*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 
   (( segid "    " and resid 1180 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4789 weight  0.10000E+01 volume  0.58200E+00 ppm1      9.045 ppm2      1.192
 ASSI (
   (( segid "    " and resid 1200 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HG2 ))
  OR 
   (( segid "    " and resid 1226 and name HB2 ))
  OR 
   (( segid "    " and resid 1215 and name HB2 ))
  OR 
   (( segid "    " and resid 1214 and name HG  ))
  OR 
   (( segid "    " and resid 1214 and name HB2 ))
  OR 
   (( segid "    " and resid 1202 and name HB1 ))
  OR 
   (( segid "    " and resid 1188 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4788 weight  0.10000E+01 volume  0.14700E+00 ppm1      9.047 ppm2      1.656
 ASSI (
   (( segid "    " and resid 1200 and name HN  ))
 )(
   (( segid "    " and resid 1198 and name HB2 ))
  OR 
   (( segid "    " and resid 1188 and name HB1 ))
  OR 
   (( segid "    " and resid 1179 and name HB  ))
 )
      6.000     6.000     0.000 peak  4787 weight  0.10000E+01 volume  0.34600E+00 ppm1      9.044 ppm2      1.788
 ASSI (
   (( segid "    " and resid 1200 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 ))
 )
      5.000     5.000     0.000 peak  4785 weight  0.10000E+01 volume  0.50600E+00 ppm1      9.044 ppm2      2.083
 ASSI (
   (( segid "    " and resid 1200 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HB1 ))
  OR 
   (( segid "    " and resid 1214 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  4786 weight  0.10000E+01 volume  0.10300E+00 ppm1      9.044 ppm2      2.233
 ASSI (
   (( segid "    " and resid 1200 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  4784 weight  0.10000E+01 volume  0.76100E+00 ppm1      9.045 ppm2      2.890
 ASSI (
   (( segid "    " and resid 1200 and name HN  ))
 )(
   (( segid "    " and resid 1199 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4783 weight  0.10000E+01 volume  0.12460E+01 ppm1      9.045 ppm2      3.124
 ASSI (
   (( segid "    " and resid 1200 and name HN  ))
 )(
   (( segid "    " and resid 1181 and name HA  ))
 )
      5.000     5.000     0.000 peak  4782 weight  0.10000E+01 volume  0.50100E+00 ppm1      9.045 ppm2      4.330
 ASSI (
   (( segid "    " and resid 1200 and name HN  ))
 )(
   (( segid "    " and resid 1200 and name HA  ))
 )
      5.000     5.000     0.000 peak  4781 weight  0.10000E+01 volume  0.69500E+00 ppm1      9.045 ppm2      4.567
 ASSI (
   (( segid "    " and resid 1200 and name HN  ))
 )(
   (( segid "    " and resid 1180 and name HA  ))
 )
      6.000     6.000     0.000 peak  4780 weight  0.10000E+01 volume  0.23500E+00 ppm1      9.047 ppm2      4.720
 ASSI (
   (( segid "    " and resid 1200 and name HN  ))
 )(
   (( segid "    " and resid 1199 and name HA  ))
 )
      3.300     3.300     0.000 peak  4779 weight  0.10000E+01 volume  0.29730E+01 ppm1      9.046 ppm2      5.253
 ASSI (
   (( segid "    " and resid 1200 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 ))
 )
      5.000     5.000     0.000 peak  4778 weight  0.10000E+01 volume  0.79800E+00 ppm1      9.045 ppm2      7.145
 ASSI (
   (( segid "    " and resid 1200 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  ))
 )
      5.000     5.000     0.000 peak  4775 weight  0.10000E+01 volume  0.69300E+00 ppm1      9.048 ppm2      8.449
 ASSI (
   (( segid "    " and resid 1200 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  4791 weight  0.10000E+01 volume  0.36600E+00 ppm1      9.044 ppm2      0.469
 ASSI (
   (( segid "    " and resid 1201 and name HN  ))
 )(
   (( segid "    " and resid 1200 and name HA  ))
 )
      2.700     2.700     0.000 peak  4762 weight  0.10000E+01 volume  0.38570E+01 ppm1      8.445 ppm2      4.570
 ASSI (
   (( segid "    " and resid 1201 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  4774 weight  0.10000E+01 volume  0.15020E+01 ppm1      8.448 ppm2      0.617
 ASSI (
   (( segid "    " and resid 1201 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 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  4773 weight  0.10000E+01 volume  0.16670E+01 ppm1      8.449 ppm2      0.763
 ASSI (
   (( segid "    " and resid 1201 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 HG2 ))
  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))
 )
      5.000     5.000     0.000 peak  4772 weight  0.10000E+01 volume  0.15750E+01 ppm1      8.450 ppm2      1.064
 ASSI (
   (( segid "    " and resid 1201 and name HN  ))
 )(
   (( segid "    " and resid 1201 and name HB2 ))
 )
      3.300     3.300     0.000 peak  4768 weight  0.10000E+01 volume  0.22370E+01 ppm1      8.447 ppm2      2.661
 ASSI (
   (( segid "    " and resid 1201 and name HN  ))
 )(
   (( segid "    " and resid 1205 and name HB1 ))
  OR 
   (( segid "    " and resid 1199 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4766 weight  0.10000E+01 volume  0.32800E+00 ppm1      8.451 ppm2      3.169
 ASSI (
   (( segid "    " and resid 1202 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))
 )
      6.000     6.000     0.000 peak  4755 weight  0.10000E+01 volume  0.18500E+00 ppm1      7.927 ppm2      0.599
 ASSI (
   (( segid "    " and resid 1202 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))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )
      5.000     5.000     0.000 peak  4754 weight  0.10000E+01 volume  0.87300E+00 ppm1      7.927 ppm2      0.722
 ASSI (
   (( segid "    " and resid 1202 and name HN  ))
 )(
   (( segid "    " and resid 1202 and name HG2 ))
  OR 
   (( segid "    " and resid 1202 and name HB2 ))
 )
      3.300     3.300     0.000 peak  4751 weight  0.10000E+01 volume  0.24380E+01 ppm1      7.927 ppm2      1.022
 ASSI (
   (( segid "    " and resid 1202 and name HN  ))
 )(
   (( 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 ))
  OR 
   (( segid "    " and resid 1178 and name HB2 ))
 )
      5.000     5.000     0.000 peak  4752 weight  0.10000E+01 volume  0.10890E+01 ppm1      7.927 ppm2      1.176
 ASSI (
   (( segid "    " and resid 1202 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  4753 weight  0.10000E+01 volume  0.33000E+00 ppm1      7.928 ppm2      1.325
 ASSI (
   (( segid "    " and resid 1202 and name HN  ))
 )(
   (( segid "    " and resid 1202 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4749 weight  0.10000E+01 volume  0.11420E+01 ppm1      7.928 ppm2      1.636
 ASSI (
   (( segid "    " and resid 1202 and name HN  ))
 )(
   (( 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  4748 weight  0.10000E+01 volume  0.44700E+00 ppm1      7.928 ppm2      1.779
 ASSI (
   (( segid "    " and resid 1202 and name HN  ))
 )(
   (( segid "    " and resid 1200 and name HB  ))
 )
      6.000     6.000     0.000 peak  4750 weight  0.10000E+01 volume  0.15100E+00 ppm1      7.929 ppm2      2.132
 ASSI (
   (( segid "    " and resid 1202 and name HN  ))
 )(
   (( segid "    " and resid 1205 and name HB2 ))
  OR 
   (( segid "    " and resid 1201 and name HB2 ))
 )
      5.000     5.000     0.000 peak  4745 weight  0.10000E+01 volume  0.94400E+00 ppm1      7.929 ppm2      2.642
 ASSI (
   (( segid "    " and resid 1202 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 ))
 )
      5.000     5.000     0.000 peak  4746 weight  0.10000E+01 volume  0.84000E+00 ppm1      7.929 ppm2      2.687
 ASSI (
   (( segid "    " and resid 1202 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 ))
 )
      6.000     6.000     0.000 peak  4747 weight  0.10000E+01 volume  0.27200E+00 ppm1      7.927 ppm2      2.825
 ASSI (
   (( segid "    " and resid 1202 and name HN  ))
 )(
   (( segid "    " and resid 1205 and name HB1 ))
  OR 
   (( segid "    " and resid 1199 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4742 weight  0.10000E+01 volume  0.38700E+00 ppm1      7.929 ppm2      3.182
 ASSI (
   (( segid "    " and resid 1202 and name HN  ))
 )(
   (( segid "    " and resid 1200 and name HN  ))
  OR 
   (( segid "    " and resid 1180 and name HN  ))
 )
      6.000     6.000     0.000 peak  5101 weight  0.10000E+01 volume  0.38200E+00 ppm1      7.927 ppm2      9.006
 ASSI (
   (( segid "    " and resid 1202 and name HN  ))
 )(
   (( segid "    " and resid 1201 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4743 weight  0.10000E+01 volume  0.61600E+00 ppm1      7.927 ppm2      3.003
 ASSI (
   (( segid "    " and resid 1202 and name HN  ))
 )(
   (( segid "    " and resid 1180 and name HN  ))
 )
      5.000     5.000     0.000 peak  4734 weight  0.10000E+01 volume  0.41300E+00 ppm1      7.926 ppm2      8.983
 ASSI (
   (( segid "    " and resid 1202 and name HN  ))
 )(
   (( segid "    " and resid 1205 and name HN  ))
  OR 
   (( segid "    " and resid 1203 and name HN  ))
 )
      5.000     5.000     0.000 peak  4720 weight  0.10000E+01 volume  0.47200E+00 ppm1      7.925 ppm2      8.292
 ASSI (
   (( segid "    " and resid 1202 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  4741 weight  0.10000E+01 volume  0.24300E+00 ppm1      7.930 ppm2      3.692
 ASSI (
   (( segid "    " and resid 1202 and name HN  ))
 )(
   (( 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  4736 weight  0.10000E+01 volume  0.45900E+00 ppm1      7.929 ppm2      6.646
 ASSI (
   (( segid "    " and resid 1203 and name HN  ))
 )(
   (( segid "    " and resid 1202 and name HG2 ))
  OR 
   (( segid "    " and resid 1202 and name HB2 ))
 )
      5.000     5.000     0.000 peak  4731 weight  0.10000E+01 volume  0.13800E+01 ppm1      8.290 ppm2      1.026
 ASSI (
   (( segid "    " and resid 1203 and name HN  ))
 )(
   (( 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  4730 weight  0.10000E+01 volume  0.99900E+00 ppm1      8.289 ppm2      1.177
 ASSI (
   (( segid "    " and resid 1203 and name HN  ))
 )(
   (( segid "    " and resid 1202 and name HD2 ))
 )
      6.000     6.000     0.000 peak  4732 weight  0.10000E+01 volume  0.15500E+00 ppm1      8.286 ppm2      1.334
 ASSI (
   (( segid "    " and resid 1203 and name HN  ))
 )(
   (( segid "    " and resid 1203 and name HG2 ))
  OR 
   (( segid "    " and resid 1202 and name HB1 ))
 )
      3.300     3.300     0.000 peak  4729 weight  0.10000E+01 volume  0.24810E+01 ppm1      8.290 ppm2      1.621
 ASSI (
   (( segid "    " and resid 1203 and name HN  ))
 )(
   (( segid "    " and resid 1203 and name HG1 ))
  OR 
   (( segid "    " and resid 1203 and name HB2 ))
 )
      2.700     2.700     0.000 peak  4728 weight  0.10000E+01 volume  0.50120E+01 ppm1      8.291 ppm2      1.747
 ASSI (
   (( segid "    " and resid 1203 and name HN  ))
 )(
   (( segid "    " and resid 1203 and name HB1 ))
 )
      2.700     2.700     0.000 peak  4727 weight  0.10000E+01 volume  0.37030E+01 ppm1      8.290 ppm2      1.854
 ASSI (
   (( segid "    " and resid 1203 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 ))
 )
      6.000     6.000     0.000 peak  4725 weight  0.10000E+01 volume  0.18900E+00 ppm1      8.290 ppm2      2.836
 ASSI (
   (( segid "    " and resid 1203 and name HN  ))
 )(
   (( segid "    " and resid 1205 and name HB1 ))
  OR 
   (( segid "    " and resid 1203 and name HD2 ))
  OR 
   (( segid "    " and resid 1203 and name HD1 ))
 )
      5.000     5.000     0.000 peak  4724 weight  0.10000E+01 volume  0.72200E+00 ppm1      8.290 ppm2      3.211
 ASSI (
   (( segid "    " and resid 1203 and name HN  ))
 )(
   (( segid "    " and resid 1203 and name HA  ))
 )
      3.300     3.300     0.000 peak  4722 weight  0.10000E+01 volume  0.20830E+01 ppm1      8.289 ppm2      4.079
 ASSI (
   (( segid "    " and resid 1203 and name HN  ))
 )(
   (( segid "    " and resid 1204 and name HA1 ))
  OR 
   (( segid "    " and resid 1184 and name HB  ))
 )
      6.000     6.000     0.000 peak  5468 weight  0.10000E+01 volume  0.29500E+00 ppm1      8.289 ppm2      4.202
 ASSI (
   (( segid "    " and resid 1203 and name HN  ))
 )(
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )
      6.000     6.000     0.000 peak  4719 weight  0.10000E+01 volume  0.26100E+00 ppm1      8.290 ppm2      6.641
 ASSI (
   (( segid "    " and resid 1203 and name HN  ))
 )(
   (( segid "    " and resid 1201 and name HN  ))
 )
      5.000     5.000     0.000 peak  4716 weight  0.10000E+01 volume  0.43400E+00 ppm1      8.291 ppm2      8.401
 ASSI (
   (( segid "    " and resid 1203 and name HN  ))
 )(
   (( segid "    " and resid 1200 and name HN  ))
  OR 
   (( segid "    " and resid 1180 and name HN  ))
 )
      6.000     6.000     0.000 peak  4715 weight  0.10000E+01 volume  0.10100E+00 ppm1      8.286 ppm2      9.022
 ASSI (
   (( segid "    " and resid 1204 and name HN  ))
 )(
   (( segid "    " and resid 1205 and name HA  ))
 )
      6.000     6.000     0.000 peak  4703 weight  0.10000E+01 volume  0.16200E+00 ppm1      8.879 ppm2      4.776
 ASSI (
   (( segid "    " and resid 1204 and name HN  ))
 )(
   (( segid "    " and resid 1206 and name HG1 ))
  OR 
   (( segid "    " and resid 1203 and name HG2 ))
  OR 
   (( segid "    " and resid 1202 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4711 weight  0.10000E+01 volume  0.71200E+00 ppm1      8.880 ppm2      1.605
 ASSI (
   (( segid "    " and resid 1204 and name HN  ))
 )(
   (( segid "    " and resid 1231 and name HB1 ))
  OR 
   (( segid "    " and resid 1203 and name HG1 ))
  OR 
   (( segid "    " and resid 1203 and name HB2 ))
 )
      5.000     5.000     0.000 peak  4712 weight  0.10000E+01 volume  0.13880E+01 ppm1      8.880 ppm2      1.742
 ASSI (
   (( segid "    " and resid 1204 and name HN  ))
 )(
   (( segid "    " and resid 1203 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4713 weight  0.10000E+01 volume  0.63700E+00 ppm1      8.880 ppm2      1.853
 ASSI (
   (( segid "    " and resid 1204 and name HN  ))
 )(
   (( segid "    " and resid 1205 and name HB2 ))
  OR 
   (( segid "    " and resid 1201 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4710 weight  0.10000E+01 volume  0.10300E+00 ppm1      8.882 ppm2      2.644
 ASSI (
   (( segid "    " and resid 1204 and name HN  ))
 )(
   (( segid "    " and resid 1205 and name HB1 ))
  OR 
   (( segid "    " and resid 1203 and name HD2 ))
  OR 
   (( segid "    " and resid 1203 and name HD1 ))
 )
      5.000     5.000     0.000 peak  4709 weight  0.10000E+01 volume  0.44200E+00 ppm1      8.881 ppm2      3.210
 ASSI (
   (( segid "    " and resid 1204 and name HN  ))
 )(
   (( segid "    " and resid 1204 and name HA2 ))
 )
      3.300     3.300     0.000 peak  4708 weight  0.10000E+01 volume  0.22270E+01 ppm1      8.878 ppm2      3.585
 ASSI (
   (( segid "    " and resid 1204 and name HN  ))
 )(
   (( segid "    " and resid 1202 and name HA  ))
  OR 
   (( segid "    " and resid 1178 and name HA  ))
 )
      6.000     6.000     0.000 peak  4707 weight  0.10000E+01 volume  0.31300E+00 ppm1      8.882 ppm2      3.954
 ASSI (
   (( segid "    " and resid 1204 and name HN  ))
 )(
   (( segid "    " and resid 1203 and name HA  ))
 )
      2.700     2.700     0.000 peak  4706 weight  0.10000E+01 volume  0.48960E+01 ppm1      8.879 ppm2      4.081
 ASSI (
   (( segid "    " and resid 1204 and name HN  ))
 )(
   (( segid "    " and resid 1204 and name HA1 ))
 )
      3.300     3.300     0.000 peak  4705 weight  0.10000E+01 volume  0.22320E+01 ppm1      8.880 ppm2      4.223
 ASSI (
   (( segid "    " and resid 1204 and name HN  ))
 )(
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )
      6.000     6.000     0.000 peak  4702 weight  0.10000E+01 volume  0.29600E+00 ppm1      8.881 ppm2      6.639
 ASSI (
   (( segid "    " and resid 1204 and name HN  ))
 )(
   (( segid "    " and resid 1205 and name HN  ))
  OR 
   (( segid "    " and resid 1203 and name HN  ))
 )
      3.300     3.300     0.000 peak  4701 weight  0.10000E+01 volume  0.27180E+01 ppm1      8.880 ppm2      8.292
 ASSI (
   (( segid "    " and resid 1206 and name HN  ))
 )(
   (( segid "    " and resid 1230 and name HG1 ))
  OR 
   (( segid "    " and resid 1178 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4699 weight  0.10000E+01 volume  0.13200E+00 ppm1      9.340 ppm2      1.184
 ASSI (
   (( segid "    " and resid 1206 and name HN  ))
 )(
   (( segid "    " and resid 1230 and name HD2 ))
  OR 
   (( 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 ))
 )
      5.000     5.000     0.000 peak  4698 weight  0.10000E+01 volume  0.99300E+00 ppm1      9.334 ppm2      1.428
 ASSI (
   (( segid "    " and resid 1206 and name HN  ))
 )(
   (( segid "    " and resid 1206 and name HG2 ))
 )
      3.300     3.300     0.000 peak  4697 weight  0.10000E+01 volume  0.18430E+01 ppm1      9.334 ppm2      1.561
 ASSI (
   (( segid "    " and resid 1206 and name HN  ))
 )(
   (( segid "    " and resid 1206 and name HG2 ))
  OR 
   (( segid "    " and resid 1206 and name HG1 ))
 )
      3.300     3.300     0.000 peak  4696 weight  0.10000E+01 volume  0.20110E+01 ppm1      9.335 ppm2      1.599
 ASSI (
   (( segid "    " and resid 1206 and name HN  ))
 )(
   (( segid "    " and resid 1206 and name HB2 ))
  OR 
   (( segid "    " and resid 1206 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4695 weight  0.10000E+01 volume  0.15120E+01 ppm1      9.337 ppm2      1.810
 ASSI (
   (( segid "    " and resid 1206 and name HN  ))
 )(
   (( segid "    " and resid 1205 and name HB2 ))
  OR 
   (( segid "    " and resid 1201 and name HB2 ))
 )
      5.000     5.000     0.000 peak  4694 weight  0.10000E+01 volume  0.16710E+01 ppm1      9.336 ppm2      2.661
 ASSI (
   (( segid "    " and resid 1206 and name HN  ))
 )(
   (( segid "    " and resid 1206 and name HD2 ))
  OR 
   (( segid "    " and resid 1206 and name HD1 ))
  OR 
   (( segid "    " and resid 1205 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4693 weight  0.10000E+01 volume  0.10650E+01 ppm1      9.338 ppm2      3.167
 ASSI (
   (( segid "    " and resid 1206 and name HN  ))
 )(
   (( segid "    " and resid 1230 and name HA  ))
  OR 
   (( segid "    " and resid 1228 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4690 weight  0.10000E+01 volume  0.12210E+01 ppm1      9.338 ppm2      3.674
 ASSI (
   (( segid "    " and resid 1206 and name HN  ))
 )(
   (( segid "    " and resid 1207 and name HA  ))
 )
      6.000     6.000     0.000 peak  4688 weight  0.10000E+01 volume  0.17000E+00 ppm1      9.337 ppm2      4.390
 ASSI (
   (( segid "    " and resid 1206 and name HN  ))
 )(
   (( segid "    " and resid 1205 and name HA  ))
 )
      2.700     2.700     0.000 peak  4687 weight  0.10000E+01 volume  0.39670E+01 ppm1      9.334 ppm2      4.781
 ASSI (
   (( segid "    " and resid 1206 and name HN  ))
 )(
   (( segid "    " and resid 1229 and name HA  ))
  OR 
   (( segid "    " and resid 1206 and name HA  ))
 )
      5.000     5.000     0.000 peak  4686 weight  0.10000E+01 volume  0.15500E+01 ppm1      9.337 ppm2      4.946
 ASSI (
   (( segid "    " and resid 1206 and name HN  ))
 )(
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )
      5.000     5.000     0.000 peak  4684 weight  0.10000E+01 volume  0.81200E+00 ppm1      9.337 ppm2      6.637
 ASSI (
   (( segid "    " and resid 1206 and name HN  ))
 )(
   (( segid "    " and resid 1230 and name HG2 ))
 )
      6.000     6.000     0.000 peak  4700 weight  0.10000E+01 volume  0.94000E-01 ppm1      9.342 ppm2      1.069
 ASSI (
   (( segid "    " and resid 1206 and name HN  ))
 )(
   (( segid "    " and resid 1231 and name HA  ))
 )
      6.000     6.000     0.000 peak  4689 weight  0.10000E+01 volume  0.14700E+00 ppm1      9.329 ppm2      3.978
 ASSI (
   (( segid "    " and resid 1207 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HA  ))
  OR 
   (( segid "    " and resid 1208 and name HA  ))
 )
      6.000     6.000     0.000 peak  4668 weight  0.10000E+01 volume  0.17700E+00 ppm1      8.756 ppm2      4.493
 ASSI (
   (( segid "    " and resid 1207 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 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  4677 weight  0.10000E+01 volume  0.16100E+00 ppm1      8.756 ppm2      0.678
 ASSI (
   (( segid "    " and resid 1207 and name HN  ))
 )(
   (( 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  4676 weight  0.10000E+01 volume  0.13940E+01 ppm1      8.756 ppm2      0.827
 ASSI (
   (( segid "    " and resid 1207 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))
 )
      6.000     6.000     0.000 peak  4674 weight  0.10000E+01 volume  0.17500E+00 ppm1      8.756 ppm2      1.070
 ASSI (
   (( segid "    " and resid 1207 and name HN  ))
 )(
   (( segid "    " and resid 1207 and name HB2 ))
 )
      2.700     2.700     0.000 peak  4671 weight  0.10000E+01 volume  0.41870E+01 ppm1      8.754 ppm2      1.441
 ASSI (
   (( segid "    " and resid 1207 and name HN  ))
 )(
   (( segid "    " and resid 1206 and name HG2 ))
  OR 
   (( segid "    " and resid 1206 and name HG1 ))
 )
      5.000     5.000     0.000 peak  4672 weight  0.10000E+01 volume  0.14210E+01 ppm1      8.756 ppm2      1.569
 ASSI (
   (( segid "    " and resid 1207 and name HN  ))
 )(
   (( 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 ))
 )
      2.700     2.700     0.000 peak  4673 weight  0.10000E+01 volume  0.63590E+01 ppm1      8.754 ppm2      1.792
 ASSI (
   (( segid "    " and resid 1207 and name HN  ))
 )(
   (( segid "    " and resid 1205 and name HB2 ))
  OR 
   (( segid "    " and resid 1201 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4670 weight  0.10000E+01 volume  0.23600E+00 ppm1      8.756 ppm2      2.659
 ASSI (
   (( segid "    " and resid 1207 and name HN  ))
 )(
   (( segid "    " and resid 1206 and name HD2 ))
  OR 
   (( segid "    " and resid 1206 and name HD1 ))
 )
      5.000     5.000     0.000 peak  4669 weight  0.10000E+01 volume  0.44400E+00 ppm1      8.755 ppm2      3.137
 ASSI (
   (( segid "    " and resid 1207 and name HN  ))
 )(
   (( segid "    " and resid 1205 and name HA  ))
 )
      6.000     6.000     0.000 peak  4678 weight  0.10000E+01 volume  0.29700E+00 ppm1      8.756 ppm2      4.810
 ASSI (
   (( segid "    " and resid 1207 and name HN  ))
 )(
   (( segid "    " and resid 1206 and name HA  ))
 )
      2.700     2.700     0.000 peak  4666 weight  0.10000E+01 volume  0.61110E+01 ppm1      8.755 ppm2      4.945
 ASSI (
   (( segid "    " and resid 1208 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 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  4660 weight  0.10000E+01 volume  0.25300E+00 ppm1      8.899 ppm2      0.667
 ASSI (
   (( segid "    " and resid 1208 and name HN  ))
 )(
   (( 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  4658 weight  0.10000E+01 volume  0.62200E+00 ppm1      8.900 ppm2      0.823
 ASSI (
   (( segid "    " and resid 1208 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))
 )
      3.300     3.300     0.000 peak  4657 weight  0.10000E+01 volume  0.17930E+01 ppm1      8.900 ppm2      0.930
 ASSI (
   (( segid "    " and resid 1208 and name HN  ))
 )(
   (( 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 ))
 )
      5.000     5.000     0.000 peak  4661 weight  0.10000E+01 volume  0.10550E+01 ppm1      8.897 ppm2      1.441
 ASSI (
   (( segid "    " and resid 1208 and name HN  ))
 )(
   (( segid "    " and resid 1210 and name HG2 ))
  OR 
   (( segid "    " and resid 1210 and name HG1 ))
  OR 
   (( segid "    " and resid 1206 and name HG2 ))
 )
      6.000     6.000     0.000 peak  4655 weight  0.10000E+01 volume  0.21000E+00 ppm1      8.900 ppm2      1.557
 ASSI (
   (( segid "    " and resid 1208 and name HN  ))
 )(
   (( segid "    " and resid 1207 and name HG  ))
  OR 
   (( segid "    " and resid 1207 and name HB1 ))
  OR 
   (( segid "    " and resid 1206 and name HB2 ))
 )
      5.000     5.000     0.000 peak  4654 weight  0.10000E+01 volume  0.14400E+01 ppm1      8.900 ppm2      1.780
 ASSI (
   (( segid "    " and resid 1208 and name HN  ))
 )(
   (( segid "    " and resid 1228 and name HB1 ))
  OR 
   (( segid "    " and resid 1227 and name HB  ))
  OR 
   (( segid "    " and resid 1208 and name HB2 ))
 )
      3.300     3.300     0.000 peak  4652 weight  0.10000E+01 volume  0.18310E+01 ppm1      8.897 ppm2      3.663
 ASSI (
   (( segid "    " and resid 1208 and name HN  ))
 )(
   (( segid "    " and resid 1228 and name HB1 ))
  OR 
   (( segid "    " and resid 1227 and name HB  ))
  OR 
   (( segid "    " and resid 1211 and name HB2 ))
 )
      5.000     5.000     0.000 peak  4651 weight  0.10000E+01 volume  0.65800E+00 ppm1      8.897 ppm2      3.735
 ASSI (
   (( segid "    " and resid 1208 and name HN  ))
 )(
   (( segid "    " and resid 1211 and name HB1 ))
  OR 
   (( segid "    " and resid 1208 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4649 weight  0.10000E+01 volume  0.16340E+01 ppm1      8.897 ppm2      3.911
 ASSI (
   (( segid "    " and resid 1208 and name HN  ))
 )(
   (( segid "    " and resid 1211 and name HB1 ))
  OR 
   (( segid "    " and resid 1209 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4650 weight  0.10000E+01 volume  0.32000E+00 ppm1      8.897 ppm2      3.993
 ASSI (
   (( segid "    " and resid 1208 and name HN  ))
 )(
   (( segid "    " and resid 1210 and name HA  ))
  OR 
   (( segid "    " and resid 1209 and name HA  ))
 )
      6.000     6.000     0.000 peak  4648 weight  0.10000E+01 volume  0.30100E+00 ppm1      8.898 ppm2      4.273
 ASSI (
   (( segid "    " and resid 1208 and name HN  ))
 )(
   (( segid "    " and resid 1207 and name HA  ))
 )
      2.700     2.700     0.000 peak  4646 weight  0.10000E+01 volume  0.32310E+01 ppm1      8.896 ppm2      4.394
 ASSI (
   (( segid "    " and resid 1208 and name HN  ))
 )(
   (( segid "    " and resid 1229 and name HA  ))
  OR 
   (( segid "    " and resid 1206 and name HA  ))
 )
      6.000     6.000     0.000 peak  4644 weight  0.10000E+01 volume  0.24500E+00 ppm1      8.901 ppm2      4.953
 ASSI (
   (( segid "    " and resid 1208 and name HN  ))
 )(
   (( segid "    " and resid 1211 and name HN  ))
 )
      6.000     6.000     0.000 peak  4642 weight  0.10000E+01 volume  0.13000E+00 ppm1      8.894 ppm2      7.580
 ASSI (
   (( segid "    " and resid 1208 and name HN  ))
 )(
   (( segid "    " and resid 1227 and name HN  ))
 )
      6.000     6.000     0.000 peak  4641 weight  0.10000E+01 volume  0.11200E+00 ppm1      8.898 ppm2      7.941
 ASSI (
   (( segid "    " and resid 1208 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 ))
 )
      6.000     6.000     0.000 peak  4653 weight  0.10000E+01 volume  0.25900E+00 ppm1      8.900 ppm2      2.692
 ASSI (
   (( segid "    " and resid 1209 and name HN  ))
 )(
   (( segid "    " and resid 1207 and name HN  ))
 )
      6.000     6.000     0.000 peak  4623 weight  0.10000E+01 volume  0.11400E+00 ppm1      8.404 ppm2      8.761
 ASSI (
   (( segid "    " and resid 1209 and name HN  ))
 )(
   (( segid "    " and resid 1227 and name HN  ))
 )
      6.000     6.000     0.000 peak  4624 weight  0.10000E+01 volume  0.16500E+00 ppm1      8.411 ppm2      7.940
 ASSI (
   (( segid "    " and resid 1209 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))
 )
      6.000     6.000     0.000 peak  4637 weight  0.10000E+01 volume  0.24900E+00 ppm1      8.403 ppm2      0.932
 ASSI (
   (( segid "    " and resid 1209 and name HN  ))
 )(
   (( 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  4636 weight  0.10000E+01 volume  0.21300E+00 ppm1      8.404 ppm2      1.431
 ASSI (
   (( segid "    " and resid 1209 and name HN  ))
 )(
   (( segid "    " and resid 1210 and name HG2 ))
  OR 
   (( segid "    " and resid 1210 and name HG1 ))
  OR 
   (( segid "    " and resid 1206 and name HG2 ))
 )
      6.000     6.000     0.000 peak  4635 weight  0.10000E+01 volume  0.17100E+00 ppm1      8.404 ppm2      1.563
 ASSI (
   (( segid "    " and resid 1209 and name HN  ))
 )(
   (( segid "    " and resid 1210 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4634 weight  0.10000E+01 volume  0.10900E+00 ppm1      8.403 ppm2      1.692
 ASSI (
   (( segid "    " and resid 1209 and name HN  ))
 )(
   (( segid "    " and resid 1209 and name HB2 ))
  OR 
   (( segid "    " and resid 1208 and name HB1 ))
 )
      3.300     3.300     0.000 peak  4630 weight  0.10000E+01 volume  0.23350E+01 ppm1      8.404 ppm2      3.906
 ASSI (
   (( segid "    " and resid 1209 and name HN  ))
 )(
   (( segid "    " and resid 1209 and name HB2 ))
  OR 
   (( segid "    " and resid 1209 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4631 weight  0.10000E+01 volume  0.15940E+01 ppm1      8.402 ppm2      3.973
 ASSI (
   (( segid "    " and resid 1209 and name HN  ))
 )(
   (( segid "    " and resid 1208 and name HA  ))
  OR 
   (( segid "    " and resid 1207 and name HA  ))
 )
      3.300     3.300     0.000 peak  4628 weight  0.10000E+01 volume  0.22490E+01 ppm1      8.402 ppm2      4.457
 ASSI (
   (( segid "    " and resid 1209 and name HN  ))
 )(
   (( segid "    " and resid 1211 and name HN  ))
 )
      6.000     6.000     0.000 peak  4625 weight  0.10000E+01 volume  0.11200E+00 ppm1      8.403 ppm2      7.556
 ASSI (
   (( segid "    " and resid 1209 and name HN  ))
 )(
   (( segid "    " and resid 1208 and name HB2 ))
 )
      5.000     5.000     0.000 peak  4632 weight  0.10000E+01 volume  0.67400E+00 ppm1      8.405 ppm2      3.656
 ASSI (
   (( segid "    " and resid 1209 and name HN  ))
 )(
   (( segid "    " and resid 1207 and name HG  ))
  OR 
   (( segid "    " and resid 1207 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4633 weight  0.10000E+01 volume  0.43700E+00 ppm1      8.403 ppm2      1.790
 ASSI (
   (( segid "    " and resid 1210 and name HN  ))
 )(
   (( segid "    " and resid 1210 and name HD2 ))
  OR 
   (( segid "    " and resid 1210 and name HD1 ))
 )
      6.000     6.000     0.000 peak  4618 weight  0.10000E+01 volume  0.31600E+00 ppm1      8.063 ppm2      3.148
 ASSI (
   (( segid "    " and resid 1210 and name HN  ))
 )(
   (( segid "    " and resid 1210 and name HG2 ))
  OR 
   (( segid "    " and resid 1210 and name HG1 ))
 )
      3.300     3.300     0.000 peak  4621 weight  0.10000E+01 volume  0.17560E+01 ppm1      8.061 ppm2      1.571
 ASSI (
   (( segid "    " and resid 1210 and name HN  ))
 )(
   (( segid "    " and resid 1210 and name HB2 ))
 )
      3.300     3.300     0.000 peak  4620 weight  0.10000E+01 volume  0.18760E+01 ppm1      8.062 ppm2      1.686
 ASSI (
   (( segid "    " and resid 1210 and name HN  ))
 )(
   (( segid "    " and resid 1210 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4619 weight  0.10000E+01 volume  0.12380E+01 ppm1      8.061 ppm2      1.921
 ASSI (
   (( segid "    " and resid 1210 and name HN  ))
 )(
   (( segid "    " and resid 1227 and name HB  ))
  OR 
   (( segid "    " and resid 1208 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4614 weight  0.10000E+01 volume  0.31500E+00 ppm1      8.061 ppm2      3.660
 ASSI (
   (( segid "    " and resid 1210 and name HN  ))
 )(
   (( segid "    " and resid 1211 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4615 weight  0.10000E+01 volume  0.15800E+00 ppm1      8.063 ppm2      3.756
 ASSI (
   (( segid "    " and resid 1210 and name HN  ))
 )(
   (( segid "    " and resid 1211 and name HB1 ))
  OR 
   (( segid "    " and resid 1209 and name HB2 ))
  OR 
   (( segid "    " and resid 1208 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4616 weight  0.10000E+01 volume  0.12260E+01 ppm1      8.061 ppm2      3.919
 ASSI (
   (( segid "    " and resid 1210 and name HN  ))
 )(
   (( segid "    " and resid 1209 and name HB2 ))
  OR 
   (( segid "    " and resid 1209 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4617 weight  0.10000E+01 volume  0.11200E+01 ppm1      8.062 ppm2      3.982
 ASSI (
   (( segid "    " and resid 1210 and name HN  ))
 )(
   (( segid "    " and resid 1210 and name HA  ))
  OR 
   (( segid "    " and resid 1209 and name HA  ))
 )
      2.700     2.700     0.000 peak  4613 weight  0.10000E+01 volume  0.44000E+01 ppm1      8.060 ppm2      4.263
 ASSI (
   (( segid "    " and resid 1210 and name HN  ))
 )(
   (( segid "    " and resid 1213 and name HA  ))
  OR 
   (( segid "    " and resid 1211 and name HA  ))
  OR 
   (( segid "    " and resid 1207 and name HA  ))
 )
      5.000     5.000     0.000 peak  4612 weight  0.10000E+01 volume  0.40300E+00 ppm1      8.059 ppm2      4.377
 ASSI (
   (( segid "    " and resid 1210 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HA  ))
  OR 
   (( segid "    " and resid 1208 and name HA  ))
 )
      5.000     5.000     0.000 peak  4611 weight  0.10000E+01 volume  0.44900E+00 ppm1      8.061 ppm2      4.477
 ASSI (
   (( segid "    " and resid 1211 and name HN  ))
 )(
   (( segid "    " and resid 1210 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4589 weight  0.10000E+01 volume  0.49200E+00 ppm1      7.560 ppm2      1.920
 ASSI (
   (( segid "    " and resid 1211 and name HN  ))
 )(
   (( 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  4606 weight  0.10000E+01 volume  0.12800E+00 ppm1      7.560 ppm2      0.822
 ASSI (
   (( segid "    " and resid 1211 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))
 )
      6.000     6.000     0.000 peak  4605 weight  0.10000E+01 volume  0.98000E-01 ppm1      7.561 ppm2      0.933
 ASSI (
   (( segid "    " and resid 1211 and name HN  ))
 )(
   (( segid "    " and resid 1210 and name HG2 ))
  OR 
   (( segid "    " and resid 1210 and name HG1 ))
 )
      6.000     6.000     0.000 peak  4603 weight  0.10000E+01 volume  0.39600E+00 ppm1      7.563 ppm2      1.571
 ASSI (
   (( segid "    " and resid 1211 and name HN  ))
 )(
   (( segid "    " and resid 1210 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4602 weight  0.10000E+01 volume  0.39400E+00 ppm1      7.563 ppm2      1.693
 ASSI (
   (( segid "    " and resid 1211 and name HN  ))
 )(
   (( segid "    " and resid 1212 and name HB1 ))
  OR 
   (( segid "    " and resid 1210 and name HD2 ))
  OR 
   (( segid "    " and resid 1210 and name HD1 ))
 )
      6.000     6.000     0.000 peak  4601 weight  0.10000E+01 volume  0.11300E+00 ppm1      7.562 ppm2      3.163
 ASSI (
   (( segid "    " and resid 1211 and name HN  ))
 )(
   (( segid "    " and resid 1227 and name HB  ))
  OR 
   (( segid "    " and resid 1208 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4600 weight  0.10000E+01 volume  0.38500E+00 ppm1      7.564 ppm2      3.672
 ASSI (
   (( segid "    " and resid 1211 and name HN  ))
 )(
   (( segid "    " and resid 1211 and name HB1 ))
  OR 
   (( segid "    " and resid 1209 and name HB2 ))
  OR 
   (( segid "    " and resid 1208 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4598 weight  0.10000E+01 volume  0.10410E+01 ppm1      7.564 ppm2      3.922
 ASSI (
   (( segid "    " and resid 1211 and name HN  ))
 )(
   (( segid "    " and resid 1210 and name HA  ))
  OR 
   (( segid "    " and resid 1209 and name HA  ))
 )
      3.300     3.300     0.000 peak  4596 weight  0.10000E+01 volume  0.19460E+01 ppm1      7.563 ppm2      4.267
 ASSI (
   (( segid "    " and resid 1211 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HA  ))
  OR 
   (( segid "    " and resid 1213 and name HB  ))
  OR 
   (( segid "    " and resid 1208 and name HA  ))
 )
      6.000     6.000     0.000 peak  4595 weight  0.10000E+01 volume  0.21500E+00 ppm1      7.565 ppm2      4.482
 ASSI (
   (( segid "    " and resid 1211 and name HN  ))
 )(
   (( segid "    " and resid 1207 and name HG  ))
  OR 
   (( segid "    " and resid 1207 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4604 weight  0.10000E+01 volume  0.15500E+00 ppm1      7.557 ppm2      1.787
 ASSI (
   (( segid "    " and resid 1212 and name HN  ))
 )(
   (( 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  4588 weight  0.10000E+01 volume  0.16900E+00 ppm1      8.558 ppm2      0.809
 ASSI (
   (( segid "    " and resid 1212 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))
 )
      6.000     6.000     0.000 peak  4587 weight  0.10000E+01 volume  0.20300E+00 ppm1      8.560 ppm2      1.222
 ASSI (
   (( segid "    " and resid 1212 and name HN  ))
 )(
   (( segid "    " and resid 1212 and name HB2 ))
 )
      5.000     5.000     0.000 peak  4586 weight  0.10000E+01 volume  0.12250E+01 ppm1      8.558 ppm2      3.036
 ASSI (
   (( segid "    " and resid 1212 and name HN  ))
 )(
   (( segid "    " and resid 1212 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4585 weight  0.10000E+01 volume  0.15510E+01 ppm1      8.558 ppm2      3.191
 ASSI (
   (( segid "    " and resid 1212 and name HN  ))
 )(
   (( segid "    " and resid 1211 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4584 weight  0.10000E+01 volume  0.27500E+00 ppm1      8.558 ppm2      3.764
 ASSI (
   (( segid "    " and resid 1212 and name HN  ))
 )(
   (( segid "    " and resid 1211 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4583 weight  0.10000E+01 volume  0.53500E+00 ppm1      8.558 ppm2      3.934
 ASSI (
   (( segid "    " and resid 1212 and name HN  ))
 )(
   (( segid "    " and resid 1211 and name HA  ))
 )
      3.300     3.300     0.000 peak  4580 weight  0.10000E+01 volume  0.22100E+01 ppm1      8.559 ppm2      4.325
 ASSI (
   (( segid "    " and resid 1214 and name HN  ))
 )(
   (( 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  4556 weight  0.10000E+01 volume  0.71500E+00 ppm1      8.373 ppm2      0.823
 ASSI (
   (( segid "    " and resid 1214 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  4555 weight  0.10000E+01 volume  0.59500E+00 ppm1      8.374 ppm2      0.931
 ASSI (
   (( segid "    " and resid 1214 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))
 )
      3.300     3.300     0.000 peak  4554 weight  0.10000E+01 volume  0.18180E+01 ppm1      8.373 ppm2      1.067
 ASSI (
   (( segid "    " and resid 1214 and name HN  ))
 )(
   (( 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  4552 weight  0.10000E+01 volume  0.30100E+00 ppm1      8.374 ppm2      2.095
 ASSI (
   (( segid "    " and resid 1214 and name HN  ))
 )(
   (( segid "    " and resid 1214 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4551 weight  0.10000E+01 volume  0.14660E+01 ppm1      8.374 ppm2      2.225
 ASSI (
   (( segid "    " and resid 1214 and name HN  ))
 )(
   (( segid "    " and resid 1213 and name HA  ))
 )
      2.700     2.700     0.000 peak  4549 weight  0.10000E+01 volume  0.32550E+01 ppm1      8.375 ppm2      4.390
 ASSI (
   (( segid "    " and resid 1214 and name HN  ))
 )(
   (( segid "    " and resid 1213 and name HB  ))
 )
      3.300     3.300     0.000 peak  4548 weight  0.10000E+01 volume  0.19100E+01 ppm1      8.375 ppm2      4.489
 ASSI (
   (( segid "    " and resid 1215 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))
 )
      6.000     6.000     0.000 peak  4542 weight  0.10000E+01 volume  0.17800E+00 ppm1      7.698 ppm2      0.920
 ASSI (
   (( segid "    " and resid 1215 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))
 )
      5.000     5.000     0.000 peak  4544 weight  0.10000E+01 volume  0.54000E+00 ppm1      7.698 ppm2      0.658
 ASSI (
   (( segid "    " and resid 1215 and name HN  ))
 )(
   (( segid "    " and resid 1207 and name HD13))
  OR 
   (( segid "    " and resid 1207 and name HD12))
  OR 
   (( segid "    " and resid 1207 and name HD11))
  OR 
   (( segid "    " and resid 1200 and name HG13))
  OR 
   (( segid "    " and resid 1200 and name HG12))
  OR 
   (( segid "    " and resid 1200 and name HG11))
 )
      6.000     6.000     0.000 peak  4543 weight  0.10000E+01 volume  0.13900E+00 ppm1      7.698 ppm2      0.822
 ASSI (
   (( segid "    " and resid 1215 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))
 )
      5.000     5.000     0.000 peak  4541 weight  0.10000E+01 volume  0.78500E+00 ppm1      7.697 ppm2      1.070
 ASSI (
   (( segid "    " and resid 1215 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))
 )
      5.000     5.000     0.000 peak  4540 weight  0.10000E+01 volume  0.13250E+01 ppm1      7.697 ppm2      1.219
 ASSI (
   (( segid "    " and resid 1215 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  4539 weight  0.10000E+01 volume  0.10810E+01 ppm1      7.697 ppm2      1.425
 ASSI (
   (( segid "    " and resid 1215 and name HN  ))
 )(
   (( segid "    " and resid 1215 and name HB2 ))
  OR 
   (( segid "    " and resid 1214 and name HG  ))
  OR 
   (( segid "    " and resid 1214 and name HB2 ))
 )
      3.300     3.300     0.000 peak  4534 weight  0.10000E+01 volume  0.31320E+01 ppm1      7.697 ppm2      1.654
 ASSI (
   (( segid "    " and resid 1215 and name HN  ))
 )(
   (( segid "    " and resid 1215 and name HB1 ))
 )
      2.700     2.700     0.000 peak  4535 weight  0.10000E+01 volume  0.32940E+01 ppm1      7.699 ppm2      1.758
 ASSI (
   (( segid "    " and resid 1215 and name HN  ))
 )(
   (( segid "    " and resid 1198 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4536 weight  0.10000E+01 volume  0.24900E+00 ppm1      7.697 ppm2      1.882
 ASSI (
   (( segid "    " and resid 1215 and name HN  ))
 )(
   (( 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  4538 weight  0.10000E+01 volume  0.29300E+00 ppm1      7.697 ppm2      2.026
 ASSI (
   (( segid "    " and resid 1215 and name HN  ))
 )(
   (( segid "    " and resid 1214 and name HB1 ))
  OR 
   (( segid "    " and resid 1198 and name HG1 ))
 )
      5.000     5.000     0.000 peak  4537 weight  0.10000E+01 volume  0.60200E+00 ppm1      7.696 ppm2      2.214
 ASSI (
   (( segid "    " and resid 1215 and name HN  ))
 )(
   (( segid "    " and resid 1215 and name HD2 ))
  OR 
   (( segid "    " and resid 1215 and name HD1 ))
  OR 
   (( segid "    " and resid 1212 and name HB1 ))
  OR 
   (( segid "    " and resid 1199 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4533 weight  0.10000E+01 volume  0.52400E+00 ppm1      7.698 ppm2      3.158
 ASSI (
   (( segid "    " and resid 1215 and name HN  ))
 )(
   (( segid "    " and resid 1213 and name HA  ))
 )
      5.000     5.000     0.000 peak  4531 weight  0.10000E+01 volume  0.76500E+00 ppm1      7.697 ppm2      4.388
 ASSI (
   (( segid "    " and resid 1215 and name HN  ))
 )(
   (( segid "    " and resid 1198 and name HA  ))
 )
      6.000     6.000     0.000 peak  4529 weight  0.10000E+01 volume  0.29300E+00 ppm1      7.698 ppm2      4.762
 ASSI (
   (( segid "    " and resid 1215 and name HN  ))
 )(
   (( segid "    " and resid 1215 and name HA  ))
 )
      5.000     5.000     0.000 peak  4527 weight  0.10000E+01 volume  0.14010E+01 ppm1      7.697 ppm2      5.255
 ASSI (
   (( segid "    " and resid 1216 and name HN  ))
 )(
   (( segid "    " and resid 1198 and name HN  ))
 )
      6.000     6.000     0.000 peak  4502 weight  0.10000E+01 volume  0.11700E+00 ppm1      8.740 ppm2      7.968
 ASSI (
   (( segid "    " and resid 1216 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HB1 ))
  OR 
   (( segid "    " and resid 1213 and name HG23))
  OR 
   (( segid "    " and resid 1213 and name HG22))
  OR 
   (( segid "    " and resid 1213 and name HG21))
 )
      6.000     6.000     0.000 peak  4524 weight  0.10000E+01 volume  0.11800E+00 ppm1      8.735 ppm2      1.244
 ASSI (
   (( segid "    " and resid 1216 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  4523 weight  0.10000E+01 volume  0.22100E+00 ppm1      8.741 ppm2      0.126
 ASSI (
   (( segid "    " and resid 1216 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))
 )
      6.000     6.000     0.000 peak  4522 weight  0.10000E+01 volume  0.34900E+00 ppm1      8.739 ppm2      0.619
 ASSI (
   (( segid "    " and resid 1216 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))
 )
      3.300     3.300     0.000 peak  4521 weight  0.10000E+01 volume  0.27850E+01 ppm1      8.741 ppm2      1.113
 ASSI (
   (( segid "    " and resid 1216 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 ))
 )
      5.000     5.000     0.000 peak  4519 weight  0.10000E+01 volume  0.98800E+00 ppm1      8.741 ppm2      1.657
 ASSI (
   (( segid "    " and resid 1216 and name HN  ))
 )(
   (( segid "    " and resid 1215 and name HB1 ))
  OR 
   (( segid "    " and resid 1198 and name HB2 ))
 )
      5.000     5.000     0.000 peak  4518 weight  0.10000E+01 volume  0.96000E+00 ppm1      8.740 ppm2      1.766
 ASSI (
   (( segid "    " and resid 1216 and name HN  ))
 )(
   (( segid "    " and resid 1198 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4517 weight  0.10000E+01 volume  0.26700E+00 ppm1      8.740 ppm2      1.890
 ASSI (
   (( segid "    " and resid 1216 and name HN  ))
 )(
   (( 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  4515 weight  0.10000E+01 volume  0.29500E+00 ppm1      8.738 ppm2      2.036
 ASSI (
   (( segid "    " and resid 1216 and name HN  ))
 )(
   (( segid "    " and resid 1224 and name HG1 ))
  OR 
   (( segid "    " and resid 1198 and name HG1 ))
  OR 
   (( segid "    " and resid 1195 and name HB2 ))
  OR 
   (( segid "    " and resid 1195 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4516 weight  0.10000E+01 volume  0.37700E+00 ppm1      8.741 ppm2      2.157
 ASSI (
   (( segid "    " and resid 1216 and name HN  ))
 )(
   (( segid "    " and resid 1215 and name HD2 ))
  OR 
   (( segid "    " and resid 1215 and name HD1 ))
  OR 
   (( segid "    " and resid 1199 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4514 weight  0.10000E+01 volume  0.48600E+00 ppm1      8.740 ppm2      3.151
 ASSI (
   (( segid "    " and resid 1216 and name HN  ))
 )(
   (( segid "    " and resid 1196 and name HB2 ))
  OR 
   (( segid "    " and resid 1196 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4513 weight  0.10000E+01 volume  0.60000E+00 ppm1      8.740 ppm2      3.635
 ASSI (
   (( segid "    " and resid 1216 and name HN  ))
 )(
   (( segid "    " and resid 1216 and name HB  ))
  OR 
   (( segid "    " and resid 1197 and name HA  ))
 )
      5.000     5.000     0.000 peak  4512 weight  0.10000E+01 volume  0.86400E+00 ppm1      8.741 ppm2      4.034
 ASSI (
   (( segid "    " and resid 1216 and name HN  ))
 )(
   (( segid "    " and resid 1217 and name HA  ))
  OR 
   (( segid "    " and resid 1198 and name HA  ))
 )
      5.000     5.000     0.000 peak  4509 weight  0.10000E+01 volume  0.16830E+01 ppm1      8.741 ppm2      4.767
 ASSI (
   (( segid "    " and resid 1216 and name HN  ))
 )(
   (( segid "    " and resid 1196 and name HA  ))
 )
      5.000     5.000     0.000 peak  4506 weight  0.10000E+01 volume  0.83200E+00 ppm1      8.741 ppm2      5.134
 ASSI (
   (( segid "    " and resid 1216 and name HN  ))
 )(
   (( segid "    " and resid 1215 and name HA  ))
 )
      2.700     2.700     0.000 peak  4508 weight  0.10000E+01 volume  0.67200E+01 ppm1      8.740 ppm2      5.254
 ASSI (
   (( segid "    " and resid 1216 and name HN  ))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HD2 ))
 )
      5.000     5.000     0.000 peak  4505 weight  0.10000E+01 volume  0.62200E+00 ppm1      8.742 ppm2      7.148
 ASSI (
   (( segid "    " and resid 1217 and name HN  ))
 )(
   (( segid "    " and resid 1217 and name HB  ))
 )
      2.700     2.700     0.000 peak  4487 weight  0.10000E+01 volume  0.38990E+01 ppm1      8.244 ppm2      3.874
 ASSI (
   (( segid "    " and resid 1217 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))
 )
      6.000     6.000     0.000 peak  4489 weight  0.10000E+01 volume  0.16800E+00 ppm1      8.246 ppm2      0.392
 ASSI (
   (( segid "    " and resid 1217 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  4488 weight  0.10000E+01 volume  0.28200E+00 ppm1      8.245 ppm2      0.506
 ASSI (
   (( segid "    " and resid 1217 and name HN  ))
 )(
   (( segid "    " and resid 1216 and name HB  ))
 )
      3.300     3.300     0.000 peak  4492 weight  0.10000E+01 volume  0.20500E+01 ppm1      8.243 ppm2      4.035
 ASSI (
   (( segid "    " and resid 1218 and name HN  ))
 )(
   (( segid "    " and resid 1219 and name HN  ))
  OR 
   (( segid "    " and resid 1197 and name HN  ))
 )
      5.000     5.000     0.000 peak  4471 weight  0.10000E+01 volume  0.65300E+00 ppm1      8.280 ppm2      8.932
 ASSI (
   (( segid "    " and resid 1218 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))
 )
      6.000     6.000     0.000 peak  4484 weight  0.10000E+01 volume  0.20300E+00 ppm1      8.284 ppm2      0.392
 ASSI (
   (( segid "    " and resid 1218 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  4485 weight  0.10000E+01 volume  0.30100E+00 ppm1      8.285 ppm2      0.511
 ASSI (
   (( segid "    " and resid 1218 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))
 )
      6.000     6.000     0.000 peak  4486 weight  0.10000E+01 volume  0.25000E+00 ppm1      8.286 ppm2      0.621
 ASSI (
   (( segid "    " and resid 1218 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  4483 weight  0.10000E+01 volume  0.15370E+01 ppm1      8.285 ppm2      1.032
 ASSI (
   (( segid "    " and resid 1218 and name HN  ))
 )(
   (( segid "    " and resid 1195 and name HB2 ))
  OR 
   (( segid "    " and resid 1195 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4482 weight  0.10000E+01 volume  0.16200E+00 ppm1      8.284 ppm2      2.114
 ASSI (
   (( segid "    " and resid 1218 and name HN  ))
 )(
   (( segid "    " and resid 1167 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4481 weight  0.10000E+01 volume  0.27800E+00 ppm1      8.285 ppm2      2.694
 ASSI (
   (( segid "    " and resid 1218 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  4479 weight  0.10000E+01 volume  0.10720E+01 ppm1      8.283 ppm2      3.070
 ASSI (
   (( segid "    " and resid 1218 and name HN  ))
 )(
   (( 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  4478 weight  0.10000E+01 volume  0.43800E+00 ppm1      8.284 ppm2      3.645
 ASSI (
   (( segid "    " and resid 1218 and name HN  ))
 )(
   (( segid "    " and resid 1217 and name HB  ))
 )
      6.000     6.000     0.000 peak  4477 weight  0.10000E+01 volume  0.30900E+00 ppm1      8.285 ppm2      3.877
 ASSI (
   (( segid "    " and resid 1218 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HA  ))
  OR 
   (( segid "    " and resid 1195 and name HA  ))
  OR 
   (( segid "    " and resid 1194 and name HA1 ))
 )
      6.000     6.000     0.000 peak  4476 weight  0.10000E+01 volume  0.35000E-01 ppm1      8.283 ppm2      4.439
 ASSI (
   (( segid "    " and resid 1218 and name HN  ))
 )(
   (( segid "    " and resid 1196 and name HA  ))
 )
      5.000     5.000     0.000 peak  4473 weight  0.10000E+01 volume  0.88400E+00 ppm1      8.285 ppm2      5.129
 ASSI (
   (( segid "    " and resid 1219 and name HN  ))
 )(
   (( segid "    " and resid 1196 and name HB1 ))
  OR 
   (( segid "    " and resid 1194 and name HA2 ))
  OR 
   (( segid "    " and resid 1193 and name HB  ))
 )
      6.000     6.000     0.000 peak  4459 weight  0.10000E+01 volume  0.14700E+00 ppm1      8.919 ppm2      3.609
 ASSI (
   (( segid "    " and resid 1219 and name HN  ))
 )(
   (( segid "    " and resid 1219 and name HD1 ))
 )
      6.000     6.000     0.000 peak  4465 weight  0.10000E+01 volume  0.21600E+00 ppm1      8.933 ppm2      7.155
 ASSI (
   (( segid "    " and resid 1219 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))
 )
      5.000     5.000     0.000 peak  4446 weight  0.10000E+01 volume  0.94000E+00 ppm1      8.927 ppm2      0.379
 ASSI (
   (( segid "    " and resid 1219 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))
 )
      5.000     5.000     0.000 peak  4447 weight  0.10000E+01 volume  0.70900E+00 ppm1      8.926 ppm2      0.508
 ASSI (
   (( segid "    " and resid 1219 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  4448 weight  0.10000E+01 volume  0.14100E+00 ppm1      8.928 ppm2      0.629
 ASSI (
   (( segid "    " and resid 1219 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  4450 weight  0.10000E+01 volume  0.29700E+00 ppm1      8.926 ppm2      1.024
 ASSI (
   (( segid "    " and resid 1219 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 1164 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4449 weight  0.10000E+01 volume  0.22800E+00 ppm1      8.926 ppm2      1.113
 ASSI (
   (( segid "    " and resid 1219 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4451 weight  0.10000E+01 volume  0.11900E+00 ppm1      8.925 ppm2      1.222
 ASSI (
   (( segid "    " and resid 1219 and name HN  ))
 )(
   (( segid "    " and resid 1222 and name HG2 ))
  OR 
   (( segid "    " and resid 1222 and name HG1 ))
  OR 
   (( segid "    " and resid 1166 and name HG2 ))
 )
      6.000     6.000     0.000 peak  4452 weight  0.10000E+01 volume  0.12200E+00 ppm1      8.923 ppm2      1.379
 ASSI (
   (( segid "    " and resid 1219 and name HN  ))
 )(
   (( segid "    " and resid 1222 and name HD2 ))
  OR 
   (( segid "    " and resid 1222 and name HD1 ))
  OR 
   (( segid "    " and resid 1220 and name HB2 ))
  OR 
   (( segid "    " and resid 1143 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4454 weight  0.10000E+01 volume  0.11700E+00 ppm1      8.926 ppm2      1.717
 ASSI (
   (( segid "    " and resid 1219 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  ))
 )
      5.000     5.000     0.000 peak  4453 weight  0.10000E+01 volume  0.43000E+00 ppm1      8.926 ppm2      1.926
 ASSI (
   (( segid "    " and resid 1219 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  4457 weight  0.10000E+01 volume  0.51400E+00 ppm1      8.926 ppm2      2.793
 ASSI (
   (( segid "    " and resid 1219 and name HN  ))
 )(
   (( segid "    " and resid 1220 and name HB1 ))
  OR 
   (( segid "    " and resid 1219 and name HB2 ))
  OR 
   (( segid "    " and resid 1218 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4455 weight  0.10000E+01 volume  0.12910E+01 ppm1      8.925 ppm2      3.047
 ASSI (
   (( segid "    " and resid 1219 and name HN  ))
 )(
   (( segid "    " and resid 1219 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4456 weight  0.10000E+01 volume  0.10130E+01 ppm1      8.926 ppm2      3.359
 ASSI (
   (( segid "    " and resid 1219 and name HN  ))
 )(
   (( segid "    " and resid 1193 and name HB  ))
  OR 
   (( segid "    " and resid 1191 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4458 weight  0.10000E+01 volume  0.10500E+00 ppm1      8.926 ppm2      3.518
 ASSI (
   (( segid "    " and resid 1219 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HA  ))
  OR 
   (( segid "    " and resid 1222 and name HA  ))
  OR 
   (( segid "    " and resid 1220 and name HA  ))
 )
      5.000     5.000     0.000 peak  4461 weight  0.10000E+01 volume  0.12260E+01 ppm1      8.927 ppm2      4.470
 ASSI (
   (( segid "    " and resid 1219 and name HN  ))
 )(
   (( segid "    " and resid 1167 and name HA  ))
 )
      6.000     6.000     0.000 peak  4462 weight  0.10000E+01 volume  0.29600E+00 ppm1      8.926 ppm2      4.755
 ASSI (
   (( segid "    " and resid 1219 and name HN  ))
 )(
   (( segid "    " and resid 1219 and name HE3 ))
 )
      6.000     6.000     0.000 peak  4466 weight  0.10000E+01 volume  0.13000E+00 ppm1      8.925 ppm2      7.581
 ASSI (
   (( segid "    " and resid 1219 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HN  ))
 )
      6.000     6.000     0.000 peak  4467 weight  0.10000E+01 volume  0.18000E+00 ppm1      8.926 ppm2      8.151
 ASSI (
   (( segid "    " and resid 1219 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  4470 weight  0.10000E+01 volume  0.54100E+00 ppm1      8.925 ppm2      8.286
 ASSI (
   (( segid "    " and resid 1219 and name HN  ))
 )(
   (( segid "    " and resid 1194 and name HN  ))
 )
      6.000     6.000     0.000 peak  6096 weight  0.10000E+01 volume  0.12500E+00 ppm1      8.927 ppm2      9.163
 ASSI (
   (( segid "    " and resid 1219 and name HE1 ))
 )(
   (( segid "    " and resid 1145 and name HG2 ))
  OR 
   (( segid "    " and resid 1145 and name HG1 ))
 )
      6.000     6.000     0.000 peak  5351 weight  0.10000E+01 volume  0.13000E+00 ppm1     10.224 ppm2      2.255
 ASSI (
   (( segid "    " and resid 1219 and name HE1 ))
 )(
   (( 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  5356 weight  0.10000E+01 volume  0.36000E+00 ppm1     10.225 ppm2      0.394
 ASSI (
   (( segid "    " and resid 1219 and name HE1 ))
 )(
   (( 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  5354 weight  0.10000E+01 volume  0.27700E+00 ppm1     10.225 ppm2      1.031
 ASSI (
   (( segid "    " and resid 1219 and name HE1 ))
 )(
   (( segid "    " and resid 1164 and name HB1 ))
  OR 
   (( segid "    " and resid 1143 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5352 weight  0.10000E+01 volume  0.18400E+00 ppm1     10.222 ppm2      1.631
 ASSI (
   (( segid "    " and resid 1219 and name HE1 ))
 )(
   (( segid "    " and resid 1220 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5353 weight  0.10000E+01 volume  0.62400E+00 ppm1     10.226 ppm2      1.753
 ASSI (
   (( segid "    " and resid 1219 and name HE1 ))
 )(
   (( segid "    " and resid 1220 and name HB1 ))
  OR 
   (( segid "    " and resid 1219 and name HB2 ))
  OR 
   (( segid "    " and resid 1218 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5350 weight  0.10000E+01 volume  0.76800E+00 ppm1     10.228 ppm2      3.074
 ASSI (
   (( segid "    " and resid 1219 and name HE1 ))
 )(
   (( segid "    " and resid 1219 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5349 weight  0.10000E+01 volume  0.53700E+00 ppm1     10.229 ppm2      3.350
 ASSI (
   (( segid "    " and resid 1219 and name HE1 ))
 )(
   (( segid "    " and resid 1220 and name HA  ))
 )
      6.000     6.000     0.000 peak  5347 weight  0.10000E+01 volume  0.17300E+00 ppm1     10.223 ppm2      4.471
 ASSI (
   (( segid "    " and resid 1220 and name HN  ))
 )(
   (( segid "    " and resid 1164 and name HA  ))
  OR 
   (( segid "    " and resid 1142 and name HA  ))
 )
      6.000     6.000     0.000 peak  4435 weight  0.10000E+01 volume  0.36200E+00 ppm1      8.902 ppm2      4.356
 ASSI (
   (( segid "    " and resid 1220 and name HN  ))
 )(
   (( segid "    " and resid 1194 and name HN  ))
 )
      6.000     6.000     0.000 peak  4427 weight  0.10000E+01 volume  0.19600E+00 ppm1      8.895 ppm2      9.154
 ASSI (
   (( segid "    " and resid 1220 and name HN  ))
 )(
   (( segid "    " and resid 1222 and name HN  ))
 )
      6.000     6.000     0.000 peak  4429 weight  0.10000E+01 volume  0.12100E+00 ppm1      8.895 ppm2      7.765
 ASSI (
   (( segid "    " and resid 1220 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  4443 weight  0.10000E+01 volume  0.55100E+00 ppm1      8.901 ppm2      0.632
 ASSI (
   (( segid "    " and resid 1220 and name HN  ))
 )(
   (( segid "    " and resid 1164 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4442 weight  0.10000E+01 volume  0.24300E+00 ppm1      8.898 ppm2      1.116
 ASSI (
   (( segid "    " and resid 1220 and name HN  ))
 )(
   (( segid "    " and resid 1164 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4440 weight  0.10000E+01 volume  0.23900E+00 ppm1      8.901 ppm2      1.630
 ASSI (
   (( segid "    " and resid 1220 and name HN  ))
 )(
   (( segid "    " and resid 1220 and name HB2 ))
 )
      5.000     5.000     0.000 peak  4441 weight  0.10000E+01 volume  0.52400E+00 ppm1      8.900 ppm2      1.752
 ASSI (
   (( segid "    " and resid 1220 and name HN  ))
 )(
   (( segid "    " and resid 1220 and name HB1 ))
  OR 
   (( segid "    " and resid 1219 and name HB2 ))
  OR 
   (( segid "    " and resid 1218 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4445 weight  0.10000E+01 volume  0.68200E+00 ppm1      8.902 ppm2      3.054
 ASSI (
   (( segid "    " and resid 1220 and name HN  ))
 )(
   (( segid "    " and resid 1219 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4437 weight  0.10000E+01 volume  0.20000E+00 ppm1      8.902 ppm2      3.361
 ASSI (
   (( segid "    " and resid 1220 and name HN  ))
 )(
   (( segid "    " and resid 1220 and name HA  ))
 )
      5.000     5.000     0.000 peak  4434 weight  0.10000E+01 volume  0.10920E+01 ppm1      8.901 ppm2      4.481
 ASSI (
   (( segid "    " and resid 1220 and name HN  ))
 )(
   (( segid "    " and resid 1219 and name HD1 ))
 )
      6.000     6.000     0.000 peak  4431 weight  0.10000E+01 volume  0.14600E+00 ppm1      8.901 ppm2      7.141
 ASSI (
   (( segid "    " and resid 1220 and name HN  ))
 )(
   (( segid "    " and resid 1219 and name HE3 ))
 )
      6.000     6.000     0.000 peak  4430 weight  0.10000E+01 volume  0.14500E+00 ppm1      8.899 ppm2      7.569
 ASSI (
   (( segid "    " and resid 1221 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))
 )
      6.000     6.000     0.000 peak  4425 weight  0.10000E+01 volume -0.17900E+00 ppm1      6.350 ppm2      0.397
 ASSI (
   (( segid "    " and resid 1221 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  ))
 )
      6.000     6.000     0.000 peak  4424 weight  0.10000E+01 volume -0.22600E+00 ppm1      6.349 ppm2      0.638
 ASSI (
   (( segid "    " and resid 1221 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HB2 ))
  OR 
   (( segid "    " and resid 1164 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4423 weight  0.10000E+01 volume -0.12500E+00 ppm1      6.353 ppm2      1.146
 ASSI (
   (( segid "    " and resid 1221 and name HN  ))
 )(
   (( segid "    " and resid 1222 and name HD2 ))
  OR 
   (( segid "    " and resid 1222 and name HD1 ))
  OR 
   (( segid "    " and resid 1220 and name HB2 ))
  OR 
   (( segid "    " and resid 1166 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4421 weight  0.10000E+01 volume -0.25000E+00 ppm1      6.351 ppm2      1.750
 ASSI (
   (( segid "    " and resid 1221 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  4420 weight  0.10000E+01 volume -0.24400E+00 ppm1      6.350 ppm2      1.932
 ASSI (
   (( segid "    " and resid 1221 and name HN  ))
 )(
   (( segid "    " and resid 1220 and name HB1 ))
  OR 
   (( segid "    " and resid 1219 and name HB2 ))
  OR 
   (( segid "    " and resid 1218 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4418 weight  0.10000E+01 volume -0.20900E+00 ppm1      6.353 ppm2      3.066
 ASSI (
   (( segid "    " and resid 1221 and name HN  ))
 )(
   (( segid "    " and resid 1222 and name HG2 ))
  OR 
   (( segid "    " and resid 1222 and name HG1 ))
  OR 
   (( segid "    " and resid 1166 and name HG2 ))
 )
      6.000     6.000     0.000 peak  4422 weight  0.10000E+01 volume -0.10700E+00 ppm1      6.351 ppm2      1.388
 ASSI (
   (( segid "    " and resid 1222 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))
 )
      6.000     6.000     0.000 peak  4408 weight  0.10000E+01 volume  0.12700E+00 ppm1      7.770 ppm2      0.381
 ASSI (
   (( segid "    " and resid 1222 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 1164 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4407 weight  0.10000E+01 volume  0.19700E+00 ppm1      7.772 ppm2      1.152
 ASSI (
   (( segid "    " and resid 1222 and name HN  ))
 )(
   (( segid "    " and resid 1222 and name HG2 ))
 )
      5.000     5.000     0.000 peak  4406 weight  0.10000E+01 volume  0.96100E+00 ppm1      7.770 ppm2      1.338
 ASSI (
   (( segid "    " and resid 1222 and name HN  ))
 )(
   (( segid "    " and resid 1222 and name HG1 ))
  OR 
   (( segid "    " and resid 1169 and name HG11))
 )
      5.000     5.000     0.000 peak  4405 weight  0.10000E+01 volume  0.10370E+01 ppm1      7.769 ppm2      1.405
 ASSI (
   (( segid "    " and resid 1222 and name HN  ))
 )(
   (( segid "    " and resid 1222 and name HD2 ))
  OR 
   (( segid "    " and resid 1222 and name HD1 ))
  OR 
   (( segid "    " and resid 1220 and name HB2 ))
  OR 
   (( segid "    " and resid 1169 and name HB  ))
 )
      5.000     5.000     0.000 peak  4403 weight  0.10000E+01 volume  0.76800E+00 ppm1      7.772 ppm2      1.740
 ASSI (
   (( segid "    " and resid 1222 and name HN  ))
 )(
   (( segid "    " and resid 1222 and name HB2 ))
  OR 
   (( segid "    " and resid 1222 and name HB1 ))
 )
      2.700     2.700     0.000 peak  4404 weight  0.10000E+01 volume  0.55490E+01 ppm1      7.771 ppm2      1.927
 ASSI (
   (( segid "    " and resid 1222 and name HN  ))
 )(
   (( segid "    " and resid 1222 and name HE2 ))
  OR 
   (( segid "    " and resid 1222 and name HE1 ))
  OR 
   (( segid "    " and resid 1220 and name HB1 ))
  OR 
   (( segid "    " and resid 1219 and name HB2 ))
  OR 
   (( segid "    " and resid 1218 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4401 weight  0.10000E+01 volume  0.50600E+00 ppm1      7.769 ppm2      3.058
 ASSI (
   (( segid "    " and resid 1222 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  4402 weight  0.10000E+01 volume  0.28600E+00 ppm1      7.768 ppm2      3.134
 ASSI (
   (( segid "    " and resid 1222 and name HN  ))
 )(
   (( segid "    " and resid 1219 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4400 weight  0.10000E+01 volume  0.17600E+00 ppm1      7.769 ppm2      3.356
 ASSI (
   (( segid "    " and resid 1222 and name HN  ))
 )(
   (( segid "    " and resid 1221 and name HA2 ))
 )
      5.000     5.000     0.000 peak  4399 weight  0.10000E+01 volume  0.94500E+00 ppm1      7.771 ppm2      3.728
 ASSI (
   (( segid "    " and resid 1222 and name HN  ))
 )(
   (( segid "    " and resid 1221 and name HA1 ))
 )
      5.000     5.000     0.000 peak  4398 weight  0.10000E+01 volume  0.83600E+00 ppm1      7.770 ppm2      4.054
 ASSI (
   (( segid "    " and resid 1222 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HA  ))
  OR 
   (( segid "    " and resid 1222 and name HA  ))
  OR 
   (( segid "    " and resid 1220 and name HA  ))
 )
      3.300     3.300     0.000 peak  4397 weight  0.10000E+01 volume  0.29360E+01 ppm1      7.770 ppm2      4.472
 ASSI (
   (( segid "    " and resid 1222 and name HN  ))
 )(
   (( segid "    " and resid 1167 and name HA  ))
 )
      6.000     6.000     0.000 peak  4395 weight  0.10000E+01 volume  0.23800E+00 ppm1      7.767 ppm2      4.776
 ASSI (
   (( segid "    " and resid 1223 and name HN  ))
 )(
   (( segid "    " and resid 1222 and name HD2 ))
  OR 
   (( segid "    " and resid 1222 and name HD1 ))
  OR 
   (( segid "    " and resid 1169 and name HB  ))
 )
      5.000     5.000     0.000 peak  4383 weight  0.10000E+01 volume  0.55100E+00 ppm1      8.142 ppm2      1.731
 ASSI (
   (( segid "    " and resid 1223 and name HN  ))
 )(
   (( segid "    " and resid 1218 and name HB2 ))
  OR 
   (( segid "    " and resid 1167 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4381 weight  0.10000E+01 volume  0.14300E+00 ppm1      8.142 ppm2      2.774
 ASSI (
   (( segid "    " and resid 1223 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HA  ))
  OR 
   (( segid "    " and resid 1222 and name HA  ))
 )
      2.700     2.700     0.000 peak  4379 weight  0.10000E+01 volume  0.10689E+02 ppm1      8.141 ppm2      4.472
 ASSI (
   (( segid "    " and resid 1223 and name HN  ))
 )(
   (( segid "    " and resid 1170 and name HN  ))
 )
      6.000     6.000     0.000 peak  4375 weight  0.10000E+01 volume  0.11000E+00 ppm1      8.143 ppm2      7.920
 ASSI (
   (( segid "    " and resid 1223 and name HN  ))
 )(
   (( segid "    " and resid 1225 and name HN  ))
  OR 
   (( segid "    " and resid 1224 and name HN  ))
  OR 
   (( segid "    " and resid 1217 and name HN  ))
  OR 
   (( segid "    " and resid 1169 and name HN  ))
 )
      5.000     5.000     0.000 peak  4377 weight  0.10000E+01 volume  0.90900E+00 ppm1      8.142 ppm2      8.268
 ASSI (
   (( segid "    " and resid 1223 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  4374 weight  0.10000E+01 volume  0.10700E+00 ppm1      8.142 ppm2      8.939
 ASSI (
   (( segid "    " and resid 1223 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))
 )
      6.000     6.000     0.000 peak  4389 weight  0.10000E+01 volume  0.33900E+00 ppm1      8.142 ppm2      0.386
 ASSI (
   (( segid "    " and resid 1223 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HG  ))
  OR 
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )
      5.000     5.000     0.000 peak  4387 weight  0.10000E+01 volume  0.46200E+00 ppm1      8.141 ppm2      1.002
 ASSI (
   (( segid "    " and resid 1223 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HB2 ))
 )
      5.000     5.000     0.000 peak  4386 weight  0.10000E+01 volume  0.13000E+01 ppm1      8.141 ppm2      1.118
 ASSI (
   (( segid "    " and resid 1223 and name HN  ))
 )(
   (( segid "    " and resid 1222 and name HG2 ))
  OR 
   (( segid "    " and resid 1169 and name HG11))
 )
      5.000     5.000     0.000 peak  4384 weight  0.10000E+01 volume  0.92400E+00 ppm1      8.141 ppm2      1.361
 ASSI (
   (( segid "    " and resid 1223 and name HN  ))
 )(
   (( segid "    " and resid 1222 and name HB2 ))
  OR 
   (( segid "    " and resid 1222 and name HB1 ))
 )
      3.300     3.300     0.000 peak  4382 weight  0.10000E+01 volume  0.22040E+01 ppm1      8.142 ppm2      1.930
 ASSI (
   (( segid "    " and resid 1223 and name HN  ))
 )(
   (( segid "    " and resid 1222 and name HE2 ))
  OR 
   (( segid "    " and resid 1222 and name HE1 ))
 )
      6.000     6.000     0.000 peak  4380 weight  0.10000E+01 volume  0.90000E-01 ppm1      8.142 ppm2      3.023
 ASSI (
   (( segid "    " and resid 1223 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  4378 weight  0.10000E+01 volume  0.18500E+00 ppm1      8.144 ppm2      6.711
 ASSI (
   (( segid "    " and resid 1224 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))
 )
      5.000     5.000     0.000 peak  4360 weight  0.10000E+01 volume  0.65000E+00 ppm1      8.284 ppm2      0.393
 ASSI (
   (( segid "    " and resid 1224 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HG  ))
  OR 
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )
      5.000     5.000     0.000 peak  4363 weight  0.10000E+01 volume  0.10510E+01 ppm1      8.283 ppm2      1.008
 ASSI (
   (( segid "    " and resid 1224 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))
 )
      3.300     3.300     0.000 peak  4362 weight  0.10000E+01 volume  0.23300E+01 ppm1      8.283 ppm2      1.121
 ASSI (
   (( segid "    " and resid 1224 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4361 weight  0.10000E+01 volume  0.74200E+00 ppm1      8.283 ppm2      1.223
 ASSI (
   (( segid "    " and resid 1224 and name HN  ))
 )(
   (( segid "    " and resid 1222 and name HG2 ))
  OR 
   (( segid "    " and resid 1169 and name HG11))
 )
      6.000     6.000     0.000 peak  4364 weight  0.10000E+01 volume  0.22100E+00 ppm1      8.282 ppm2      1.356
 ASSI (
   (( segid "    " and resid 1224 and name HN  ))
 )(
   (( segid "    " and resid 1224 and name HB2 ))
  OR 
   (( segid "    " and resid 1224 and name HB1 ))
 )
      2.700     2.700     0.000 peak  4365 weight  0.10000E+01 volume  0.63780E+01 ppm1      8.282 ppm2      1.666
 ASSI (
   (( segid "    " and resid 1224 and name HN  ))
 )(
   (( segid "    " and resid 1222 and name HD2 ))
  OR 
   (( segid "    " and resid 1222 and name HD1 ))
  OR 
   (( segid "    " and resid 1215 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4366 weight  0.10000E+01 volume  0.49500E+00 ppm1      8.282 ppm2      1.796
 ASSI (
   (( segid "    " and resid 1224 and name HN  ))
 )(
   (( segid "    " and resid 1222 and name HB2 ))
  OR 
   (( segid "    " and resid 1222 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4367 weight  0.10000E+01 volume  0.32100E+00 ppm1      8.282 ppm2      1.922
 ASSI (
   (( segid "    " and resid 1224 and name HN  ))
 )(
   (( segid "    " and resid 1224 and name HG1 ))
 )
      5.000     5.000     0.000 peak  4369 weight  0.10000E+01 volume  0.12070E+01 ppm1      8.282 ppm2      2.188
 ASSI (
   (( segid "    " and resid 1224 and name HN  ))
 )(
   (( segid "    " and resid 1224 and name HA  ))
  OR 
   (( segid "    " and resid 1223 and name HA  ))
 )
      2.700     2.700     0.000 peak  4370 weight  0.10000E+01 volume  0.99760E+01 ppm1      8.283 ppm2      4.452
 ASSI (
   (( segid "    " and resid 1224 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  4372 weight  0.10000E+01 volume  0.11400E+00 ppm1      8.283 ppm2      6.772
 ASSI (
   (( segid "    " and resid 1227 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 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  4358 weight  0.10000E+01 volume -0.76300E+00 ppm1      7.960 ppm2      0.644
 ASSI (
   (( segid "    " and resid 1227 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  4357 weight  0.10000E+01 volume -0.47600E+00 ppm1      7.958 ppm2      0.932
 ASSI (
   (( segid "    " and resid 1227 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HB2 ))
 )
      5.000     5.000     0.000 peak  4356 weight  0.10000E+01 volume -0.62700E+00 ppm1      7.955 ppm2      1.611
 ASSI (
   (( segid "    " and resid 1227 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
 )
      6.000     6.000     0.000 peak  4355 weight  0.10000E+01 volume -0.14900E+00 ppm1      7.955 ppm2      2.054
 ASSI (
   (( segid "    " and resid 1227 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4354 weight  0.10000E+01 volume -0.55300E+00 ppm1      7.957 ppm2      2.232
 ASSI (
   (( segid "    " and resid 1227 and name HN  ))
 )(
   (( segid "    " and resid 1228 and name HB1 ))
  OR 
   (( segid "    " and resid 1227 and name HB  ))
 )
      5.000     5.000     0.000 peak  4352 weight  0.10000E+01 volume -0.86100E+00 ppm1      7.957 ppm2      3.675
 ASSI (
   (( segid "    " and resid 1227 and name HN  ))
 )(
   (( segid "    " and resid 1228 and name HB1 ))
  OR 
   (( segid "    " and resid 1211 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4351 weight  0.10000E+01 volume -0.34500E+00 ppm1      7.958 ppm2      3.759
 ASSI (
   (( segid "    " and resid 1227 and name HN  ))
 )(
   (( segid "    " and resid 1211 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4350 weight  0.10000E+01 volume -0.67400E+00 ppm1      7.956 ppm2      3.930
 ASSI (
   (( segid "    " and resid 1227 and name HN  ))
 )(
   (( segid "    " and resid 1225 and name HA  ))
  OR 
   (( segid "    " and resid 1214 and name HA  ))
 )
      6.000     6.000     0.000 peak  4349 weight  0.10000E+01 volume -0.16100E+00 ppm1      7.959 ppm2      4.158
 ASSI (
   (( segid "    " and resid 1227 and name HN  ))
 )(
   (( segid "    " and resid 1211 and name HA  ))
  OR 
   (( segid "    " and resid 1209 and name HA  ))
 )
      6.000     6.000     0.000 peak  4348 weight  0.10000E+01 volume -0.18300E+00 ppm1      7.959 ppm2      4.309
 ASSI (
   (( segid "    " and resid 1229 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 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  4337 weight  0.10000E+01 volume  0.25500E+00 ppm1      9.811 ppm2      0.653
 ASSI (
   (( segid "    " and resid 1229 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))
 )
      6.000     6.000     0.000 peak  4336 weight  0.10000E+01 volume  0.28300E+00 ppm1      9.811 ppm2      0.932
 ASSI (
   (( segid "    " and resid 1229 and name HN  ))
 )(
   (( segid "    " and resid 1230 and name HG1 ))
  OR 
   (( segid "    " and resid 1178 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4335 weight  0.10000E+01 volume  0.14700E+00 ppm1      9.810 ppm2      1.179
 ASSI (
   (( segid "    " and resid 1229 and name HN  ))
 )(
   (( 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  4334 weight  0.10000E+01 volume  0.39370E+01 ppm1      9.808 ppm2      1.427
 ASSI (
   (( segid "    " and resid 1229 and name HN  ))
 )(
   (( segid "    " and resid 1231 and name HB2 ))
  OR 
   (( segid "    " and resid 1206 and name HG2 ))
 )
      5.000     5.000     0.000 peak  4332 weight  0.10000E+01 volume  0.78600E+00 ppm1      9.810 ppm2      1.565
 ASSI (
   (( segid "    " and resid 1229 and name HN  ))
 )(
   (( segid "    " and resid 1230 and name HB1 ))
  OR 
   (( segid "    " and resid 1206 and name HG1 ))
 )
      6.000     6.000     0.000 peak  4333 weight  0.10000E+01 volume  0.36400E+00 ppm1      9.811 ppm2      1.638
 ASSI (
   (( segid "    " and resid 1229 and name HN  ))
 )(
   (( 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  4331 weight  0.10000E+01 volume  0.65200E+00 ppm1      9.810 ppm2      1.795
 ASSI (
   (( segid "    " and resid 1229 and name HN  ))
 )(
   (( segid "    " and resid 1228 and name HB2 ))
  OR 
   (( segid "    " and resid 1205 and name HB2 ))
 )
      3.300     3.300     0.000 peak  4330 weight  0.10000E+01 volume  0.18520E+01 ppm1      9.809 ppm2      2.685
 ASSI (
   (( segid "    " and resid 1229 and name HN  ))
 )(
   (( segid "    " and resid 1230 and name HE2 ))
  OR 
   (( segid "    " and resid 1230 and name HE1 ))
  OR 
   (( segid "    " and resid 1178 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4344 weight  0.10000E+01 volume  0.42900E+00 ppm1      9.808 ppm2      2.780
 ASSI (
   (( segid "    " and resid 1229 and name HN  ))
 )(
   (( segid "    " and resid 1206 and name HD2 ))
  OR 
   (( segid "    " and resid 1206 and name HD1 ))
  OR 
   (( segid "    " and resid 1205 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4329 weight  0.10000E+01 volume  0.66900E+00 ppm1      9.811 ppm2      3.171
 ASSI (
   (( segid "    " and resid 1229 and name HN  ))
 )(
   (( segid "    " and resid 1228 and name HB1 ))
 )
      3.300     3.300     0.000 peak  4328 weight  0.10000E+01 volume  0.21960E+01 ppm1      9.811 ppm2      3.680
 ASSI (
   (( segid "    " and resid 1229 and name HN  ))
 )(
   (( segid "    " and resid 1211 and name HB1 ))
  OR 
   (( segid "    " and resid 1209 and name HB2 ))
  OR 
   (( segid "    " and resid 1208 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4327 weight  0.10000E+01 volume  0.47600E+00 ppm1      9.810 ppm2      3.909
 ASSI (
   (( segid "    " and resid 1229 and name HN  ))
 )(
   (( segid "    " and resid 1207 and name HA  ))
 )
      5.000     5.000     0.000 peak  4324 weight  0.10000E+01 volume  0.90400E+00 ppm1      9.812 ppm2      4.396
 ASSI (
   (( segid "    " and resid 1229 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HA  ))
  OR 
   (( segid "    " and resid 1208 and name HA  ))
 )
      6.000     6.000     0.000 peak  4326 weight  0.10000E+01 volume  0.34400E+00 ppm1      9.810 ppm2      4.479
 ASSI (
   (( segid "    " and resid 1229 and name HN  ))
 )(
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )
      5.000     5.000     0.000 peak  4338 weight  0.10000E+01 volume  0.72500E+00 ppm1      9.808 ppm2      6.645
 ASSI (
   (( segid "    " and resid 1229 and name HN  ))
 )(
   (( segid "    " and resid 1228 and name HN  ))
  OR 
   (( segid "    " and resid 1205 and name HN  ))
 )
      5.000     5.000     0.000 peak  4340 weight  0.10000E+01 volume  0.68900E+00 ppm1      9.810 ppm2      8.340
 ASSI (
   (( segid "    " and resid 1229 and name HN  ))
 )(
   (( segid "    " and resid 1205 and name HA  ))
 )
      5.000     5.000     0.000 peak  4323 weight  0.10000E+01 volume  0.64300E+00 ppm1      9.812 ppm2      4.779
 ASSI (
   (( segid "    " and resid 1229 and name HN  ))
 )(
   (( segid "    " and resid 1229 and name HA  ))
  OR 
   (( segid "    " and resid 1206 and name HA  ))
 )
      5.000     5.000     0.000 peak  4322 weight  0.10000E+01 volume  0.12520E+01 ppm1      9.807 ppm2      4.948
 ASSI (
   (( segid "    " and resid 1229 and name HN  ))
 )(
   (( segid "    " and resid 1206 and name HN  ))
 )
      3.300     3.300     0.000 peak  4343 weight  0.10000E+01 volume  0.24330E+01 ppm1      9.808 ppm2      9.343
 ASSI (
   (( segid "    " and resid 1229 and name HN  ))
 )(
   (( segid "    " and resid 1207 and name HN  ))
 )
      5.000     5.000     0.000 peak  4342 weight  0.10000E+01 volume  0.75700E+00 ppm1      9.810 ppm2      8.763
 ASSI (
   (( segid "    " and resid 1229 and name HN  ))
 )(
   (( segid "    " and resid 1208 and name HN  ))
 )
      5.000     5.000     0.000 peak  4341 weight  0.10000E+01 volume  0.93100E+00 ppm1      9.810 ppm2      8.905
 ASSI (
   (( segid "    " and resid 1229 and name HN  ))
 )(
   (( segid "    " and resid 1231 and name HN  ))
 )
      6.000     6.000     0.000 peak  4339 weight  0.10000E+01 volume  0.10900E+00 ppm1      9.811 ppm2      7.750
 ASSI (
   (( segid "    " and resid 1230 and name HN  ))
 )(
   (( 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 ))
 )
      2.700     2.700     0.000 peak  4318 weight  0.10000E+01 volume  0.97210E+01 ppm1      8.776 ppm2      1.422
 ASSI (
   (( segid "    " and resid 1230 and name HN  ))
 )(
   (( segid "    " and resid 1230 and name HB1 ))
  OR 
   (( segid "    " and resid 1206 and name HG2 ))
  OR 
   (( segid "    " and resid 1206 and name HG1 ))
 )
      3.300     3.300     0.000 peak  4317 weight  0.10000E+01 volume  0.31900E+01 ppm1      8.776 ppm2      1.609
 ASSI (
   (( segid "    " and resid 1230 and name HN  ))
 )(
   (( segid "    " and resid 1205 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4316 weight  0.10000E+01 volume  0.16800E+00 ppm1      8.776 ppm2      2.654
 ASSI (
   (( segid "    " and resid 1230 and name HN  ))
 )(
   (( 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  4315 weight  0.10000E+01 volume  0.21500E+00 ppm1      8.777 ppm2      2.784
 ASSI (
   (( segid "    " and resid 1230 and name HN  ))
 )(
   (( segid "    " and resid 1230 and name HA  ))
 )
      3.300     3.300     0.000 peak  4314 weight  0.10000E+01 volume  0.21830E+01 ppm1      8.776 ppm2      3.694
 ASSI (
   (( segid "    " and resid 1230 and name HN  ))
 )(
   (( segid "    " and resid 1205 and name HA  ))
 )
      6.000     6.000     0.000 peak  4312 weight  0.10000E+01 volume  0.36300E+00 ppm1      8.778 ppm2      4.800
 ASSI (
   (( segid "    " and resid 1230 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  4313 weight  0.10000E+01 volume  0.22850E+01 ppm1      8.775 ppm2      6.645
 ASSI (
   (( segid "    " and resid 1230 and name HN  ))
 )(
   (( segid "    " and resid 1206 and name HE  ))
  OR 
   (( segid "    " and resid 1178 and name HD21))
 )
      6.000     6.000     0.000 peak  4310 weight  0.10000E+01 volume  0.18700E+00 ppm1      8.778 ppm2      7.127
 ASSI (
   (( segid "    " and resid 1230 and name HN  ))
 )(
   (( segid "    " and resid 1206 and name HN  ))
 )
      6.000     6.000     0.000 peak  4308 weight  0.10000E+01 volume  0.13500E+00 ppm1      8.782 ppm2      9.357
 ASSI (
   (( segid "    " and resid 1231 and name HN  ))
 )(
   (( segid "    " and resid 1231 and name HD2 ))
  OR 
   (( segid "    " and resid 1231 and name HD1 ))
 )
      5.000     5.000     0.000 peak  4299 weight  0.10000E+01 volume  0.59000E+00 ppm1      7.759 ppm2      3.112
 ASSI (
   (( segid "    " and resid 1231 and name HN  ))
 )(
   (( segid "    " and resid 1205 and name HA  ))
 )
      3.300     3.300     0.000 peak  4292 weight  0.10000E+01 volume  0.30070E+01 ppm1      7.756 ppm2      4.785
 ASSI (
   (( segid "    " and resid 1231 and name HN  ))
 )(
   (( segid "    " and resid 1231 and name HG2 ))
  OR 
   (( segid "    " and resid 1231 and name HG1 ))
  OR 
   (( segid "    " and resid 1230 and name HB2 ))
 )
      2.700     2.700     0.000 peak  4303 weight  0.10000E+01 volume  0.43500E+01 ppm1      7.751 ppm2      1.423
 ASSI (
   (( segid "    " and resid 1231 and name HN  ))
 )(
   (( segid "    " and resid 1231 and name HB2 ))
 )
      2.700     2.700     0.000 peak  4302 weight  0.10000E+01 volume  0.41310E+01 ppm1      7.752 ppm2      1.544
 ASSI (
   (( segid "    " and resid 1231 and name HN  ))
 )(
   (( segid "    " and resid 1231 and name HB1 ))
 )
      3.300     3.300     0.000 peak  4301 weight  0.10000E+01 volume  0.29650E+01 ppm1      7.755 ppm2      1.687
 ASSI (
   (( segid "    " and resid 1231 and name HN  ))
 )(
   (( segid "    " and resid 1205 and name HB2 ))
  OR 
   (( segid "    " and resid 1201 and name HB2 ))
 )
      5.000     5.000     0.000 peak  4298 weight  0.10000E+01 volume  0.49300E+00 ppm1      7.756 ppm2      2.657
 ASSI (
   (( segid "    " and resid 1231 and name HN  ))
 )(
   (( 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  4297 weight  0.10000E+01 volume  0.39000E+00 ppm1      7.758 ppm2      2.785
 ASSI (
   (( segid "    " and resid 1231 and name HN  ))
 )(
   (( segid "    " and resid 1204 and name HA2 ))
 )
      6.000     6.000     0.000 peak  4296 weight  0.10000E+01 volume  0.25900E+00 ppm1      7.757 ppm2      3.563
 ASSI (
   (( segid "    " and resid 1231 and name HN  ))
 )(
   (( segid "    " and resid 1231 and name HA  ))
 )
      2.700     2.700     0.000 peak  4293 weight  0.10000E+01 volume  0.39410E+01 ppm1      7.756 ppm2      3.995
 ASSI (
   (( segid "    " and resid 1231 and name HN  ))
 )(
   (( segid "    " and resid 1229 and name HA  ))
  OR 
   (( segid "    " and resid 1206 and name HA  ))
 )
      5.000     5.000     0.000 peak  4291 weight  0.10000E+01 volume  0.51900E+00 ppm1      7.757 ppm2      4.947
 ASSI (
   (( segid "    " and resid 1107 and name HN  ))
 )(
   (( segid "    " and resid 1107 and name HA1 ))
 )
      2.700     2.700     0.000 peak  9247 weight  0.10000E+01 volume  0.41530E+01 ppm1      8.245 ppm2      3.790
 ASSI (
   (( segid "    " and resid 1107 and name HN  ))
 )(
   (( segid "    " and resid 1107 and name HA2 ))
 )
      2.700     2.700     0.000 peak  9248 weight  0.10000E+01 volume  0.55830E+01 ppm1      8.244 ppm2      3.461
 ASSI (
   (( segid "    " and resid 1108 and name HN  ))
 )(
   (( segid "    " and resid 1107 and name HA2 ))
 )
      3.300     3.300     0.000 peak  6715 weight  0.10000E+01 volume  0.17520E+01 ppm1      7.493 ppm2      3.470
 ASSI (
   (( segid "    " and resid 1108 and name HN  ))
 )(
   (( segid "    " and resid 1108 and name HG1 ))
 )
      3.300     3.300     0.000 peak  6712 weight  0.10000E+01 volume  0.21550E+01 ppm1      7.490 ppm2      1.388
 ASSI (
   (( segid "    " and resid 1108 and name HN  ))
 )(
   (( segid "    " and resid 1108 and name HG2 ))
 )
      5.000     5.000     0.000 peak  6713 weight  0.10000E+01 volume  0.13450E+01 ppm1      7.490 ppm2      1.272
 ASSI (
   (( segid "    " and resid 1108 and name HN  ))
 )(
   (( segid "    " and resid 1109 and name HN  ))
 )
      5.000     5.000     0.000 peak  6131 weight  0.10000E+01 volume  0.68100E+00 ppm1      7.492 ppm2      8.623
 ASSI (
   (( segid "    " and resid 1109 and name HN  ))
 )(
   (( segid "    " and resid 1109 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6140 weight  0.10000E+01 volume  0.14240E+01 ppm1      8.618 ppm2      2.887
 ASSI (
   (( segid "    " and resid 1109 and name HN  ))
 )(
   (( segid "    " and resid 1110 and name HN  ))
 )
      5.000     5.000     0.000 peak  6114 weight  0.10000E+01 volume  0.54700E+00 ppm1      8.622 ppm2      8.114
 ASSI (
   (( segid "    " and resid 1109 and name HN  ))
 )(
   (( segid "    " and resid 1128 and name HN  ))
 )
      5.000     5.000     0.000 peak  5920 weight  0.10000E+01 volume  0.76800E+00 ppm1      8.619 ppm2      8.949
 ASSI (
   (( segid "    " and resid 1109 and name HN  ))
 )(
   (( segid "    " and resid 1157 and name HE1 ))
 )
      6.000     6.000     0.000 peak  5518 weight  0.10000E+01 volume  0.20600E+00 ppm1      8.616 ppm2      9.749
 ASSI (
   (( segid "    " and resid 1110 and name HN  ))
 )(
   (( segid "    " and resid 1109 and name HB1 ))
 )
      3.300     3.300     0.000 peak  6123 weight  0.10000E+01 volume -0.20390E+01 ppm1      8.113 ppm2      2.874
 ASSI (
   (( segid "    " and resid 1110 and name HN  ))
 )(
   (( segid "    " and resid 1109 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6125 weight  0.10000E+01 volume -0.12540E+01 ppm1      8.112 ppm2      2.046
 ASSI (
   (( segid "    " and resid 1110 and name HN  ))
 )(
   (( segid "    " and resid 1110 and name HA1 ))
 )
      3.300     3.300     0.000 peak  6117 weight  0.10000E+01 volume -0.20030E+01 ppm1      8.113 ppm2      4.697
 ASSI (
   (( segid "    " and resid 1110 and name HN  ))
 )(
   (( segid "    " and resid 1110 and name HA2 ))
 )
      3.300     3.300     0.000 peak  6120 weight  0.10000E+01 volume -0.29440E+01 ppm1      8.113 ppm2      3.953
 ASSI (
   (( segid "    " and resid 1110 and name HN  ))
 )(
   (( segid "    " and resid 1157 and name HE1 ))
 )
      5.000     5.000     0.000 peak  6112 weight  0.10000E+01 volume -0.62200E+00 ppm1      8.113 ppm2      9.757
 ASSI (
   (( segid "    " and resid 1115 and name HN  ))
 )(
   (( segid "    " and resid 1114 and name HB1 ))
 )
      3.300     3.300     0.000 peak  6104 weight  0.10000E+01 volume  0.19240E+01 ppm1      8.703 ppm2      2.184
 ASSI (
   (( segid "    " and resid 1115 and name HN  ))
 )(
   (( segid "    " and resid 1116 and name HN  ))
 )
      5.000     5.000     0.000 peak  6093 weight  0.10000E+01 volume  0.59800E+00 ppm1      8.702 ppm2      8.170
 ASSI (
   (( segid "    " and resid 1115 and name HN  ))
 )(
   (( segid "    " and resid 1118 and name HN  ))
 )
      6.000     6.000     0.000 peak  6048 weight  0.10000E+01 volume  0.17800E+00 ppm1      8.707 ppm2      7.235
 ASSI (
   (( segid "    " and resid 1115 and name HN  ))
 )(
   (( segid "    " and resid 1136 and name HE2 ))
  OR 
   (( segid "    " and resid 1136 and name HE1 ))
 )
      5.000     5.000     0.000 peak  6094 weight  0.10000E+01 volume  0.75600E+00 ppm1      8.705 ppm2      6.412
 ASSI (
   (( segid "    " and resid 1116 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  6091 weight  0.10000E+01 volume  0.21890E+01 ppm1      8.169 ppm2      0.416
 ASSI (
   (( segid "    " and resid 1116 and name HN  ))
 )(
   (( segid "    " and resid 1117 and name HN  ))
 )
      5.000     5.000     0.000 peak  6072 weight  0.10000E+01 volume  0.71100E+00 ppm1      8.171 ppm2      8.874
 ASSI (
   (( segid "    " and resid 1117 and name HN  ))
 )(
   (( segid "    " and resid 1116 and name HA  ))
 )
      2.700     2.700     0.000 peak  6077 weight  0.10000E+01 volume  0.60570E+01 ppm1      8.869 ppm2      4.339
 ASSI (
   (( segid "    " and resid 1117 and name HN  ))
 )(
   (( segid "    " and resid 1118 and name HN  ))
 )
      3.300     3.300     0.000 peak  6050 weight  0.10000E+01 volume  0.17900E+01 ppm1      8.871 ppm2      7.237
 ASSI (
   (( segid "    " and resid 1117 and name HD22))
 )(
   (( segid "    " and resid 1116 and name HB2 ))
  OR 
   (( segid "    " and resid 1116 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8436 weight  0.10000E+01 volume  0.81900E+00 ppm1      6.628 ppm2      2.491
 ASSI (
   (( segid "    " and resid 1118 and name HN  ))
 )(
   (( segid "    " and resid 1118 and name HA1 ))
 )
      5.000     5.000     0.000 peak  6056 weight  0.10000E+01 volume -0.15860E+01 ppm1      7.234 ppm2      4.522
 ASSI (
   (( segid "    " and resid 1118 and name HN  ))
 )(
   (( segid "    " and resid 1118 and name HA2 ))
 )
      3.300     3.300     0.000 peak  6058 weight  0.10000E+01 volume -0.27330E+01 ppm1      7.233 ppm2      3.815
 ASSI (
   (( segid "    " and resid 1118 and name HN  ))
 )(
   (( segid "    " and resid 1119 and name HN  ))
 )
      5.000     5.000     0.000 peak  6025 weight  0.10000E+01 volume -0.64300E+00 ppm1      7.233 ppm2      8.545
 ASSI (
   (( segid "    " and resid 1118 and name HN  ))
 )(
   (( segid "    " and resid 1139 and name HN  ))
 )
      6.000     6.000     0.000 peak  5766 weight  0.10000E+01 volume -0.36600E+00 ppm1      7.233 ppm2      8.341
 ASSI (
   (( segid "    " and resid 1119 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  6027 weight  0.10000E+01 volume  0.12500E+00 ppm1      8.544 ppm2      6.419
 ASSI (
   (( segid "    " and resid 1119 and name HN  ))
 )(
   (( segid "    " and resid 1137 and name HN  ))
 )
      5.000     5.000     0.000 peak  5800 weight  0.10000E+01 volume  0.13560E+01 ppm1      8.538 ppm2      8.771
 ASSI (
   (( segid "    " and resid 1120 and name HN  ))
 )(
   (( segid "    " and resid 1120 and name HG11))
 )
      3.300     3.300     0.000 peak  6019 weight  0.10000E+01 volume  0.25760E+01 ppm1      8.488 ppm2      1.408
 ASSI (
   (( segid "    " and resid 1120 and name HN  ))
 )(
   (( segid "    " and resid 1120 and name HG12))
 )
      2.700     2.700     0.000 peak  6020 weight  0.10000E+01 volume  0.42330E+01 ppm1      8.483 ppm2      0.740
 ASSI (
   (( segid "    " and resid 1120 and name HN  ))
 )(
   (( segid "    " and resid 1122 and name HN  ))
 )
      6.000     6.000     0.000 peak  5992 weight  0.10000E+01 volume  0.19000E+00 ppm1      8.489 ppm2      7.056
 ASSI (
   (( segid "    " and resid 1120 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  6014 weight  0.10000E+01 volume  0.25300E+00 ppm1      8.489 ppm2      6.416
 ASSI (
   (( segid "    " and resid 1121 and name HN  ))
 )(
   (( segid "    " and resid 1120 and name HN  ))
 )
      5.000     5.000     0.000 peak  5977 weight  0.10000E+01 volume  0.45600E+00 ppm1      8.256 ppm2      8.495
 ASSI (
   (( segid "    " and resid 1121 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  9447 weight  0.10000E+01 volume  0.16300E+00 ppm1      8.255 ppm2      0.576
 ASSI (
   (( segid "    " and resid 1121 and name HN  ))
 )(
   (( segid "    " and resid 1137 and name HN  ))
 )
      6.000     6.000     0.000 peak  5801 weight  0.10000E+01 volume  0.31800E+00 ppm1      8.256 ppm2      8.773
 ASSI (
   (( segid "    " and resid 1122 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  6005 weight  0.10000E+01 volume  0.13190E+01 ppm1      7.056 ppm2      0.479
 ASSI (
   (( segid "    " and resid 1122 and name HN  ))
 )(
   (( 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  6006 weight  0.10000E+01 volume  0.15030E+01 ppm1      7.057 ppm2      0.079
 ASSI (
   (( segid "    " and resid 1122 and name HN  ))
 )(
   (( segid "    " and resid 1121 and name HN  ))
 )
      3.300     3.300     0.000 peak  5979 weight  0.10000E+01 volume  0.27910E+01 ppm1      7.055 ppm2      8.256
 ASSI (
   (( segid "    " and resid 1122 and name HN  ))
 )(
   (( segid "    " and resid 1123 and name HN  ))
 )
      3.300     3.300     0.000 peak  5983 weight  0.10000E+01 volume  0.17060E+01 ppm1      7.056 ppm2      8.299
 ASSI (
   (( segid "    " and resid 1123 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))
 )
      6.000     6.000     0.000 peak  5991 weight  0.10000E+01 volume  0.14300E+00 ppm1      8.299 ppm2      0.490
 ASSI (
   (( segid "    " and resid 1123 and name HN  ))
 )(
   (( segid "    " and resid 1123 and name HD2 ))
  OR 
   (( segid "    " and resid 1123 and name HD1 ))
 )
      5.000     5.000     0.000 peak  5984 weight  0.10000E+01 volume  0.48000E+00 ppm1      8.301 ppm2      7.246
 ASSI (
   (( segid "    " and resid 1125 and name HN  ))
 )(
   (( segid "    " and resid 1126 and name HN  ))
 )
      5.000     5.000     0.000 peak  5951 weight  0.10000E+01 volume  0.48200E+00 ppm1      7.721 ppm2      8.332
 ASSI (
   (( segid "    " and resid 1125 and name HN  ))
 )(
   (( segid "    " and resid 1127 and name HN  ))
 )
      6.000     6.000     0.000 peak  5939 weight  0.10000E+01 volume  0.30800E+00 ppm1      7.721 ppm2      6.969
 ASSI (
   (( segid "    " and resid 1126 and name HN  ))
 )(
   (( segid "    " and resid 1127 and name HN  ))
 )
      2.700     2.700     0.000 peak  5937 weight  0.10000E+01 volume  0.35510E+01 ppm1      8.329 ppm2      6.971
 ASSI (
   (( segid "    " and resid 1127 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))
 )
      2.700     2.700     0.000 peak  5948 weight  0.10000E+01 volume  0.54170E+01 ppm1      6.968 ppm2      0.811
 ASSI (
   (( segid "    " and resid 1127 and name HN  ))
 )(
   (( segid "    " and resid 1128 and name HN  ))
 )
      5.000     5.000     0.000 peak  5925 weight  0.10000E+01 volume  0.44600E+00 ppm1      6.966 ppm2      8.949
 ASSI (
   (( segid "    " and resid 1128 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))
 )
      2.700     2.700     0.000 peak  5935 weight  0.10000E+01 volume  0.32680E+01 ppm1      8.943 ppm2      0.810
 ASSI (
   (( segid "    " and resid 1128 and name HN  ))
 )(
   (( segid "    " and resid 1129 and name HN  ))
 )
      5.000     5.000     0.000 peak  5516 weight  0.10000E+01 volume  0.41500E+00 ppm1      8.944 ppm2      8.327
 ASSI (
   (( segid "    " and resid 1129 and name HN  ))
 )(
   (( segid "    " and resid 1125 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5917 weight  0.10000E+01 volume  0.20600E+00 ppm1      8.329 ppm2      1.250
 ASSI (
   (( segid "    " and resid 1131 and name HN  ))
 )(
   (( segid "    " and resid 1132 and name HN  ))
 )
      5.000     5.000     0.000 peak  5875 weight  0.10000E+01 volume  0.10170E+01 ppm1      8.994 ppm2      7.837
 ASSI (
   (( segid "    " and resid 1131 and name HN  ))
 )(
   (( segid "    " and resid 1152 and name HN  ))
 )
      6.000     6.000     0.000 peak  5342 weight  0.10000E+01 volume  0.34700E+00 ppm1      8.992 ppm2      8.339
 ASSI (
   (( segid "    " and resid 1132 and name HN  ))
 )(
   (( segid "    " and resid 1133 and name HN  ))
 )
      5.000     5.000     0.000 peak  5860 weight  0.10000E+01 volume  0.57900E+00 ppm1      7.838 ppm2      8.472
 ASSI (
   (( segid "    " and resid 1132 and name HN  ))
 )(
   (( segid "    " and resid 1152 and name HN  ))
 )
      5.000     5.000     0.000 peak  5614 weight  0.10000E+01 volume  0.67600E+00 ppm1      7.839 ppm2      8.329
 ASSI (
   (( segid "    " and resid 1133 and name HN  ))
 )(
   (( segid "    " and resid 1134 and name HN  ))
 )
      5.000     5.000     0.000 peak  5858 weight  0.10000E+01 volume  0.48200E+00 ppm1      8.473 ppm2      8.242
 ASSI (
   (( segid "    " and resid 1134 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))
 )
      5.000     5.000     0.000 peak  5840 weight  0.10000E+01 volume  0.66600E+00 ppm1      8.244 ppm2      0.559
 ASSI (
   (( segid "    " and resid 1134 and name HN  ))
 )(
   (( segid "    " and resid 1150 and name HN  ))
 )
      5.000     5.000     0.000 peak  5654 weight  0.10000E+01 volume  0.10880E+01 ppm1      8.244 ppm2      8.721
 ASSI (
   (( segid "    " and resid 1135 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))
 )
      3.300     3.300     0.000 peak  5830 weight  0.10000E+01 volume  0.20130E+01 ppm1      8.287 ppm2      0.561
 ASSI (
   (( segid "    " and resid 1135 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  5829 weight  0.10000E+01 volume  0.19190E+01 ppm1      8.286 ppm2      0.074
 ASSI (
   (( segid "    " and resid 1136 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  6174 weight  0.10000E+01 volume  0.24200E+00 ppm1      8.351 ppm2      6.418
 ASSI (
   (( segid "    " and resid 1137 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  5805 weight  0.10000E+01 volume  0.24500E+00 ppm1      8.777 ppm2      6.422
 ASSI (
   (( segid "    " and resid 1137 and name HN  ))
 )(
   (( segid "    " and resid 1138 and name HN  ))
 )
      5.000     5.000     0.000 peak  5298 weight  0.10000E+01 volume  0.65000E+00 ppm1      8.769 ppm2      8.866
 ASSI (
   (( segid "    " and resid 1138 and name HN  ))
 )(
   (( segid "    " and resid 1139 and name HN  ))
 )
      6.000     6.000     0.000 peak  5764 weight  0.10000E+01 volume  0.34400E+00 ppm1      8.862 ppm2      8.345
 ASSI (
   (( segid "    " and resid 1138 and name HN  ))
 )(
   (( segid "    " and resid 1144 and name HN  ))
 )
      6.000     6.000     0.000 peak  5782 weight  0.10000E+01 volume  0.22400E+00 ppm1      8.861 ppm2      8.560
 ASSI (
   (( segid "    " and resid 1139 and name HN  ))
 )(
   (( segid "    " and resid 1142 and name HD2 ))
  OR 
   (( segid "    " and resid 1142 and name HD1 ))
 )
      5.000     5.000     0.000 peak  5695 weight  0.10000E+01 volume  0.58200E+00 ppm1      8.343 ppm2      6.649
 ASSI (
   (( segid "    " and resid 1140 and name HN  ))
 )(
   (( segid "    " and resid 1140 and name HB1 ))
 )
      2.700     2.700     0.000 peak  5745 weight  0.10000E+01 volume  0.44110E+01 ppm1      8.460 ppm2      2.793
 ASSI (
   (( segid "    " and resid 1142 and name HN  ))
 )(
   (( segid "    " and resid 1142 and name HE2 ))
  OR 
   (( segid "    " and resid 1142 and name HE1 ))
 )
      5.000     5.000     0.000 peak  5734 weight  0.10000E+01 volume  0.60800E+00 ppm1      8.431 ppm2      6.177
 ASSI (
   (( segid "    " and resid 1142 and name HN  ))
 )(
   (( segid "    " and resid 1143 and name HN  ))
 )
      6.000     6.000     0.000 peak  6199 weight  0.10000E+01 volume  0.22700E+00 ppm1      8.432 ppm2      7.869
 ASSI (
   (( segid "    " and resid 1143 and name HN  ))
 )(
   (( segid "    " and resid 1142 and name HD2 ))
  OR 
   (( segid "    " and resid 1142 and name HD1 ))
 )
      5.000     5.000     0.000 peak  6200 weight  0.10000E+01 volume  0.50300E+00 ppm1      7.871 ppm2      6.651
 ASSI (
   (( segid "    " and resid 1143 and name HN  ))
 )(
   (( segid "    " and resid 1144 and name HN  ))
 )
      6.000     6.000     0.000 peak  6184 weight  0.10000E+01 volume  0.23700E+00 ppm1      7.872 ppm2      8.572
 ASSI (
   (( segid "    " and resid 1143 and name HN  ))
 )(
   (( segid "    " and resid 1164 and name HN  ))
 )
      5.000     5.000     0.000 peak  5396 weight  0.10000E+01 volume  0.60400E+00 ppm1      7.874 ppm2      9.536
 ASSI (
   (( segid "    " and resid 1145 and name HN  ))
 )(
   (( segid "    " and resid 1144 and name HN  ))
 )
      5.000     5.000     0.000 peak  5411 weight  0.10000E+01 volume  0.53100E+00 ppm1      9.402 ppm2      8.547
 ASSI (
   (( segid "    " and resid 1145 and name HN  ))
 )(
   (( segid "    " and resid 1162 and name HN  ))
 )
      5.000     5.000     0.000 peak  5433 weight  0.10000E+01 volume  0.14870E+01 ppm1      9.405 ppm2      8.040
 ASSI (
   (( segid "    " and resid 1145 and name HN  ))
 )(
   (( segid "    " and resid 1163 and name HN  ))
 )
      6.000     6.000     0.000 peak  5412 weight  0.10000E+01 volume  0.95000E-01 ppm1      9.407 ppm2      8.998
 ASSI (
   (( segid "    " and resid 1145 and name HN  ))
 )(
   (( segid "    " and resid 1164 and name HN  ))
 )
      5.000     5.000     0.000 peak  5720 weight  0.10000E+01 volume  0.50600E+00 ppm1      9.400 ppm2      9.533
 ASSI (
   (( segid "    " and resid 1146 and name HN  ))
 )(
   (( segid "    " and resid 1144 and name HG  ))
 )
      6.000     6.000     0.000 peak  5718 weight  0.10000E+01 volume  0.21700E+00 ppm1      8.529 ppm2      1.330
 ASSI (
   (( segid "    " and resid 1148 and name HN  ))
 )(
   (( segid "    " and resid 1148 and name HG2 ))
 )
      5.000     5.000     0.000 peak  5706 weight  0.10000E+01 volume  0.98100E+00 ppm1      8.145 ppm2      1.457
 ASSI (
   (( segid "    " and resid 1149 and name HN  ))
 )(
   (( segid "    " and resid 1148 and name HG2 ))
 )
      5.000     5.000     0.000 peak  5690 weight  0.10000E+01 volume  0.11430E+01 ppm1      7.718 ppm2      1.467
 ASSI (
   (( segid "    " and resid 1149 and name HN  ))
 )(
   (( segid "    " and resid 1149 and name HB1 ))
 )
      2.700     2.700     0.000 peak  5688 weight  0.10000E+01 volume  0.39540E+01 ppm1      7.718 ppm2      1.698
 ASSI (
   (( segid "    " and resid 1149 and name HN  ))
 )(
   (( segid "    " and resid 1150 and name HN  ))
 )
      5.000     5.000     0.000 peak  5656 weight  0.10000E+01 volume  0.52900E+00 ppm1      7.719 ppm2      8.724
 ASSI (
   (( segid "    " and resid 1150 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  5658 weight  0.10000E+01 volume  0.28700E+00 ppm1      8.721 ppm2      6.411
 ASSI (
   (( segid "    " and resid 1151 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))
 )
      5.000     5.000     0.000 peak  5650 weight  0.10000E+01 volume  0.12200E+01 ppm1      8.416 ppm2      0.737
 ASSI (
   (( segid "    " and resid 1151 and name HN  ))
 )(
   (( segid "    " and resid 1157 and name HH2 ))
 )
      6.000     6.000     0.000 peak  5636 weight  0.10000E+01 volume  0.94000E-01 ppm1      8.424 ppm2      6.729
 ASSI (
   (( segid "    " and resid 1151 and name HN  ))
 )(
   (( segid "    " and resid 1158 and name HN  ))
 )
      5.000     5.000     0.000 peak  5472 weight  0.10000E+01 volume  0.94700E+00 ppm1      8.414 ppm2      8.153
 ASSI (
   (( segid "    " and resid 1152 and name HN  ))
 )(
   (( segid "    " and resid 1133 and name HA  ))
 )
      5.000     5.000     0.000 peak  5618 weight  0.10000E+01 volume  0.10170E+01 ppm1      8.330 ppm2      6.001
 ASSI (
   (( segid "    " and resid 1152 and name HN  ))
 )(
   (( segid "    " and resid 1153 and name HN  ))
 )
      6.000     6.000     0.000 peak  5593 weight  0.10000E+01 volume  0.29900E+00 ppm1      8.331 ppm2      8.715
 ASSI (
   (( segid "    " and resid 1153 and name HN  ))
 )(
   (( segid "    " and resid 1154 and name HN  ))
 )
      5.000     5.000     0.000 peak  4468 weight  0.10000E+01 volume  0.69500E+00 ppm1      8.713 ppm2      9.190
 ASSI (
   (( segid "    " and resid 1153 and name HN  ))
 )(
   (( segid "    " and resid 1155 and name HN  ))
 )
      6.000     6.000     0.000 peak  5562 weight  0.10000E+01 volume  0.28900E+00 ppm1      8.715 ppm2      7.659
 ASSI (
   (( segid "    " and resid 1153 and name HN  ))
 )(
   (( segid "    " and resid 1158 and name HN  ))
 )
      5.000     5.000     0.000 peak  5476 weight  0.10000E+01 volume  0.55400E+00 ppm1      8.714 ppm2      8.158
 ASSI (
   (( segid "    " and resid 1154 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  5590 weight  0.10000E+01 volume  0.23100E+01 ppm1      9.187 ppm2      1.700
 ASSI (
   (( segid "    " and resid 1154 and name HN  ))
 )(
   (( segid "    " and resid 1155 and name HN  ))
 )
      5.000     5.000     0.000 peak  5561 weight  0.10000E+01 volume  0.16130E+01 ppm1      9.185 ppm2      7.659
 ASSI (
   (( segid "    " and resid 1154 and name HD21))
 )(
   (( segid "    " and resid 1154 and name HN  ))
 )
      6.000     6.000     0.000 peak  8830 weight  0.10000E+01 volume  0.91000E-01 ppm1      7.549 ppm2      9.199
 ASSI (
   (( segid "    " and resid 1156 and name HN  ))
 )(
   (( segid "    " and resid 1153 and name HN  ))
 )
      3.300     3.300     0.000 peak  5542 weight  0.10000E+01 volume  0.20640E+01 ppm1      7.545 ppm2      8.717
 ASSI (
   (( segid "    " and resid 1156 and name HN  ))
 )(
   (( segid "    " and resid 1154 and name HN  ))
 )
      6.000     6.000     0.000 peak  5540 weight  0.10000E+01 volume  0.28000E+00 ppm1      7.544 ppm2      9.190
 ASSI (
   (( segid "    " and resid 1157 and name HN  ))
 )(
   (( segid "    " and resid 1158 and name HN  ))
 )
      5.000     5.000     0.000 peak  5474 weight  0.10000E+01 volume  0.53700E+00 ppm1      8.542 ppm2      8.152
 ASSI (
   (( segid "    " and resid 1157 and name HE1 ))
 )(
   (( segid "    " and resid 1109 and name HB1 ))
 )
      3.300     3.300     0.000 peak  5530 weight  0.10000E+01 volume  0.17970E+01 ppm1      9.751 ppm2      2.865
 ASSI (
   (( segid "    " and resid 1157 and name HE1 ))
 )(
   (( segid "    " and resid 1157 and name HD1 ))
 )
      2.700     2.700     0.000 peak  5519 weight  0.10000E+01 volume  0.34560E+01 ppm1      9.748 ppm2      7.113
 ASSI (
   (( segid "    " and resid 1158 and name HN  ))
 )(
   (( segid "    " and resid 1159 and name HN  ))
 )
      5.000     5.000     0.000 peak  5454 weight  0.10000E+01 volume  0.54600E+00 ppm1      8.154 ppm2      7.955
 ASSI (
   (( segid "    " and resid 1159 and name HN  ))
 )(
   (( segid "    " and resid 1159 and name HB1 ))
 )
      2.700     2.700     0.000 peak  5464 weight  0.10000E+01 volume  0.39660E+01 ppm1      7.954 ppm2      2.014
 ASSI (
   (( segid "    " and resid 1159 and name HN  ))
 )(
   (( segid "    " and resid 1159 and name HB2 ))
 )
      2.700     2.700     0.000 peak  5465 weight  0.10000E+01 volume  0.45360E+01 ppm1      7.956 ppm2      1.931
 ASSI (
   (( segid "    " and resid 1162 and name HN  ))
 )(
   (( segid "    " and resid 1162 and name HB2 ))
 )
      3.300     3.300     0.000 peak  5447 weight  0.10000E+01 volume  0.27570E+01 ppm1      8.041 ppm2      1.538
 ASSI (
   (( segid "    " and resid 1162 and name HN  ))
 )(
   (( segid "    " and resid 1163 and name HN  ))
 )
      6.000     6.000     0.000 peak  5414 weight  0.10000E+01 volume  0.23100E+00 ppm1      8.038 ppm2      8.996
 ASSI (
   (( segid "    " and resid 1163 and name HN  ))
 )(
   (( segid "    " and resid 1162 and name HA  ))
 )
      2.700     2.700     0.000 peak  5418 weight  0.10000E+01 volume  0.46530E+01 ppm1      8.994 ppm2      4.507
 ASSI (
   (( segid "    " and resid 1163 and name HN  ))
 )(
   (( segid "    " and resid 1162 and name HB1 ))
 )
      3.300     3.300     0.000 peak  5427 weight  0.10000E+01 volume  0.18170E+01 ppm1      8.997 ppm2      1.674
 ASSI (
   (( segid "    " and resid 1163 and name HN  ))
 )(
   (( segid "    " and resid 1162 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5426 weight  0.10000E+01 volume  0.12570E+01 ppm1      8.995 ppm2      1.537
 ASSI (
   (( segid "    " and resid 1163 and name HN  ))
 )(
   (( segid "    " and resid 1163 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5421 weight  0.10000E+01 volume  0.14080E+01 ppm1      8.997 ppm2      2.789
 ASSI (
   (( segid "    " and resid 1163 and name HN  ))
 )(
   (( segid "    " and resid 1163 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5422 weight  0.10000E+01 volume  0.99600E+00 ppm1      8.997 ppm2      2.491
 ASSI (
   (( segid "    " and resid 1163 and name HN  ))
 )(
   (( segid "    " and resid 1164 and name HN  ))
 )
      6.000     6.000     0.000 peak  5394 weight  0.10000E+01 volume  0.28300E+00 ppm1      9.000 ppm2      9.534
 ASSI (
   (( segid "    " and resid 1164 and name HN  ))
 )(
   (( segid "    " and resid 1163 and name HA  ))
 )
      2.700     2.700     0.000 peak  5397 weight  0.10000E+01 volume  0.33990E+01 ppm1      9.528 ppm2      5.036
 ASSI (
   (( segid "    " and resid 1164 and name HN  ))
 )(
   (( segid "    " and resid 1164 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5407 weight  0.10000E+01 volume  0.63800E+00 ppm1      9.530 ppm2      1.115
 ASSI (
   (( segid "    " and resid 1164 and name HN  ))
 )(
   (( segid "    " and resid 1165 and name HN  ))
 )
      6.000     6.000     0.000 peak  5373 weight  0.10000E+01 volume  0.24600E+00 ppm1      9.537 ppm2      9.781
 ASSI (
   (( segid "    " and resid 1164 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  5409 weight  0.10000E+01 volume  0.30100E+00 ppm1      9.533 ppm2      0.396
 ASSI (
   (( segid "    " and resid 1165 and name HN  ))
 )(
   (( segid "    " and resid 1164 and name HA  ))
 )
      3.300     3.300     0.000 peak  5382 weight  0.10000E+01 volume  0.18290E+01 ppm1      9.777 ppm2      4.344
 ASSI (
   (( segid "    " and resid 1165 and name HN  ))
 )(
   (( segid "    " and resid 1220 and name HN  ))
 )
      6.000     6.000     0.000 peak  5321 weight  0.10000E+01 volume  0.21600E+00 ppm1      9.777 ppm2      8.896
 ASSI (
   (( segid "    " and resid 1165 and name HN  ))
 )(
   (( segid "    " and resid 1221 and name HN  ))
 )
      6.000     6.000     0.000 peak  5378 weight  0.10000E+01 volume  0.30700E+00 ppm1      9.782 ppm2      6.345
 ASSI (
   (( segid "    " and resid 1167 and name HN  ))
 )(
   (( segid "    " and resid 1166 and name HA  ))
 )
      3.300     3.300     0.000 peak  5323 weight  0.10000E+01 volume  0.29800E+01 ppm1      9.414 ppm2      4.817
 ASSI (
   (( segid "    " and resid 1167 and name HN  ))
 )(
   (( segid "    " and resid 1167 and name HB1 ))
 )
      3.300     3.300     0.000 peak  5330 weight  0.10000E+01 volume  0.17920E+01 ppm1      9.415 ppm2      2.790
 ASSI (
   (( segid "    " and resid 1167 and name HN  ))
 )(
   (( segid "    " and resid 1191 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5327 weight  0.10000E+01 volume  0.27400E+00 ppm1      9.413 ppm2      3.521
 ASSI (
   (( segid "    " and resid 1167 and name HN  ))
 )(
   (( segid "    " and resid 1191 and name HN  ))
 )
      5.000     5.000     0.000 peak  4932 weight  0.10000E+01 volume  0.12050E+01 ppm1      9.419 ppm2      8.836
 ASSI (
   (( segid "    " and resid 1167 and name HN  ))
 )(
   (( segid "    " and resid 1192 and name HA  ))
 )
      5.000     5.000     0.000 peak  5325 weight  0.10000E+01 volume  0.67800E+00 ppm1      9.416 ppm2      4.227
 ASSI (
   (( segid "    " and resid 1168 and name HN  ))
 )(
   (( segid "    " and resid 1167 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5307 weight  0.10000E+01 volume  0.10410E+01 ppm1      8.529 ppm2      2.774
 ASSI (
   (( segid "    " and resid 1168 and name HN  ))
 )(
   (( segid "    " and resid 1167 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5308 weight  0.10000E+01 volume  0.70800E+00 ppm1      8.529 ppm2      2.683
 ASSI (
   (( segid "    " and resid 1168 and name HN  ))
 )(
   (( segid "    " and resid 1168 and name HB  ))
 )
      3.300     3.300     0.000 peak  5309 weight  0.10000E+01 volume  0.22570E+01 ppm1      8.530 ppm2      1.883
 ASSI (
   (( segid "    " and resid 1168 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))
 )
      3.300     3.300     0.000 peak  5313 weight  0.10000E+01 volume  0.27900E+01 ppm1      8.531 ppm2      0.805
 ASSI (
   (( segid "    " and resid 1168 and name HN  ))
 )(
   (( segid "    " and resid 1169 and name HN  ))
 )
      5.000     5.000     0.000 peak  5275 weight  0.10000E+01 volume  0.41900E+00 ppm1      8.535 ppm2      8.216
 ASSI (
   (( segid "    " and resid 1168 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  5315 weight  0.10000E+01 volume  0.15800E+00 ppm1      8.531 ppm2      0.516
 ASSI (
   (( segid "    " and resid 1169 and name HN  ))
 )(
   (( segid "    " and resid 1168 and name HA  ))
 )
      2.700     2.700     0.000 peak  5281 weight  0.10000E+01 volume  0.54460E+01 ppm1      8.219 ppm2      4.181
 ASSI (
   (( segid "    " and resid 1169 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))
 )
      3.300     3.300     0.000 peak  5290 weight  0.10000E+01 volume  0.23360E+01 ppm1      8.218 ppm2      0.799
 ASSI (
   (( segid "    " and resid 1169 and name HN  ))
 )(
   (( segid "    " and resid 1170 and name HN  ))
 )
      6.000     6.000     0.000 peak  5254 weight  0.10000E+01 volume  0.23500E+00 ppm1      8.216 ppm2      7.925
 ASSI (
   (( segid "    " and resid 1169 and name HN  ))
 )(
   (( segid "    " and resid 1191 and name HN  ))
 )
      6.000     6.000     0.000 peak  4934 weight  0.10000E+01 volume  0.22700E+00 ppm1      8.221 ppm2      8.839
 ASSI (
   (( segid "    " and resid 1170 and name HN  ))
 )(
   (( segid "    " and resid 1171 and name HN  ))
 )
      6.000     6.000     0.000 peak  5100 weight  0.10000E+01 volume  0.28700E+00 ppm1      7.926 ppm2      8.997
 ASSI (
   (( segid "    " and resid 1170 and name HN  ))
 )(
   (( segid "    " and resid 1173 and name HN  ))
 )
      6.000     6.000     0.000 peak  5255 weight  0.10000E+01 volume  0.24700E+00 ppm1      7.922 ppm2      7.349
 ASSI (
   (( segid "    " and resid 1171 and name HN  ))
 )(
   (( segid "    " and resid 1171 and name HA  ))
 )
      3.300     3.300     0.000 peak  5243 weight  0.10000E+01 volume  0.19030E+01 ppm1      8.990 ppm2      4.087
 ASSI (
   (( segid "    " and resid 1171 and name HN  ))
 )(
   (( segid "    " and resid 1171 and name HB2 ))
  OR 
   (( segid "    " and resid 1171 and name HB1 ))
 )
      2.700     2.700     0.000 peak  5251 weight  0.10000E+01 volume  0.34910E+01 ppm1      8.988 ppm2      1.850
 ASSI (
   (( segid "    " and resid 1171 and name HN  ))
 )(
   (( segid "    " and resid 1172 and name HN  ))
 )
      3.300     3.300     0.000 peak  5223 weight  0.10000E+01 volume  0.18140E+01 ppm1      8.990 ppm2      8.334
 ASSI (
   (( segid "    " and resid 1172 and name HN  ))
 )(
   (( segid "    " and resid 1173 and name HN  ))
 )
      5.000     5.000     0.000 peak  5225 weight  0.10000E+01 volume  0.15460E+01 ppm1      8.337 ppm2      7.356
 ASSI (
   (( segid "    " and resid 1173 and name HN  ))
 )(
   (( segid "    " and resid 1173 and name HA  ))
 )
      5.000     5.000     0.000 peak  5229 weight  0.10000E+01 volume  0.78300E+00 ppm1      7.355 ppm2      3.178
 ASSI (
   (( segid "    " and resid 1174 and name HN  ))
 )(
   (( segid "    " and resid 1173 and name HN  ))
 )
      5.000     5.000     0.000 peak  5204 weight  0.10000E+01 volume  0.15220E+01 ppm1      7.440 ppm2      7.346
 ASSI (
   (( segid "    " and resid 1174 and name HN  ))
 )(
   (( 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  5190 weight  0.10000E+01 volume  0.34300E+00 ppm1      7.439 ppm2      0.355
 ASSI (
   (( segid "    " and resid 1175 and name HN  ))
 )(
   (( segid "    " and resid 1174 and name HN  ))
 )
      3.300     3.300     0.000 peak  5184 weight  0.10000E+01 volume  0.18140E+01 ppm1      7.785 ppm2      7.435
 ASSI (
   (( segid "    " and resid 1175 and name HN  ))
 )(
   (( segid "    " and resid 1175 and name HB2 ))
  OR 
   (( segid "    " and resid 1175 and name HB1 ))
 )
      2.700     2.700     0.000 peak  5217 weight  0.10000E+01 volume  0.33680E+01 ppm1      7.786 ppm2      2.031
 ASSI (
   (( segid "    " and resid 1175 and name HN  ))
 )(
   (( 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  5221 weight  0.10000E+01 volume  0.14100E+00 ppm1      7.787 ppm2      0.354
 ASSI (
   (( segid "    " and resid 1176 and name HN  ))
 )(
   (( segid "    " and resid 1173 and name HA  ))
 )
      5.000     5.000     0.000 peak  5175 weight  0.10000E+01 volume  0.10730E+01 ppm1      7.537 ppm2      3.175
 ASSI (
   (( segid "    " and resid 1176 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  5172 weight  0.10000E+01 volume  0.23300E+00 ppm1      7.534 ppm2     -0.422
 ASSI (
   (( segid "    " and resid 1176 and name HN  ))
 )(
   (( segid "    " and resid 1175 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5178 weight  0.10000E+01 volume  0.11550E+01 ppm1      7.535 ppm2      1.989
 ASSI (
   (( segid "    " and resid 1176 and name HN  ))
 )(
   (( segid "    " and resid 1175 and name HN  ))
 )
      3.300     3.300     0.000 peak  5167 weight  0.10000E+01 volume  0.21990E+01 ppm1      7.534 ppm2      7.784
 ASSI (
   (( segid "    " and resid 1176 and name HN  ))
 )(
   (( segid "    " and resid 1176 and name HA  ))
 )
      3.300     3.300     0.000 peak  5173 weight  0.10000E+01 volume  0.22170E+01 ppm1      7.535 ppm2      4.358
 ASSI (
   (( segid "    " and resid 1176 and name HN  ))
 )(
   (( segid "    " and resid 1176 and name HB1 ))
 )
      2.700     2.700     0.000 peak  5183 weight  0.10000E+01 volume  0.38100E+01 ppm1      7.536 ppm2      2.626
 ASSI (
   (( segid "    " and resid 1176 and name HN  ))
 )(
   (( segid "    " and resid 1177 and name HE2 ))
  OR 
   (( segid "    " and resid 1177 and name HE1 ))
 )
      6.000     6.000     0.000 peak  1484 weight  0.10000E+01 volume  0.88000E-01 ppm1      7.533 ppm2      6.559
 ASSI (
   (( segid "    " and resid 1176 and name HN  ))
 )(
   (( segid "    " and resid 1177 and name HN  ))
 )
      3.300     3.300     0.000 peak  5166 weight  0.10000E+01 volume  0.22800E+01 ppm1      7.534 ppm2      7.874
 ASSI (
   (( segid "    " and resid 1177 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  6561 weight  0.10000E+01 volume  0.25600E+00 ppm1      7.875 ppm2     -0.420
 ASSI (
   (( segid "    " and resid 1177 and name HN  ))
 )(
   (( segid "    " and resid 1174 and name HA  ))
 )
      5.000     5.000     0.000 peak  6555 weight  0.10000E+01 volume  0.45300E+00 ppm1      7.876 ppm2      3.486
 ASSI (
   (( segid "    " and resid 1177 and name HN  ))
 )(
   (( segid "    " and resid 1176 and name HB2 ))
 )
      3.300     3.300     0.000 peak  6560 weight  0.10000E+01 volume  0.21510E+01 ppm1      7.875 ppm2      2.579
 ASSI (
   (( segid "    " and resid 1177 and name HN  ))
 )(
   (( segid "    " and resid 1177 and name HD2 ))
  OR 
   (( segid "    " and resid 1177 and name HD1 ))
 )
      5.000     5.000     0.000 peak  6179 weight  0.10000E+01 volume  0.71700E+00 ppm1      7.875 ppm2      6.779
 ASSI (
   (( segid "    " and resid 1177 and name HN  ))
 )(
   (( segid "    " and resid 1177 and name HE2 ))
  OR 
   (( segid "    " and resid 1177 and name HE1 ))
 )
      6.000     6.000     0.000 peak  6180 weight  0.10000E+01 volume  0.21500E+00 ppm1      7.873 ppm2      6.569
 ASSI (
   (( segid "    " and resid 1177 and name HN  ))
 )(
   (( segid "    " and resid 1178 and name HA  ))
 )
      5.000     5.000     0.000 peak  6178 weight  0.10000E+01 volume  0.92300E+00 ppm1      7.874 ppm2      3.920
 ASSI (
   (( segid "    " and resid 1177 and name HN  ))
 )(
   (( segid "    " and resid 1178 and name HN  ))
 )
      3.300     3.300     0.000 peak  5149 weight  0.10000E+01 volume  0.28320E+01 ppm1      7.874 ppm2      7.579
 ASSI (
   (( segid "    " and resid 1177 and name HN  ))
 )(
   (( 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  6562 weight  0.10000E+01 volume  0.23500E+00 ppm1      7.875 ppm2      0.354
 ASSI (
   (( segid "    " and resid 1178 and name HN  ))
 )(
   (( segid "    " and resid 1176 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5157 weight  0.10000E+01 volume  0.51600E+00 ppm1      7.583 ppm2      2.586
 ASSI (
   (( segid "    " and resid 1178 and name HN  ))
 )(
   (( segid "    " and resid 1177 and name HA  ))
 )
      5.000     5.000     0.000 peak  5150 weight  0.10000E+01 volume  0.80300E+00 ppm1      7.581 ppm2      4.719
 ASSI (
   (( segid "    " and resid 1178 and name HN  ))
 )(
   (( segid "    " and resid 1177 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5152 weight  0.10000E+01 volume  0.54700E+00 ppm1      7.582 ppm2      3.691
 ASSI (
   (( segid "    " and resid 1178 and name HN  ))
 )(
   (( segid "    " and resid 1178 and name HA  ))
 )
      2.700     2.700     0.000 peak  5153 weight  0.10000E+01 volume  0.48040E+01 ppm1      7.582 ppm2      3.911
 ASSI (
   (( segid "    " and resid 1178 and name HN  ))
 )(
   (( segid "    " and resid 1178 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5155 weight  0.10000E+01 volume  0.83700E+00 ppm1      7.581 ppm2      2.805
 ASSI (
   (( segid "    " and resid 1178 and name HN  ))
 )(
   (( 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  5165 weight  0.10000E+01 volume  0.18000E+00 ppm1      7.578 ppm2      0.351
 ASSI (
   (( segid "    " and resid 1178 and name HD21))
 )(
   (( segid "    " and resid 1177 and name HA  ))
 )
      6.000     6.000     0.000 peak  8474 weight  0.10000E+01 volume  0.13600E+00 ppm1      7.118 ppm2      4.726
 ASSI (
   (( segid "    " and resid 1178 and name HD22))
 )(
   (( segid "    " and resid 1177 and name HA  ))
 )
      6.000     6.000     0.000 peak  8475 weight  0.10000E+01 volume  0.19700E+00 ppm1      6.791 ppm2      4.726
 ASSI (
   (( segid "    " and resid 1179 and name HN  ))
 )(
   (( segid "    " and resid 1178 and name HN  ))
 )
      5.000     5.000     0.000 peak  5126 weight  0.10000E+01 volume  0.13590E+01 ppm1      7.865 ppm2      7.578
 ASSI (
   (( segid "    " and resid 1179 and name HN  ))
 )(
   (( segid "    " and resid 1179 and name HA  ))
 )
      5.000     5.000     0.000 peak  5130 weight  0.10000E+01 volume  0.53300E+00 ppm1      7.869 ppm2      5.221
 ASSI (
   (( segid "    " and resid 1179 and name HN  ))
 )(
   (( 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  5143 weight  0.10000E+01 volume  0.96200E+00 ppm1      7.863 ppm2      0.351
 ASSI (
   (( segid "    " and resid 1179 and name HN  ))
 )(
   (( segid "    " and resid 1180 and name HN  ))
 )
      6.000     6.000     0.000 peak  5103 weight  0.10000E+01 volume  0.15100E+00 ppm1      7.860 ppm2      8.993
 ASSI (
   (( segid "    " and resid 1180 and name HN  ))
 )(
   (( segid "    " and resid 1179 and name HA  ))
 )
      3.300     3.300     0.000 peak  5106 weight  0.10000E+01 volume  0.27220E+01 ppm1      8.984 ppm2      5.217
 ASSI (
   (( segid "    " and resid 1180 and name HN  ))
 )(
   (( 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  5124 weight  0.10000E+01 volume  0.43600E+00 ppm1      8.982 ppm2      0.352
 ASSI (
   (( segid "    " and resid 1180 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  5122 weight  0.10000E+01 volume  0.15250E+01 ppm1      8.981 ppm2      0.727
 ASSI (
   (( segid "    " and resid 1182 and name HN  ))
 )(
   (( segid "    " and resid 1183 and name HN  ))
 )
      5.000     5.000     0.000 peak  5063 weight  0.10000E+01 volume  0.73300E+00 ppm1      8.082 ppm2      8.467
 ASSI (
   (( segid "    " and resid 1182 and name HN  ))
 )(
   (( segid "    " and resid 1200 and name HN  ))
 )
      6.000     6.000     0.000 peak  4777 weight  0.10000E+01 volume  0.23500E+00 ppm1      8.080 ppm2      9.045
 ASSI (
   (( segid "    " and resid 1183 and name HE1 ))
 )(
   (( segid "    " and resid 1183 and name HD1 ))
 )
      2.700     2.700     0.000 peak  5369 weight  0.10000E+01 volume  0.81000E+01 ppm1     10.074 ppm2      7.283
 ASSI (
   (( segid "    " and resid 1184 and name HN  ))
 )(
   (( segid "    " and resid 1183 and name HN  ))
 )
      5.000     5.000     0.000 peak  5043 weight  0.10000E+01 volume  0.76800E+00 ppm1      7.561 ppm2      8.474
 ASSI (
   (( segid "    " and resid 1184 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))
 )
      3.300     3.300     0.000 peak  5057 weight  0.10000E+01 volume  0.29310E+01 ppm1      7.562 ppm2      1.099
 ASSI (
   (( segid "    " and resid 1184 and name HN  ))
 )(
   (( segid "    " and resid 1185 and name HN  ))
 )
      3.300     3.300     0.000 peak  5033 weight  0.10000E+01 volume  0.17370E+01 ppm1      7.561 ppm2      8.255
 ASSI (
   (( segid "    " and resid 1185 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))
 )
      5.000     5.000     0.000 peak  5040 weight  0.10000E+01 volume  0.66500E+00 ppm1      8.254 ppm2      1.098
 ASSI (
   (( segid "    " and resid 1185 and name HN  ))
 )(
   (( segid "    " and resid 1186 and name HN  ))
 )
      5.000     5.000     0.000 peak  5021 weight  0.10000E+01 volume  0.16180E+01 ppm1      8.251 ppm2      7.719
 ASSI (
   (( segid "    " and resid 1186 and name HN  ))
 )(
   (( segid "    " and resid 1187 and name HN  ))
 )
      3.300     3.300     0.000 peak  5019 weight  0.10000E+01 volume  0.19530E+01 ppm1      7.723 ppm2      8.038
 ASSI (
   (( segid "    " and resid 1187 and name HN  ))
 )(
   (( segid "    " and resid 1175 and name HB1 ))
 )
      2.700     2.700     0.000 peak  5012 weight  0.10000E+01 volume  0.34720E+01 ppm1      8.040 ppm2      2.028
 ASSI (
   (( segid "    " and resid 1187 and name HN  ))
 )(
   (( segid "    " and resid 1175 and name HB2 ))
 )
      2.700     2.700     0.000 peak  5013 weight  0.10000E+01 volume  0.32450E+01 ppm1      8.041 ppm2      1.984
 ASSI (
   (( segid "    " and resid 1187 and name HN  ))
 )(
   (( segid "    " and resid 1187 and name HG1 ))
 )
      5.000     5.000     0.000 peak  5010 weight  0.10000E+01 volume  0.72100E+00 ppm1      8.041 ppm2      2.297
 ASSI (
   (( segid "    " and resid 1187 and name HN  ))
 )(
   (( segid "    " and resid 1187 and name HG2 ))
 )
      5.000     5.000     0.000 peak  5011 weight  0.10000E+01 volume  0.63300E+00 ppm1      8.041 ppm2      2.194
 ASSI (
   (( segid "    " and resid 1188 and name HN  ))
 )(
   (( segid "    " and resid 1187 and name HG1 ))
 )
      6.000     6.000     0.000 peak  4996 weight  0.10000E+01 volume  0.27800E+00 ppm1      8.046 ppm2      2.301
 ASSI (
   (( segid "    " and resid 1188 and name HN  ))
 )(
   (( segid "    " and resid 1187 and name HG2 ))
 )
      6.000     6.000     0.000 peak  4997 weight  0.10000E+01 volume  0.28100E+00 ppm1      8.042 ppm2      2.204
 ASSI (
   (( segid "    " and resid 1188 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HN  ))
 )
      6.000     6.000     0.000 peak  4977 weight  0.10000E+01 volume  0.25900E+00 ppm1      8.046 ppm2      8.429
 ASSI (
   (( segid "    " and resid 1189 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HG  ))
 )
      3.300     3.300     0.000 peak  9371 weight  0.10000E+01 volume  0.25810E+01 ppm1      8.427 ppm2      1.516
 ASSI (
   (( segid "    " and resid 1189 and name HN  ))
 )(
   (( segid "    " and resid 1190 and name HA  ))
 )
      6.000     6.000     0.000 peak  4980 weight  0.10000E+01 volume  0.10900E+00 ppm1      8.434 ppm2      5.334
 ASSI (
   (( segid "    " and resid 1189 and name HN  ))
 )(
   (( segid "    " and resid 1190 and name HN  ))
 )
      5.000     5.000     0.000 peak  4975 weight  0.10000E+01 volume  0.13000E+01 ppm1      8.434 ppm2      7.366
 ASSI (
   (( segid "    " and resid 1190 and name HN  ))
 )(
   (( segid "    " and resid 1190 and name HA  ))
 )
      5.000     5.000     0.000 peak  4960 weight  0.10000E+01 volume  0.69300E+00 ppm1      7.367 ppm2      5.338
 ASSI (
   (( segid "    " and resid 1190 and name HN  ))
 )(
   (( segid "    " and resid 1191 and name HN  ))
 )
      6.000     6.000     0.000 peak  4936 weight  0.10000E+01 volume  0.21300E+00 ppm1      7.367 ppm2      8.841
 ASSI (
   (( segid "    " and resid 1191 and name HN  ))
 )(
   (( segid "    " and resid 1166 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4946 weight  0.10000E+01 volume  0.23200E+00 ppm1      8.831 ppm2      2.194
 ASSI (
   (( segid "    " and resid 1191 and name HN  ))
 )(
   (( segid "    " and resid 1166 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4948 weight  0.10000E+01 volume  0.26400E+00 ppm1      8.837 ppm2      1.775
 ASSI (
   (( segid "    " and resid 1191 and name HN  ))
 )(
   (( segid "    " and resid 1190 and name HA  ))
 )
      3.300     3.300     0.000 peak  4938 weight  0.10000E+01 volume  0.29180E+01 ppm1      8.840 ppm2      5.337
 ASSI (
   (( segid "    " and resid 1192 and name HN  ))
 )(
   (( segid "    " and resid 1193 and name HN  ))
 )
      6.000     6.000     0.000 peak  4901 weight  0.10000E+01 volume  0.22100E+00 ppm1      8.772 ppm2      9.054
 ASSI (
   (( segid "    " and resid 1192 and name HN  ))
 )(
   (( segid "    " and resid 1195 and name HN  ))
 )
      6.000     6.000     0.000 peak  4856 weight  0.10000E+01 volume  0.20300E+00 ppm1      8.767 ppm2      8.024
 ASSI (
   (( segid "    " and resid 1194 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))
 )
      3.300     3.300     0.000 peak  4895 weight  0.10000E+01 volume  0.17010E+01 ppm1      9.149 ppm2      0.395
 ASSI (
   (( segid "    " and resid 1194 and name HN  ))
 )(
   (( segid "    " and resid 1195 and name HN  ))
 )
      5.000     5.000     0.000 peak  4853 weight  0.10000E+01 volume  0.14580E+01 ppm1      9.147 ppm2      8.020
 ASSI (
   (( segid "    " and resid 1194 and name HN  ))
 )(
   (( segid "    " and resid 1218 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4889 weight  0.10000E+01 volume  0.25000E+00 ppm1      9.151 ppm2      2.804
 ASSI (
   (( segid "    " and resid 1194 and name HN  ))
 )(
   (( segid "    " and resid 1218 and name HN  ))
 )
      6.000     6.000     0.000 peak  4877 weight  0.10000E+01 volume  0.26600E+00 ppm1      9.151 ppm2      8.284
 ASSI (
   (( segid "    " and resid 1196 and name HN  ))
 )(
   (( segid "    " and resid 1197 and name HN  ))
 )
      5.000     5.000     0.000 peak  4758 weight  0.10000E+01 volume  0.47500E+00 ppm1      8.481 ppm2      8.960
 ASSI (
   (( segid "    " and resid 1197 and name HN  ))
 )(
   (( segid "    " and resid 1197 and name HB  ))
 )
      3.300     3.300     0.000 peak  4843 weight  0.10000E+01 volume  0.17280E+01 ppm1      8.951 ppm2      1.533
 ASSI (
   (( segid "    " and resid 1197 and name HN  ))
 )(
   (( segid "    " and resid 1198 and name HN  ))
 )
      6.000     6.000     0.000 peak  4817 weight  0.10000E+01 volume  0.37100E+00 ppm1      8.953 ppm2      7.955
 ASSI (
   (( segid "    " and resid 1199 and name HN  ))
 )(
   (( segid "    " and resid 1200 and name HN  ))
 )
      6.000     6.000     0.000 peak  4796 weight  0.10000E+01 volume  0.33300E+00 ppm1      8.432 ppm2      9.035
 ASSI (
   (( segid "    " and resid 1201 and name HN  ))
 )(
   (( segid "    " and resid 1179 and name HA  ))
 )
      6.000     6.000     0.000 peak  4760 weight  0.10000E+01 volume  0.23200E+00 ppm1      8.451 ppm2      5.221
 ASSI (
   (( segid "    " and resid 1201 and name HN  ))
 )(
   (( segid "    " and resid 1200 and name HB  ))
 )
      2.700     2.700     0.000 peak  4770 weight  0.10000E+01 volume  0.32320E+01 ppm1      8.446 ppm2      2.092
 ASSI (
   (( segid "    " and resid 1201 and name HN  ))
 )(
   (( segid "    " and resid 1200 and name HN  ))
 )
      6.000     6.000     0.000 peak  4757 weight  0.10000E+01 volume  0.31100E+00 ppm1      8.449 ppm2      9.047
 ASSI (
   (( segid "    " and resid 1201 and name HN  ))
 )(
   (( segid "    " and resid 1202 and name HN  ))
 )
      6.000     6.000     0.000 peak  4735 weight  0.10000E+01 volume  0.38200E+00 ppm1      8.449 ppm2      7.927
 ASSI (
   (( segid "    " and resid 1202 and name HN  ))
 )(
   (( 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  5125 weight  0.10000E+01 volume  0.10900E+00 ppm1      7.930 ppm2      0.348
 ASSI (
   (( segid "    " and resid 1203 and name HN  ))
 )(
   (( segid "    " and resid 1202 and name HN  ))
 )
      5.000     5.000     0.000 peak  4717 weight  0.10000E+01 volume  0.49000E+00 ppm1      8.286 ppm2      7.922
 ASSI (
   (( segid "    " and resid 1203 and name HN  ))
 )(
   (( segid "    " and resid 1204 and name HN  ))
 )
      5.000     5.000     0.000 peak  4714 weight  0.10000E+01 volume  0.49600E+00 ppm1      8.291 ppm2      8.887
 ASSI (
   (( segid "    " and resid 1205 and name HN  ))
 )(
   (( segid "    " and resid 1206 and name HN  ))
 )
      5.000     5.000     0.000 peak  4682 weight  0.10000E+01 volume  0.61200E+00 ppm1      8.300 ppm2      9.340
 ASSI (
   (( segid "    " and resid 1206 and name HN  ))
 )(
   (( segid "    " and resid 1201 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4692 weight  0.10000E+01 volume  0.21200E+00 ppm1      9.337 ppm2      3.022
 ASSI (
   (( segid "    " and resid 1206 and name HN  ))
 )(
   (( segid "    " and resid 1207 and name HN  ))
 )
      5.000     5.000     0.000 peak  4663 weight  0.10000E+01 volume  0.44700E+00 ppm1      9.338 ppm2      8.761
 ASSI (
   (( segid "    " and resid 1206 and name HN  ))
 )(
   (( segid "    " and resid 1228 and name HA  ))
 )
      5.000     5.000     0.000 peak  4685 weight  0.10000E+01 volume  0.64600E+00 ppm1      9.336 ppm2      5.514
 ASSI (
   (( segid "    " and resid 1206 and name HN  ))
 )(
   (( segid "    " and resid 1231 and name HN  ))
 )
      5.000     5.000     0.000 peak  4683 weight  0.10000E+01 volume  0.53600E+00 ppm1      9.335 ppm2      7.749
 ASSI (
   (( segid "    " and resid 1207 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  4675 weight  0.10000E+01 volume  0.12000E+01 ppm1      8.755 ppm2      0.931
 ASSI (
   (( segid "    " and resid 1207 and name HN  ))
 )(
   (( segid "    " and resid 1208 and name HN  ))
 )
      5.000     5.000     0.000 peak  4640 weight  0.10000E+01 volume  0.59500E+00 ppm1      8.757 ppm2      8.896
 ASSI (
   (( segid "    " and resid 1207 and name HN  ))
 )(
   (( segid "    " and resid 1228 and name HA  ))
 )
      6.000     6.000     0.000 peak  4665 weight  0.10000E+01 volume  0.16000E+00 ppm1      8.756 ppm2      5.516
 ASSI (
   (( segid "    " and resid 1208 and name HN  ))
 )(
   (( segid "    " and resid 1209 and name HN  ))
 )
      5.000     5.000     0.000 peak  4626 weight  0.10000E+01 volume  0.82800E+00 ppm1      8.898 ppm2      8.398
 ASSI (
   (( segid "    " and resid 1208 and name HN  ))
 )(
   (( segid "    " and resid 1228 and name HA  ))
 )
      3.300     3.300     0.000 peak  4643 weight  0.10000E+01 volume  0.21060E+01 ppm1      8.895 ppm2      5.517
 ASSI (
   (( segid "    " and resid 1209 and name HN  ))
 )(
   (( segid "    " and resid 1210 and name HN  ))
 )
      5.000     5.000     0.000 peak  4609 weight  0.10000E+01 volume  0.73900E+00 ppm1      8.404 ppm2      8.062
 ASSI (
   (( segid "    " and resid 1210 and name HN  ))
 )(
   (( segid "    " and resid 1211 and name HN  ))
 )
      5.000     5.000     0.000 peak  4607 weight  0.10000E+01 volume  0.11280E+01 ppm1      8.061 ppm2      7.560
 ASSI (
   (( segid "    " and resid 1211 and name HN  ))
 )(
   (( segid "    " and resid 1212 and name HN  ))
 )
      6.000     6.000     0.000 peak  4581 weight  0.10000E+01 volume  0.22400E+00 ppm1      7.565 ppm2      8.565
 ASSI (
   (( segid "    " and resid 1214 and name HN  ))
 )(
   (( segid "    " and resid 1213 and name HN  ))
 )
      6.000     6.000     0.000 peak  4545 weight  0.10000E+01 volume  0.31200E+00 ppm1      8.374 ppm2      7.817
 ASSI (
   (( segid "    " and resid 1214 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))
 )
      5.000     5.000     0.000 peak  4557 weight  0.10000E+01 volume  0.11190E+01 ppm1      8.374 ppm2      0.661
 ASSI (
   (( segid "    " and resid 1214 and name HN  ))
 )(
   (( segid "    " and resid 1215 and name HN  ))
 )
      3.300     3.300     0.000 peak  4526 weight  0.10000E+01 volume  0.24930E+01 ppm1      8.375 ppm2      7.695
 ASSI (
   (( segid "    " and resid 1215 and name HN  ))
 )(
   (( segid "    " and resid 1216 and name HN  ))
 )
      5.000     5.000     0.000 peak  4501 weight  0.10000E+01 volume  0.46500E+00 ppm1      7.698 ppm2      8.740
 ASSI (
   (( segid "    " and resid 1216 and name HN  ))
 )(
   (( segid "    " and resid 1197 and name HN  ))
 )
      3.300     3.300     0.000 peak  4504 weight  0.10000E+01 volume  0.17140E+01 ppm1      8.741 ppm2      8.960
 ASSI (
   (( segid "    " and resid 1216 and name HN  ))
 )(
   (( segid "    " and resid 1217 and name HN  ))
 )
      5.000     5.000     0.000 peak  4503 weight  0.10000E+01 volume  0.42000E+00 ppm1      8.741 ppm2      8.246
 ASSI (
   (( segid "    " and resid 1217 and name HN  ))
 )(
   (( segid "    " and resid 1197 and name HN  ))
 )
      6.000     6.000     0.000 peak  4498 weight  0.10000E+01 volume  0.30600E+00 ppm1      8.248 ppm2      8.954
 ASSI (
   (( segid "    " and resid 1217 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))
 )
      3.300     3.300     0.000 peak  4491 weight  0.10000E+01 volume  0.18430E+01 ppm1      8.245 ppm2      1.121
 ASSI (
   (( segid "    " and resid 1218 and name HN  ))
 )(
   (( segid "    " and resid 1195 and name HN  ))
 )
      5.000     5.000     0.000 peak  4472 weight  0.10000E+01 volume  0.46200E+00 ppm1      8.279 ppm2      8.022
 ASSI (
   (( segid "    " and resid 1219 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  4917 weight  0.10000E+01 volume  0.72100E+00 ppm1      8.927 ppm2      0.414
 ASSI (
   (( segid "    " and resid 1219 and name HN  ))
 )(
   (( segid "    " and resid 1222 and name HN  ))
 )
      5.000     5.000     0.000 peak  4391 weight  0.10000E+01 volume  0.10450E+01 ppm1      8.926 ppm2      7.764
 ASSI (
   (( segid "    " and resid 1219 and name HE1 ))
 )(
   (( segid "    " and resid 1219 and name HD1 ))
 )
      2.700     2.700     0.000 peak  5345 weight  0.10000E+01 volume  0.87100E+01 ppm1     10.224 ppm2      7.138
 ASSI (
   (( segid "    " and resid 1219 and name HE1 ))
 )(
   (( segid "    " and resid 1219 and name HZ2 ))
 )
      2.700     2.700     0.000 peak  5344 weight  0.10000E+01 volume  0.32310E+01 ppm1     10.224 ppm2      7.390
 ASSI (
   (( segid "    " and resid 1220 and name HN  ))
 )(
   (( segid "    " and resid 1193 and name HA  ))
 )
      5.000     5.000     0.000 peak  4436 weight  0.10000E+01 volume  0.41300E+00 ppm1      8.905 ppm2      3.667
 ASSI (
   (( segid "    " and resid 1220 and name HN  ))
 )(
   (( segid "    " and resid 1193 and name HB  ))
 )
      6.000     6.000     0.000 peak  4916 weight  0.10000E+01 volume  0.21400E+00 ppm1      8.905 ppm2      3.554
 ASSI (
   (( segid "    " and resid 1220 and name HN  ))
 )(
   (( segid "    " and resid 1221 and name HN  ))
 )
      5.000     5.000     0.000 peak  4432 weight  0.10000E+01 volume  0.62100E+00 ppm1      8.901 ppm2      6.343
 ASSI (
   (( segid "    " and resid 1221 and name HN  ))
 )(
   (( segid "    " and resid 1164 and name HA  ))
 )
      6.000     6.000     0.000 peak  4414 weight  0.10000E+01 volume -0.35200E+00 ppm1      6.349 ppm2      4.360
 ASSI (
   (( segid "    " and resid 1221 and name HN  ))
 )(
   (( segid "    " and resid 1167 and name HA  ))
 )
      5.000     5.000     0.000 peak  4411 weight  0.10000E+01 volume -0.49400E+00 ppm1      6.348 ppm2      4.780
 ASSI (
   (( segid "    " and resid 1221 and name HN  ))
 )(
   (( segid "    " and resid 1219 and name HN  ))
 )
      5.000     5.000     0.000 peak  5379 weight  0.10000E+01 volume -0.96900E+00 ppm1      6.349 ppm2      8.924
 ASSI (
   (( segid "    " and resid 1221 and name HN  ))
 )(
   (( segid "    " and resid 1221 and name HA1 ))
 )
      3.300     3.300     0.000 peak  4415 weight  0.10000E+01 volume -0.20220E+01 ppm1      6.349 ppm2      4.049
 ASSI (
   (( segid "    " and resid 1221 and name HN  ))
 )(
   (( segid "    " and resid 1221 and name HA2 ))
 )
      3.300     3.300     0.000 peak  4416 weight  0.10000E+01 volume -0.20800E+01 ppm1      6.351 ppm2      3.725
 ASSI (
   (( segid "    " and resid 1221 and name HN  ))
 )(
   (( segid "    " and resid 1222 and name HN  ))
 )
      5.000     5.000     0.000 peak  4394 weight  0.10000E+01 volume -0.12280E+01 ppm1      6.353 ppm2      7.769
 ASSI (
   (( segid "    " and resid 1222 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HN  ))
 )
      5.000     5.000     0.000 peak  4392 weight  0.10000E+01 volume  0.10370E+01 ppm1      7.769 ppm2      8.143
 ASSI (
   (( segid "    " and resid 1227 and name HN  ))
 )(
   (( 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  5343 weight  0.10000E+01 volume -0.94000E-01 ppm1      7.964 ppm2      0.372
 ASSI (
   (( segid "    " and resid 1227 and name HN  ))
 )(
   (( segid "    " and resid 1201 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4353 weight  0.10000E+01 volume -0.25700E+00 ppm1      7.955 ppm2      3.035
 ASSI (
   (( segid "    " and resid 1229 and name HN  ))
 )(
   (( segid "    " and resid 1228 and name HA  ))
 )
      2.700     2.700     0.000 peak  4321 weight  0.10000E+01 volume  0.35350E+01 ppm1      9.805 ppm2      5.518
 ASSI (
   (( segid "    " and resid 1230 and name HN  ))
 )(
   (( segid "    " and resid 1229 and name HN  ))
 )
      6.000     6.000     0.000 peak  4309 weight  0.10000E+01 volume  0.25600E+00 ppm1      8.780 ppm2      9.827
 ASSI (
   (( segid "    " and resid 1230 and name HN  ))
 )(
   (( segid "    " and resid 1230 and name HG1 ))
 )
      5.000     5.000     0.000 peak  4319 weight  0.10000E+01 volume  0.95900E+00 ppm1      8.776 ppm2      1.193
 ASSI (
   (( segid "    " and resid 1230 and name HN  ))
 )(
   (( segid "    " and resid 1230 and name HG2 ))
 )
      5.000     5.000     0.000 peak  4320 weight  0.10000E+01 volume  0.86100E+00 ppm1      8.776 ppm2      1.071
 ASSI (
   (( segid "    " and resid 1230 and name HN  ))
 )(
   (( segid "    " and resid 1231 and name HN  ))
 )
      5.000     5.000     0.000 peak  4307 weight  0.10000E+01 volume  0.67900E+00 ppm1      8.779 ppm2      7.754
 ASSI (
   (( segid "    " and resid 1231 and name HN  ))
 )(
   (( segid "    " and resid 1230 and name HG1 ))
 )
      5.000     5.000     0.000 peak  4304 weight  0.10000E+01 volume  0.12510E+01 ppm1      7.756 ppm2      1.185
 ASSI (
   (( segid "    " and resid 1231 and name HN  ))
 )(
   (( segid "    " and resid 1230 and name HG2 ))
 )
      5.000     5.000     0.000 peak  4305 weight  0.10000E+01 volume  0.11980E+01 ppm1      7.756 ppm2      1.072
 ASSI (
   (( segid "    " and resid 1121 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))
 )
      3.300     3.300     0.000 peak  6011 weight  0.10000E+01 volume  0.29550E+01 ppm1      8.255 ppm2      0.949
 ASSI (
   (( segid "    " and resid 1127 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))
 )
      2.700     2.700     0.000 peak  5948 weight  0.10000E+01 volume  0.54170E+01 ppm1      6.968 ppm2      0.811
 ASSI (
   (( segid "    " and resid 1164 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  5409 weight  0.10000E+01 volume  0.30100E+00 ppm1      9.533 ppm2      0.396
 ASSI (
   (( segid "    " and resid 1177 and name HN  ))
 )(
   (( segid "    " and resid 1177 and name HD2 ))
  OR 
   (( segid "    " and resid 1177 and name HD1 ))
 )
      5.000     5.000     0.000 peak  6179 weight  0.10000E+01 volume  0.71700E+00 ppm1      7.875 ppm2      6.779
 ASSI (
   (( segid "    " and resid 1184 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))
 )
      3.300     3.300     0.000 peak  5057 weight  0.10000E+01 volume  0.29310E+01 ppm1      7.562 ppm2      1.099
 ASSI (
   (( segid "    " and resid 1214 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))
 )
      5.000     5.000     0.000 peak  4557 weight  0.10000E+01 volume  0.11190E+01 ppm1      8.374 ppm2      0.661
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLU1103           HT3      GLU1103  36.775  -3.787  -2.139
    2    H2   GLU1103           HT2      GLU1103  38.001  -4.896  -1.783
    3    H3   GLU1103           HT1      GLU1103  38.033  -4.042  -3.242
    4    HA   GLU1103           HA       GLU1103  36.016  -5.135  -3.966
    5   1HB   GLU1103           HB2      GLU1103  38.182  -7.040  -3.053
    6   2HB   GLU1103           HB1      GLU1103  36.969  -7.393  -4.276
    7   1HG   GLU1103           HG2      GLU1103  39.082  -5.255  -4.452
    8   2HG   GLU1103           HG1      GLU1103  39.110  -6.814  -5.275
    9    H    ALA1104           HN       ALA1104  37.277  -6.727  -1.030
   10    HA   ALA1104           HA       ALA1104  34.613  -7.820  -0.517
   11   1HB   ALA1104           HB3      ALA1104  36.517  -9.356  -0.420
   12   2HB   ALA1104           HB1      ALA1104  35.706  -9.230   1.141
   13   3HB   ALA1104           HB2      ALA1104  37.232  -8.387   0.869
   14    H    GLU1105           HN       GLU1105  36.908  -5.513   0.736
   15    HA   GLU1105           HA       GLU1105  35.288  -5.066   3.128
   16   1HB   GLU1105           HB2      GLU1105  37.933  -3.860   2.293
   17   2HB   GLU1105           HB1      GLU1105  37.122  -3.567   3.825
   18   1HG   GLU1105           HG2      GLU1105  37.335  -5.932   4.393
   19   2HG   GLU1105           HG1      GLU1105  38.149  -6.225   2.856
   20    H    PHE1106           HN       PHE1106  36.514  -3.304   0.302
   21    HA   PHE1106           HA       PHE1106  34.871  -0.996   0.949
   22   1HB   PHE1106           HB2      PHE1106  36.725  -1.506  -1.387
   23   2HB   PHE1106           HB1      PHE1106  35.919   0.021  -1.043
   24    HD1  PHE1106           HD1      PHE1106  36.625   1.411   0.816
   25    HD2  PHE1106           HD2      PHE1106  38.611  -2.242  -0.088
   26    HE1  PHE1106           HE1      PHE1106  38.511   2.090   2.243
   27    HE2  PHE1106           HE2      PHE1106  40.502  -1.571   1.338
   28    HZ   PHE1106           HZ       PHE1106  40.453   0.597   2.506
   29    H    GLY1107           HN       GLY1107  32.792  -1.004   0.407
   30   1HA   GLY1107           HA1      GLY1107  31.560  -2.803  -1.323
   31   2HA   GLY1107           HA2      GLY1107  31.910  -1.347  -2.239
   32    H    LYS1108           HN       LYS1108  31.569   0.191   0.385
   33    HA   LYS1108           HA       LYS1108  28.996  -0.064   1.384
   34   1HB   LYS1108           HB2      LYS1108  30.683   2.411   0.996
   35   2HB   LYS1108           HB1      LYS1108  29.167   2.401   1.886
   36   1HG   LYS1108           HG2      LYS1108  30.139   0.716   3.422
   37   2HG   LYS1108           HG1      LYS1108  31.677   0.890   2.573
   38   1HD   LYS1108           HD2      LYS1108  31.764   3.244   3.162
   39   2HD   LYS1108           HD1      LYS1108  30.189   3.124   3.949
   40   1HE   LYS1108           HE2      LYS1108  31.997   3.073   5.585
   41   2HE   LYS1108           HE1      LYS1108  31.107   1.551   5.569
   42   1HZ   LYS1108           HZ3      LYS1108  32.858   0.583   4.214
   43   2HZ   LYS1108           HZ2      LYS1108  33.714   2.041   4.233
   44   3HZ   LYS1108           HZ1      LYS1108  33.487   1.177   5.668
   45    H    CYS1109           HN       CYS1109  27.037   0.314   0.639
   46    HA   CYS1109           HA       CYS1109  26.735   1.186  -2.095
   47   1HB   CYS1109           HB2      CYS1109  24.247   0.753  -1.517
   48   2HB   CYS1109           HB1      CYS1109  25.346  -0.618  -1.624
   49    H    GLY1110           HN       GLY1110  24.677   2.583  -2.471
   50   1HA   GLY1110           HA1      GLY1110  24.579   5.006  -2.550
   51   2HA   GLY1110           HA2      GLY1110  25.022   5.024  -0.848
   52    HA   PRO1111           HA       PRO1111  20.633   5.652  -0.266
   53   1HB   PRO1111           HB2      PRO1111  19.859   6.788  -2.880
   54   2HB   PRO1111           HB1      PRO1111  19.716   7.481  -1.260
   55   1HG   PRO1111           HG2      PRO1111  21.534   8.382  -3.022
   56   2HG   PRO1111           HG1      PRO1111  21.874   8.312  -1.283
   57   1HD   PRO1111           HD2      PRO1111  22.764   6.468  -3.466
   58   2HD   PRO1111           HD1      PRO1111  23.661   7.056  -2.051
   59    HA   PRO1112           HA       PRO1112  19.011   1.998  -2.243
   60   1HB   PRO1112           HB2      PRO1112  16.781   2.006  -0.435
   61   2HB   PRO1112           HB1      PRO1112  18.219   0.986  -0.394
   62   1HG   PRO1112           HG2      PRO1112  17.612   2.930   1.466
   63   2HG   PRO1112           HG1      PRO1112  19.233   2.284   1.165
   64   1HD   PRO1112           HD2      PRO1112  18.010   4.843   0.244
   65   2HD   PRO1112           HD1      PRO1112  19.685   4.496   0.722
   66    HA   PRO1113           HA       PRO1113  16.050   3.905  -5.060
   67   1HB   PRO1113           HB2      PRO1113  15.587   1.044  -5.748
   68   2HB   PRO1113           HB1      PRO1113  15.934   2.414  -6.809
   69   1HG   PRO1113           HG2      PRO1113  17.814   0.608  -6.267
   70   2HG   PRO1113           HG1      PRO1113  18.215   2.332  -6.384
   71   1HD   PRO1113           HD2      PRO1113  17.900   0.616  -3.958
   72   2HD   PRO1113           HD1      PRO1113  19.052   1.931  -4.269
   73    HA   PRO1114           HA       PRO1114  12.296   2.995  -2.803
   74   1HB   PRO1114           HB2      PRO1114  10.827   4.971  -3.707
   75   2HB   PRO1114           HB1      PRO1114  12.338   5.346  -2.865
   76   1HG   PRO1114           HG2      PRO1114  11.790   5.237  -5.818
   77   2HG   PRO1114           HG1      PRO1114  12.646   6.490  -4.897
   78   1HD   PRO1114           HD2      PRO1114  13.865   4.405  -6.262
   79   2HD   PRO1114           HD1      PRO1114  14.608   5.313  -4.928
   80    H    ILE1115           HN       ILE1115   9.910   2.812  -3.288
   81    HA   ILE1115           HA       ILE1115   9.488   1.172  -5.669
   82    HB   ILE1115           HB       ILE1115   7.150   1.356  -4.033
   83   1HG1  ILE1115          2HG1      ILE1115   9.650   0.591  -2.504
   84   2HG1  ILE1115          1HG1      ILE1115   8.718   2.061  -2.243
   85   1HG2  ILE1115          3HG2      ILE1115   9.122  -0.840  -4.584
   86   2HG2  ILE1115          2HG2      ILE1115   7.572  -1.078  -3.777
   87   3HG2  ILE1115          1HG2      ILE1115   7.620  -0.508  -5.446
   88   1HD1  ILE1115          1HD1      ILE1115   6.794   0.722  -1.571
   89   2HD1  ILE1115          3HD1      ILE1115   7.730  -0.751  -1.829
   90   3HD1  ILE1115          2HD1      ILE1115   8.205   0.388  -0.567
   91    H    ASP1116           HN       ASP1116   6.885   1.416  -6.225
   92    HA   ASP1116           HA       ASP1116   6.687   3.906  -7.558
   93   1HB   ASP1116           HB2      ASP1116   5.547   1.865  -8.368
   94   2HB   ASP1116           HB1      ASP1116   4.500   1.896  -6.951
   95    H    ASN1117           HN       ASN1117   6.938   5.519  -6.021
   96    HA   ASN1117           HA       ASN1117   6.160   7.168  -4.650
   97   1HB   ASN1117           HB2      ASN1117   3.588   5.578  -4.442
   98   2HB   ASN1117           HB1      ASN1117   3.825   7.264  -3.988
   99   1HD2  ASN1117          1HD2      ASN1117   1.994   6.009  -5.918
  100   2HD2  ASN1117          2HD2      ASN1117   2.294   6.801  -7.423
  101    H    GLY1118           HN       GLY1118   7.290   4.430  -3.900
  102   1HA   GLY1118           HA1      GLY1118   7.382   3.064  -1.952
  103   2HA   GLY1118           HA2      GLY1118   6.453   4.282  -1.090
  104    H    ASP1119           HN       ASP1119   8.813   3.078  -0.103
  105    HA   ASP1119           HA       ASP1119  11.238   4.207  -0.362
  106   1HB   ASP1119           HB2      ASP1119  11.302   6.185   1.121
  107   2HB   ASP1119           HB1      ASP1119  10.280   6.461  -0.286
  108    H    ILE1120           HN       ILE1120  12.542   4.275   1.708
  109    HA   ILE1120           HA       ILE1120  12.135   1.961   3.166
  110    HB   ILE1120           HB       ILE1120  13.554   4.088   4.629
  111   1HG1  ILE1120          2HG1      ILE1120  14.447   3.184   1.877
  112   2HG1  ILE1120          1HG1      ILE1120  14.012   4.826   2.343
  113   1HG2  ILE1120          3HG2      ILE1120  14.270   1.337   3.642
  114   2HG2  ILE1120          2HG2      ILE1120  15.264   2.321   4.717
  115   3HG2  ILE1120          1HG2      ILE1120  13.682   1.750   5.251
  116   1HD1  ILE1120          1HD1      ILE1120  16.365   3.269   3.384
  117   2HD1  ILE1120          3HD1      ILE1120  16.417   4.566   2.190
  118   3HD1  ILE1120          2HD1      ILE1120  15.927   4.912   3.849
  119    H    THR1121           HN       THR1121  11.500   1.581   5.326
  120    HA   THR1121           HA       THR1121   9.125   2.945   6.072
  121    HB   THR1121           HB       THR1121   9.112   1.466   8.041
  122    HG1  THR1121           HG1      THR1121  11.127   1.064   8.677
  123   1HG2  THR1121          3HG2      THR1121   9.856   0.074   5.464
  124   2HG2  THR1121          2HG2      THR1121   9.023  -0.671   6.828
  125   3HG2  THR1121          1HG2      THR1121   8.244   0.624   5.919
  126    H    SER1122           HN       SER1122  12.136   4.082   6.333
  127    HA   SER1122           HA       SER1122  11.520   5.487   8.850
  128   1HB   SER1122           HB2      SER1122  14.255   4.625   7.879
  129   2HB   SER1122           HB1      SER1122  13.945   5.600   9.316
  130    HG   SER1122           HG       SER1122  12.636   3.139   9.046
  131    H    PHE1123           HN       PHE1123  14.351   6.142   6.939
  132    HA   PHE1123           HA       PHE1123  13.156   8.311   5.463
  133   1HB   PHE1123           HB2      PHE1123  13.506   9.284   7.728
  134   2HB   PHE1123           HB1      PHE1123  15.222   8.921   7.588
  135    HD1  PHE1123           HD1      PHE1123  12.479  10.988   6.267
  136    HD2  PHE1123           HD2      PHE1123  16.679  10.294   6.313
  137    HE1  PHE1123           HE1      PHE1123  12.846  13.157   5.164
  138    HE2  PHE1123           HE2      PHE1123  17.053  12.462   5.210
  139    HZ   PHE1123           HZ       PHE1123  15.135  13.897   4.634
  140    HA   PRO1124           HA       PRO1124  16.053   6.635   2.491
  141   1HB   PRO1124           HB2      PRO1124  16.032   9.569   1.859
  142   2HB   PRO1124           HB1      PRO1124  16.009   8.188   0.757
  143   1HG   PRO1124           HG2      PRO1124  13.763   9.520   1.414
  144   2HG   PRO1124           HG1      PRO1124  13.769   7.775   1.106
  145   1HD   PRO1124           HD2      PRO1124  13.366   9.211   3.628
  146   2HD   PRO1124           HD1      PRO1124  13.019   7.517   3.232
  147    H    LEU1125           HN       LEU1125  18.166   6.276   2.625
  148    HA   LEU1125           HA       LEU1125  19.834   8.131   4.183
  149   1HB   LEU1125           HB2      LEU1125  20.272   5.217   3.483
  150   2HB   LEU1125           HB1      LEU1125  21.418   6.214   4.347
  151    HG   LEU1125           HG       LEU1125  20.144   4.685   5.808
  152   1HD1  LEU1125          1HD1      LEU1125  19.726   7.629   6.268
  153   2HD1  LEU1125          3HD1      LEU1125  19.544   6.377   7.498
  154   3HD1  LEU1125          2HD1      LEU1125  21.119   6.661   6.755
  155   1HD2  LEU1125          2HD2      LEU1125  18.008   4.769   4.549
  156   2HD2  LEU1125          1HD2      LEU1125  17.821   5.052   6.282
  157   3HD2  LEU1125          3HD2      LEU1125  17.765   6.406   5.156
  158    H    SER1126           HN       SER1126  21.887   8.745   3.380
  159    HA   SER1126           HA       SER1126  22.041   8.716   0.469
  160   1HB   SER1126           HB2      SER1126  23.801  10.412   0.747
  161   2HB   SER1126           HB1      SER1126  22.335  10.868   1.612
  162    HG   SER1126           HG       SER1126  24.809  10.494   2.577
  163    H    VAL1127           HN       VAL1127  23.946   7.835   3.302
  164    HA   VAL1127           HA       VAL1127  25.599   6.101   1.584
  165    HB   VAL1127           HB       VAL1127  26.376   7.391   4.208
  166   1HG1  VAL1127          2HG1      VAL1127  27.897   5.521   2.394
  167   2HG1  VAL1127          1HG1      VAL1127  28.600   6.396   3.756
  168   3HG1  VAL1127          3HG1      VAL1127  27.345   5.188   4.035
  169   1HG2  VAL1127          2HG2      VAL1127  27.370   7.870   1.401
  170   2HG2  VAL1127          1HG2      VAL1127  26.389   8.975   2.364
  171   3HG2  VAL1127          3HG2      VAL1127  28.038   8.596   2.863
  172    H    TYR1128           HN       TYR1128  25.111   4.033   1.842
  173    HA   TYR1128           HA       TYR1128  24.011   3.169   4.432
  174   1HB   TYR1128           HB2      TYR1128  23.062   2.805   1.772
  175   2HB   TYR1128           HB1      TYR1128  23.508   1.229   2.417
  176    HD1  TYR1128           HD1      TYR1128  22.650   0.829   4.924
  177    HD2  TYR1128           HD2      TYR1128  20.919   3.523   2.127
  178    HE1  TYR1128           HE1      TYR1128  20.524   0.735   6.158
  179    HE2  TYR1128           HE2      TYR1128  18.793   3.443   3.348
  180    HH   TYR1128           HH       TYR1128  17.613   1.932   4.894
  181    H    ALA1129           HN       ALA1129  24.463   0.998   5.103
  182    HA   ALA1129           HA       ALA1129  27.248   0.347   4.820
  183   1HB   ALA1129           HB3      ALA1129  26.094   0.083   6.964
  184   2HB   ALA1129           HB1      ALA1129  26.780  -1.445   6.415
  185   3HB   ALA1129           HB2      ALA1129  25.050  -1.147   6.253
  186    HA   PRO1130           HA       PRO1130  26.906  -2.483   1.440
  187   1HB   PRO1130           HB2      PRO1130  29.011  -4.127   1.949
  188   2HB   PRO1130           HB1      PRO1130  29.197  -2.486   1.321
  189   1HG   PRO1130           HG2      PRO1130  29.466  -3.478   4.135
  190   2HG   PRO1130           HG1      PRO1130  30.498  -2.340   3.248
  191   1HD   PRO1130           HD2      PRO1130  28.638  -1.514   5.025
  192   2HD   PRO1130           HD1      PRO1130  29.045  -0.573   3.575
  193    H    ALA1131           HN       ALA1131  25.873  -4.342   0.981
  194    HA   ALA1131           HA       ALA1131  24.741  -6.294   1.238
  195   1HB   ALA1131           HB2      ALA1131  26.935  -7.186   1.855
  196   2HB   ALA1131           HB3      ALA1131  25.634  -7.981   2.742
  197   3HB   ALA1131           HB1      ALA1131  26.630  -6.764   3.539
  198    H    SER1132           HN       SER1132  24.183  -3.776   2.958
  199    HA   SER1132           HA       SER1132  22.742  -4.949   5.197
  200   1HB   SER1132           HB2      SER1132  22.329  -2.701   5.924
  201   2HB   SER1132           HB1      SER1132  24.006  -2.770   5.380
  202    HG   SER1132           HG       SER1132  21.788  -1.777   3.912
  203    H    SER1133           HN       SER1133  20.492  -4.790   5.504
  204    HA   SER1133           HA       SER1133  18.917  -4.096   3.119
  205   1HB   SER1133           HB2      SER1133  19.104  -6.526   3.141
  206   2HB   SER1133           HB1      SER1133  18.567  -6.577   4.819
  207    HG   SER1133           HG       SER1133  16.967  -6.950   3.036
  208    H    VAL1134           HN       VAL1134  16.756  -3.453   3.515
  209    HA   VAL1134           HA       VAL1134  15.955  -3.057   6.292
  210    HB   VAL1134           HB       VAL1134  15.307  -0.683   5.807
  211   1HG1  VAL1134          2HG1      VAL1134  18.247  -1.341   5.744
  212   2HG1  VAL1134          1HG1      VAL1134  17.552   0.217   6.196
  213   3HG1  VAL1134          3HG1      VAL1134  17.232  -1.210   7.180
  214   1HG2  VAL1134          1HG2      VAL1134  15.388  -0.785   3.382
  215   2HG2  VAL1134          3HG2      VAL1134  16.464   0.474   3.989
  216   3HG2  VAL1134          2HG2      VAL1134  17.130  -1.063   3.437
  217    H    GLU1135           HN       GLU1135  13.729  -2.141   6.424
  218    HA   GLU1135           HA       GLU1135  12.028  -3.545   4.535
  219   1HB   GLU1135           HB2      GLU1135  11.389  -2.117   7.121
  220   2HB   GLU1135           HB1      GLU1135  10.243  -3.038   6.165
  221   1HG   GLU1135           HG2      GLU1135  11.555  -5.064   6.532
  222   2HG   GLU1135           HG1      GLU1135  12.705  -4.136   7.495
  223    H    TYR1136           HN       TYR1136  10.441  -2.583   3.293
  224    HA   TYR1136           HA       TYR1136  10.622   0.346   3.105
  225   1HB   TYR1136           HB2      TYR1136  10.755  -1.738   1.064
  226   2HB   TYR1136           HB1      TYR1136   9.592  -0.471   0.685
  227    HD1  TYR1136           HD1      TYR1136  13.002  -0.546   2.230
  228    HD2  TYR1136           HD2      TYR1136  10.450   1.104  -0.746
  229    HE1  TYR1136           HE1      TYR1136  14.830   0.916   1.480
  230    HE2  TYR1136           HE2      TYR1136  12.272   2.567  -1.505
  231    HH   TYR1136           HH       TYR1136  15.471   2.128  -0.629
  232    H    GLN1137           HN       GLN1137   8.736   1.436   2.293
  233    HA   GLN1137           HA       GLN1137   6.166   0.156   2.452
  234   1HB   GLN1137           HB2      GLN1137   6.691   0.570   4.839
  235   2HB   GLN1137           HB1      GLN1137   6.902   2.278   4.482
  236   1HG   GLN1137           HG2      GLN1137   4.559   2.426   3.804
  237   2HG   GLN1137           HG1      GLN1137   4.348   0.714   4.174
  238   1HE2  GLN1137          1HE2      GLN1137   3.015   3.057   5.297
  239   2HE2  GLN1137          2HE2      GLN1137   3.294   2.993   7.001
  240    H    CYS1138           HN       CYS1138   4.436   1.609   1.793
  241    HA   CYS1138           HA       CYS1138   5.466   3.727   0.053
  242   1HB   CYS1138           HB2      CYS1138   2.673   2.587   0.066
  243   2HB   CYS1138           HB1      CYS1138   3.460   3.507  -1.215
  244    H    GLN1139           HN       GLN1139   4.640   5.817   0.067
  245    HA   GLN1139           HA       GLN1139   4.009   6.931   2.541
  246   1HB   GLN1139           HB2      GLN1139   3.464   8.980   1.290
  247   2HB   GLN1139           HB1      GLN1139   4.962   8.249   0.730
  248   1HG   GLN1139           HG2      GLN1139   3.778   7.280  -1.175
  249   2HG   GLN1139           HG1      GLN1139   2.278   8.017  -0.613
  250   1HE2  GLN1139          1HE2      GLN1139   5.381   9.593  -0.387
  251   2HE2  GLN1139          2HE2      GLN1139   5.069  10.813  -1.568
  252    H    ASN1140           HN       ASN1140   1.991   8.273   2.965
  253    HA   ASN1140           HA       ASN1140  -0.202   8.181   3.600
  254   1HB   ASN1140           HB2      ASN1140  -0.055   8.756   1.005
  255   2HB   ASN1140           HB1      ASN1140  -0.955   7.247   0.877
  256   1HD2  ASN1140          1HD2      ASN1140  -3.063   7.172   1.516
  257   2HD2  ASN1140          2HD2      ASN1140  -3.960   8.563   2.011
  258    H    LEU1141           HN       LEU1141  -2.303   6.571   2.560
  259    HA   LEU1141           HA       LEU1141  -1.911   4.223   4.129
  260   1HB   LEU1141           HB2      LEU1141  -4.158   5.188   2.382
  261   2HB   LEU1141           HB1      LEU1141  -4.205   3.620   3.165
  262    HG   LEU1141           HG       LEU1141  -4.015   4.735   5.368
  263   1HD1  LEU1141          3HD1      LEU1141  -4.265   7.274   3.763
  264   2HD1  LEU1141          2HD1      LEU1141  -4.342   7.153   5.521
  265   3HD1  LEU1141          1HD1      LEU1141  -2.847   6.753   4.674
  266   1HD2  LEU1141          2HD2      LEU1141  -6.289   5.699   3.640
  267   2HD2  LEU1141          1HD2      LEU1141  -6.203   4.153   4.484
  268   3HD2  LEU1141          3HD2      LEU1141  -6.282   5.656   5.403
  269    H    TYR1142           HN       TYR1142  -0.557   4.802   1.300
  270    HA   TYR1142           HA       TYR1142  -1.321   2.639  -0.349
  271   1HB   TYR1142           HB2      TYR1142   1.230   4.249  -0.197
  272   2HB   TYR1142           HB1      TYR1142   0.964   2.995  -1.404
  273    HD1  TYR1142           HD1      TYR1142  -0.637   6.101  -0.084
  274    HD2  TYR1142           HD2      TYR1142   0.061   3.588  -3.445
  275    HE1  TYR1142           HE1      TYR1142  -1.753   7.742  -1.536
  276    HE2  TYR1142           HE2      TYR1142  -1.054   5.222  -4.906
  277    HH   TYR1142           HH       TYR1142  -1.785   8.380  -3.911
  278    H    GLN1143           HN       GLN1143  -0.752   0.540  -0.375
  279    HA   GLN1143           HA       GLN1143   1.351  -0.343   1.496
  280   1HB   GLN1143           HB2      GLN1143  -1.224  -0.797   2.030
  281   2HB   GLN1143           HB1      GLN1143  -0.961  -2.140   0.927
  282   1HG   GLN1143           HG2      GLN1143   0.546  -1.593   3.472
  283   2HG   GLN1143           HG1      GLN1143  -0.654  -2.857   3.205
  284   1HE2  GLN1143          1HE2      GLN1143   2.591  -1.802   2.584
  285   2HE2  GLN1143          2HE2      GLN1143   3.184  -3.308   1.983
  286    H    LEU1144           HN       LEU1144   2.992  -1.123   0.302
  287    HA   LEU1144           HA       LEU1144   2.626  -1.949  -2.384
  288   1HB   LEU1144           HB2      LEU1144   4.983  -2.579  -2.388
  289   2HB   LEU1144           HB1      LEU1144   4.722  -0.965  -1.775
  290    HG   LEU1144           HG       LEU1144   6.493  -2.123  -0.581
  291   1HD1  LEU1144          2HD1      LEU1144   5.216  -0.428   0.589
  292   2HD1  LEU1144          1HD1      LEU1144   4.065  -1.650   1.128
  293   3HD1  LEU1144          3HD1      LEU1144   5.735  -1.701   1.694
  294   1HD2  LEU1144          1HD2      LEU1144   5.449  -4.416  -0.842
  295   2HD2  LEU1144          3HD2      LEU1144   6.252  -4.055   0.687
  296   3HD2  LEU1144          2HD2      LEU1144   4.489  -4.013   0.583
  297    H    GLU1145           HN       GLU1145   4.348  -4.133  -2.595
  298    HA   GLU1145           HA       GLU1145   3.498  -6.355  -1.076
  299   1HB   GLU1145           HB2      GLU1145   1.362  -5.986  -2.213
  300   2HB   GLU1145           HB1      GLU1145   2.171  -6.027  -3.775
  301   1HG   GLU1145           HG2      GLU1145   1.042  -8.120  -3.337
  302   2HG   GLU1145           HG1      GLU1145   2.788  -8.358  -3.399
  303    H    GLY1146           HN       GLY1146   4.989  -7.891  -1.310
  304   1HA   GLY1146           HA1      GLY1146   6.791  -7.699  -3.634
  305   2HA   GLY1146           HA2      GLY1146   6.125  -9.256  -3.159
  306    H    ASN1147           HN       ASN1147   8.587  -6.957  -2.635
  307    HA   ASN1147           HA       ASN1147   9.451  -8.269  -0.167
  308   1HB   ASN1147           HB2      ASN1147  11.785  -8.386  -1.116
  309   2HB   ASN1147           HB1      ASN1147  10.625  -9.496  -1.840
  310   1HD2  ASN1147          1HD2      ASN1147  12.647  -6.750  -2.334
  311   2HD2  ASN1147          2HD2      ASN1147  12.421  -6.625  -4.042
  312    H    LYS1148           HN       LYS1148   8.634  -6.152   0.623
  313    HA   LYS1148           HA       LYS1148   9.752  -3.674  -0.003
  314   1HB   LYS1148           HB2      LYS1148   9.172  -3.126   2.443
  315   2HB   LYS1148           HB1      LYS1148   7.865  -3.622   1.376
  316   1HG   LYS1148           HG2      LYS1148   7.528  -4.730   3.432
  317   2HG   LYS1148           HG1      LYS1148   8.124  -5.942   2.298
  318   1HD   LYS1148           HD2      LYS1148  10.388  -5.668   3.234
  319   2HD   LYS1148           HD1      LYS1148   9.747  -4.513   4.404
  320   1HE   LYS1148           HE2      LYS1148   8.298  -6.237   5.334
  321   2HE   LYS1148           HE1      LYS1148   8.887  -7.392   4.139
  322   1HZ   LYS1148           HZ1      LYS1148  11.113  -7.153   5.089
  323   2HZ   LYS1148           HZ3      LYS1148  10.505  -6.100   6.265
  324   3HZ   LYS1148           HZ2      LYS1148  10.003  -7.714   6.234
  325    H    ARG1149           HN       ARG1149  11.186  -6.387   1.432
  326    HA   ARG1149           HA       ARG1149  13.268  -4.904   2.817
  327   1HB   ARG1149           HB2      ARG1149  12.307  -7.084   3.680
  328   2HB   ARG1149           HB1      ARG1149  13.119  -7.883   2.340
  329   1HG   ARG1149           HG2      ARG1149  14.506  -8.149   4.222
  330   2HG   ARG1149           HG1      ARG1149  15.271  -6.933   3.199
  331   1HD   ARG1149           HD2      ARG1149  14.410  -5.161   4.602
  332   2HD   ARG1149           HD1      ARG1149  13.541  -6.333   5.593
  333    HE   ARG1149           HE       ARG1149  16.294  -6.956   5.547
  334   1HH1  ARG1149          1HH1      ARG1149  14.047  -4.650   6.876
  335   2HH1  ARG1149          2HH1      ARG1149  15.018  -4.312   8.269
  336   1HH2  ARG1149          1HH2      ARG1149  17.579  -6.518   7.379
  337   2HH2  ARG1149          2HH2      ARG1149  17.026  -5.373   8.555
  338    H    ILE1150           HN       ILE1150  14.596  -3.891   1.404
  339    HA   ILE1150           HA       ILE1150  15.654  -5.446  -0.861
  340    HB   ILE1150           HB       ILE1150  16.397  -3.298  -1.793
  341   1HG1  ILE1150          2HG1      ILE1150  14.857  -1.996   0.458
  342   2HG1  ILE1150          1HG1      ILE1150  16.611  -2.167   0.462
  343   1HG2  ILE1150          2HG2      ILE1150  13.479  -3.417  -1.041
  344   2HG2  ILE1150          1HG2      ILE1150  14.156  -2.417  -2.328
  345   3HG2  ILE1150          3HG2      ILE1150  14.240  -4.175  -2.441
  346   1HD1  ILE1150          2HD1      ILE1150  14.993  -0.660  -1.575
  347   2HD1  ILE1150          1HD1      ILE1150  15.944   0.045  -0.268
  348   3HD1  ILE1150          3HD1      ILE1150  16.748  -0.831  -1.571
  349    H    THR1151           HN       THR1151  17.906  -5.463  -1.280
  350    HA   THR1151           HA       THR1151  19.636  -4.622   0.942
  351    HB   THR1151           HB       THR1151  19.991  -7.282  -0.432
  352    HG1  THR1151           HG1      THR1151  19.144  -8.006   1.757
  353   1HG2  THR1151          1HG2      THR1151  21.966  -6.340   0.659
  354   2HG2  THR1151          3HG2      THR1151  21.059  -6.160   2.161
  355   3HG2  THR1151          2HG2      THR1151  21.392  -7.768   1.519
  356    H    CYS1152           HN       CYS1152  21.477  -3.640   0.294
  357    HA   CYS1152           HA       CYS1152  21.938  -3.326  -2.532
  358   1HB   CYS1152           HB2      CYS1152  23.617  -1.711  -1.930
  359   2HB   CYS1152           HB1      CYS1152  22.186  -1.432  -0.948
  360    H    ARG1153           HN       ARG1153  23.563  -4.109  -3.722
  361    HA   ARG1153           HA       ARG1153  25.456  -5.936  -2.406
  362   1HB   ARG1153           HB2      ARG1153  25.361  -7.235  -4.613
  363   2HB   ARG1153           HB1      ARG1153  23.991  -7.391  -3.524
  364   1HG   ARG1153           HG2      ARG1153  24.005  -5.430  -5.796
  365   2HG   ARG1153           HG1      ARG1153  23.489  -7.106  -5.996
  366   1HD   ARG1153           HD2      ARG1153  22.284  -5.041  -4.152
  367   2HD   ARG1153           HD1      ARG1153  21.557  -5.717  -5.611
  368    HE   ARG1153           HE       ARG1153  22.133  -7.340  -3.216
  369   1HH1  ARG1153          1HH1      ARG1153  20.059  -6.393  -5.852
  370   2HH1  ARG1153          2HH1      ARG1153  18.820  -7.536  -5.458
  371   1HH2  ARG1153          1HH2      ARG1153  20.506  -8.849  -2.691
  372   2HH2  ARG1153          2HH2      ARG1153  19.074  -8.933  -3.660
  373    H    ASN1154           HN       ASN1154  27.505  -5.419  -2.707
  374    HA   ASN1154           HA       ASN1154  29.321  -4.220  -3.374
  375   1HB   ASN1154           HB2      ASN1154  29.889  -4.516  -5.786
  376   2HB   ASN1154           HB1      ASN1154  29.458  -6.011  -4.972
  377   1HD2  ASN1154          1HD2      ASN1154  27.615  -7.076  -5.540
  378   2HD2  ASN1154          2HD2      ASN1154  26.693  -6.685  -6.947
  379    H    GLY1155           HN       GLY1155  27.772  -2.351  -2.666
  380   1HA   GLY1155           HA1      GLY1155  28.393  -0.124  -4.203
  381   2HA   GLY1155           HA2      GLY1155  27.181  -0.159  -2.936
  382    H    GLN1156           HN       GLN1156  25.602  -2.225  -4.390
  383    HA   GLN1156           HA       GLN1156  24.189  -0.355  -6.125
  384   1HB   GLN1156           HB2      GLN1156  25.717  -1.548  -7.633
  385   2HB   GLN1156           HB1      GLN1156  25.072  -3.085  -7.076
  386   1HG   GLN1156           HG2      GLN1156  22.882  -2.498  -7.978
  387   2HG   GLN1156           HG1      GLN1156  23.525  -0.954  -8.533
  388   1HE2  GLN1156          1HE2      GLN1156  22.324  -3.142 -10.048
  389   2HE2  GLN1156          2HE2      GLN1156  23.503  -3.614 -11.219
  390    H    TRP1157           HN       TRP1157  22.449  -0.325  -4.756
  391    HA   TRP1157           HA       TRP1157  21.271  -2.455  -3.423
  392   1HB   TRP1157           HB2      TRP1157  20.207   0.157  -4.432
  393   2HB   TRP1157           HB1      TRP1157  19.136  -1.001  -3.655
  394    HD1  TRP1157           HD1      TRP1157  21.945   1.426  -2.924
  395    HE1  TRP1157           HE1      TRP1157  22.080   1.779  -0.383
  396    HE3  TRP1157           HE3      TRP1157  18.707  -2.222  -1.425
  397    HZ2  TRP1157           HZ2      TRP1157  20.988   0.645   1.953
  398    HZ3  TRP1157           HZ3      TRP1157  18.311  -2.529   0.984
  399    HH2  TRP1157           HH2      TRP1157  19.427  -1.127   2.638
  400    H    SER1158           HN       SER1158  18.719  -2.636  -3.906
  401    HA   SER1158           HA       SER1158  18.439  -3.830  -6.583
  402   1HB   SER1158           HB2      SER1158  16.808  -5.378  -5.555
  403   2HB   SER1158           HB1      SER1158  18.393  -5.518  -4.798
  404    HG   SER1158           HG       SER1158  17.314  -3.774  -3.336
  405    H    GLU1159           HN       GLU1159  15.614  -4.245  -6.225
  406    HA   GLU1159           HA       GLU1159  14.629  -1.473  -6.179
  407   1HB   GLU1159           HB2      GLU1159  14.937  -2.537  -8.476
  408   2HB   GLU1159           HB1      GLU1159  13.615  -3.608  -8.042
  409   1HG   GLU1159           HG2      GLU1159  12.140  -1.685  -7.748
  410   2HG   GLU1159           HG1      GLU1159  13.463  -0.605  -8.187
  411    HA   PRO1160           HA       PRO1160  11.912  -3.140  -3.014
  412   1HB   PRO1160           HB2      PRO1160  10.307  -0.776  -3.878
  413   2HB   PRO1160           HB1      PRO1160  10.738  -1.306  -2.249
  414   1HG   PRO1160           HG2      PRO1160  11.994   0.742  -3.366
  415   2HG   PRO1160           HG1      PRO1160  12.890  -0.447  -2.399
  416   1HD   PRO1160           HD2      PRO1160  12.757  -0.104  -5.371
  417   2HD   PRO1160           HD1      PRO1160  14.125  -0.594  -4.350
  418    HA   PRO1161           HA       PRO1161   8.665  -5.303  -5.064
  419   1HB   PRO1161           HB2      PRO1161   6.477  -4.903  -3.471
  420   2HB   PRO1161           HB1      PRO1161   7.799  -6.001  -3.067
  421   1HG   PRO1161           HG2      PRO1161   7.315  -3.195  -2.142
  422   2HG   PRO1161           HG1      PRO1161   7.834  -4.610  -1.205
  423   1HD   PRO1161           HD2      PRO1161   9.579  -2.739  -2.012
  424   2HD   PRO1161           HD1      PRO1161  10.020  -4.457  -1.949
  425    H    LYS1162           HN       LYS1162   5.810  -4.076  -4.329
  426    HA   LYS1162           HA       LYS1162   5.793  -1.869  -6.238
  427   1HB   LYS1162           HB2      LYS1162   3.949  -2.873  -7.533
  428   2HB   LYS1162           HB1      LYS1162   5.429  -3.813  -7.644
  429   1HG   LYS1162           HG2      LYS1162   4.555  -5.386  -5.989
  430   2HG   LYS1162           HG1      LYS1162   3.065  -4.448  -5.893
  431   1HD   LYS1162           HD2      LYS1162   4.067  -5.582  -8.489
  432   2HD   LYS1162           HD1      LYS1162   3.055  -6.519  -7.388
  433   1HE   LYS1162           HE2      LYS1162   1.626  -5.523  -9.017
  434   2HE   LYS1162           HE1      LYS1162   1.371  -4.680  -7.491
  435   1HZ   LYS1162           HZ2      LYS1162   3.135  -3.691  -9.661
  436   2HZ   LYS1162           HZ1      LYS1162   1.536  -3.190  -9.432
  437   3HZ   LYS1162           HZ3      LYS1162   2.703  -2.866  -8.250
  438    H    CYS1163           HN       CYS1163   4.493  -0.289  -5.563
  439    HA   CYS1163           HA       CYS1163   2.973  -0.598  -3.165
  440   1HB   CYS1163           HB2      CYS1163   3.313   1.701  -5.087
  441   2HB   CYS1163           HB1      CYS1163   2.311   1.801  -3.642
  442    H    LEU1164           HN       LEU1164   0.802  -0.604  -2.850
  443    HA   LEU1164           HA       LEU1164  -0.887  -0.851  -5.252
  444   1HB   LEU1164           HB2      LEU1164  -1.001  -2.276  -2.607
  445   2HB   LEU1164           HB1      LEU1164  -2.417  -2.152  -3.630
  446    HG   LEU1164           HG       LEU1164  -1.367  -4.292  -3.967
  447   1HD1  LEU1164          1HD1      LEU1164  -2.391  -3.256  -5.914
  448   2HD1  LEU1164          3HD1      LEU1164  -0.867  -2.463  -6.310
  449   3HD1  LEU1164          2HD1      LEU1164  -0.991  -4.221  -6.382
  450   1HD2  LEU1164          3HD2      LEU1164   0.888  -3.716  -3.250
  451   2HD2  LEU1164          2HD2      LEU1164   0.904  -4.505  -4.827
  452   3HD2  LEU1164          1HD2      LEU1164   1.117  -2.758  -4.712
  453    H    HIS1165           HN       HIS1165  -2.309   0.737  -5.496
  454    HA   HIS1165           HA       HIS1165  -2.676   2.925  -3.935
  455   1HB   HIS1165           HB2      HIS1165  -4.829   1.543  -5.559
  456   2HB   HIS1165           HB1      HIS1165  -4.892   3.213  -5.002
  457    HD1  HIS1165           HD1      HIS1165  -3.640   1.099  -7.723
  458    HD2  HIS1165           HD2      HIS1165  -2.935   4.926  -6.266
  459    HE1  HIS1165           HE1      HIS1165  -2.412   2.301  -9.558
  460    HE2  HIS1165           HE2      HIS1165  -1.916   4.585  -8.618
  461    HA   PRO1166           HA       PRO1166  -4.358   1.484  -0.112
  462   1HB   PRO1166           HB2      PRO1166  -5.611   3.843   0.614
  463   2HB   PRO1166           HB1      PRO1166  -3.907   3.471   0.893
  464   1HG   PRO1166           HG2      PRO1166  -5.167   5.072  -1.294
  465   2HG   PRO1166           HG1      PRO1166  -3.667   5.380  -0.399
  466   1HD   PRO1166           HD2      PRO1166  -3.624   4.372  -2.878
  467   2HD   PRO1166           HD1      PRO1166  -2.462   3.836  -1.646
  468    H    CYS1167           HN       CYS1167  -6.512   1.765   1.124
  469    HA   CYS1167           HA       CYS1167  -8.570   0.713  -0.579
  470   1HB   CYS1167           HB2      CYS1167  -8.931   1.441   2.317
  471   2HB   CYS1167           HB1      CYS1167  -9.689   0.139   1.404
  472    H    VAL1168           HN       VAL1168  -8.423   2.933  -1.747
  473    HA   VAL1168           HA       VAL1168 -10.217   4.879  -0.481
  474    HB   VAL1168           HB       VAL1168  -8.452   5.205  -2.913
  475   1HG1  VAL1168          3HG1      VAL1168 -10.142   7.215  -1.429
  476   2HG1  VAL1168          2HG1      VAL1168  -9.016   7.589  -2.735
  477   3HG1  VAL1168          1HG1      VAL1168 -10.439   6.597  -3.054
  478   1HG2  VAL1168          3HG2      VAL1168  -7.162   5.015  -0.857
  479   2HG2  VAL1168          2HG2      VAL1168  -7.111   6.667  -1.472
  480   3HG2  VAL1168          1HG2      VAL1168  -8.151   6.266  -0.106
  481    H    ILE1169           HN       ILE1169 -12.153   3.759  -0.856
  482    HA   ILE1169           HA       ILE1169 -12.894   3.144  -3.602
  483    HB   ILE1169           HB       ILE1169 -13.497   1.825  -1.396
  484   1HG1  ILE1169          2HG1      ILE1169 -15.572   2.254  -3.555
  485   2HG1  ILE1169          1HG1      ILE1169 -14.153   1.222  -3.723
  486   1HG2  ILE1169          3HG2      ILE1169 -14.587   3.717  -0.312
  487   2HG2  ILE1169          2HG2      ILE1169 -15.786   3.767  -1.604
  488   3HG2  ILE1169          1HG2      ILE1169 -15.699   2.367  -0.535
  489   1HD1  ILE1169          2HD1      ILE1169 -16.376   0.850  -1.726
  490   2HD1  ILE1169          1HD1      ILE1169 -16.136  -0.082  -3.204
  491   3HD1  ILE1169          3HD1      ILE1169 -14.957  -0.182  -1.897
  492    H    SER1170           HN       SER1170 -15.424   3.802  -3.954
  493    HA   SER1170           HA       SER1170 -15.331   6.671  -4.155
  494   1HB   SER1170           HB2      SER1170 -17.500   4.707  -4.918
  495   2HB   SER1170           HB1      SER1170 -17.527   6.429  -5.295
  496    HG   SER1170           HG       SER1170 -16.584   4.704  -6.846
  497    H    ARG1171           HN       ARG1171 -16.194   8.141  -2.851
  498    HA   ARG1171           HA       ARG1171 -17.818   7.247  -0.563
  499   1HB   ARG1171           HB2      ARG1171 -17.219   9.364   0.461
  500   2HB   ARG1171           HB1      ARG1171 -15.760   8.579  -0.130
  501   1HG   ARG1171           HG2      ARG1171 -15.630  10.048  -1.998
  502   2HG   ARG1171           HG1      ARG1171 -17.230  10.711  -1.661
  503   1HD   ARG1171           HD2      ARG1171 -15.676  12.313  -0.890
  504   2HD   ARG1171           HD1      ARG1171 -16.307  11.507   0.545
  505    HE   ARG1171           HE       ARG1171 -14.031  10.126  -0.108
  506   1HH1  ARG1171          1HH1      ARG1171 -14.815  13.438   0.638
  507   2HH1  ARG1171          2HH1      ARG1171 -13.267  13.784   1.333
  508   1HH2  ARG1171          1HH2      ARG1171 -11.989  10.574   0.807
  509   2HH2  ARG1171          2HH2      ARG1171 -11.660  12.156   1.428
  510    H    GLU1172           HN       GLU1172 -18.186   8.580  -3.603
  511    HA   GLU1172           HA       GLU1172 -20.561  10.121  -2.841
  512   1HB   GLU1172           HB2      GLU1172 -18.792  11.143  -4.327
  513   2HB   GLU1172           HB1      GLU1172 -19.251   9.978  -5.560
  514   1HG   GLU1172           HG2      GLU1172 -21.512  10.893  -5.589
  515   2HG   GLU1172           HG1      GLU1172 -21.057  12.057  -4.345
  516    H    ILE1173           HN       ILE1173 -19.953   7.038  -3.423
  517    HA   ILE1173           HA       ILE1173 -22.495   6.648  -4.842
  518    HB   ILE1173           HB       ILE1173 -19.860   5.331  -5.313
  519   1HG1  ILE1173          2HG1      ILE1173 -20.824   7.158  -6.742
  520   2HG1  ILE1173          1HG1      ILE1173 -20.434   5.678  -7.614
  521   1HG2  ILE1173          1HG2      ILE1173 -21.348   3.485  -4.674
  522   2HG2  ILE1173          3HG2      ILE1173 -22.500   4.004  -5.903
  523   3HG2  ILE1173          2HG2      ILE1173 -20.905   3.422  -6.380
  524   1HD1  ILE1173          2HD1      ILE1173 -23.179   6.508  -6.694
  525   2HD1  ILE1173          1HD1      ILE1173 -22.555   6.635  -8.339
  526   3HD1  ILE1173          3HD1      ILE1173 -22.785   5.049  -7.603
  527    H    MET1174           HN       MET1174 -20.162   5.197  -2.569
  528    HA   MET1174           HA       MET1174 -21.908   3.172  -1.654
  529   1HB   MET1174           HB2      MET1174 -19.359   4.382  -0.682
  530   2HB   MET1174           HB1      MET1174 -20.313   3.451   0.463
  531   1HG   MET1174           HG2      MET1174 -19.177   1.702  -0.305
  532   2HG   MET1174           HG1      MET1174 -20.265   1.789  -1.689
  533   1HE   MET1174           HE2      MET1174 -19.714   2.777  -3.952
  534   2HE   MET1174           HE1      MET1174 -19.269   4.358  -3.311
  535   3HE   MET1174           HE3      MET1174 -18.180   3.515  -4.414
  536    H    GLU1175           HN       GLU1175 -20.756   6.021   0.121
  537    HA   GLU1175           HA       GLU1175 -22.916   5.979   1.960
  538   1HB   GLU1175           HB2      GLU1175 -21.745   7.593   3.057
  539   2HB   GLU1175           HB1      GLU1175 -20.448   7.111   1.966
  540   1HG   GLU1175           HG2      GLU1175 -21.082   8.925   0.440
  541   2HG   GLU1175           HG1      GLU1175 -22.329   9.430   1.580
  542    H    ASN1176           HN       ASN1176 -23.078   6.522  -1.184
  543    HA   ASN1176           HA       ASN1176 -24.652   8.944  -1.206
  544   1HB   ASN1176           HB2      ASN1176 -23.103   8.507  -3.033
  545   2HB   ASN1176           HB1      ASN1176 -23.986   7.040  -3.426
  546   1HD2  ASN1176          1HD2      ASN1176 -24.458   7.736  -5.498
  547   2HD2  ASN1176          2HD2      ASN1176 -25.619   8.975  -5.812
  548    H    TYR1177           HN       TYR1177 -25.411   5.846  -2.837
  549    HA   TYR1177           HA       TYR1177 -28.163   6.381  -2.728
  550   1HB   TYR1177           HB2      TYR1177 -28.324   3.783  -3.161
  551   2HB   TYR1177           HB1      TYR1177 -27.813   4.908  -4.409
  552    HD1  TYR1177           HD1      TYR1177 -25.956   4.392  -5.636
  553    HD2  TYR1177           HD2      TYR1177 -26.330   2.774  -1.723
  554    HE1  TYR1177           HE1      TYR1177 -23.927   3.055  -6.000
  555    HE2  TYR1177           HE2      TYR1177 -24.297   1.442  -2.072
  556    HH   TYR1177           HH       TYR1177 -22.171   1.968  -4.649
  557    H    ASN1178           HN       ASN1178 -26.380   3.903  -0.807
  558    HA   ASN1178           HA       ASN1178 -27.675   4.496   1.562
  559   1HB   ASN1178           HB2      ASN1178 -29.202   2.364   1.544
  560   2HB   ASN1178           HB1      ASN1178 -29.776   3.872   0.832
  561   1HD2  ASN1178          1HD2      ASN1178 -31.141   2.994  -0.645
  562   2HD2  ASN1178          2HD2      ASN1178 -30.623   2.021  -1.975
  563    H    ILE1179           HN       ILE1179 -25.046   3.655   0.945
  564    HA   ILE1179           HA       ILE1179 -24.962   1.323   2.706
  565    HB   ILE1179           HB       ILE1179 -23.422   0.061   1.419
  566   1HG1  ILE1179          2HG1      ILE1179 -23.496   2.211  -0.700
  567   2HG1  ILE1179          1HG1      ILE1179 -22.193   2.018   0.468
  568   1HG2  ILE1179          1HG2      ILE1179 -25.662   1.002  -0.362
  569   2HG2  ILE1179          3HG2      ILE1179 -24.732  -0.479  -0.581
  570   3HG2  ILE1179          2HG2      ILE1179 -25.750  -0.280   0.845
  571   1HD1  ILE1179          2HD1      ILE1179 -23.034  -0.032  -1.566
  572   2HD1  ILE1179          1HD1      ILE1179 -21.634   1.034  -1.691
  573   3HD1  ILE1179          3HD1      ILE1179 -21.704  -0.187  -0.420
  574    H    ALA1180           HN       ALA1180 -23.038   1.070   3.881
  575    HA   ALA1180           HA       ALA1180 -20.999   3.144   3.623
  576   1HB   ALA1180           HB2      ALA1180 -21.157   3.787   5.973
  577   2HB   ALA1180           HB1      ALA1180 -22.669   4.114   5.128
  578   3HB   ALA1180           HB3      ALA1180 -22.536   2.709   6.185
  579    H    LEU1181           HN       LEU1181 -20.094   2.447   6.403
  580    HA   LEU1181           HA       LEU1181 -18.743  -0.055   5.688
  581   1HB   LEU1181           HB2      LEU1181 -17.891   2.367   6.882
  582   2HB   LEU1181           HB1      LEU1181 -17.756   1.124   8.109
  583    HG   LEU1181           HG       LEU1181 -15.666   1.475   6.823
  584   1HD1  LEU1181          3HD1      LEU1181 -16.091  -0.661   7.906
  585   2HD1  LEU1181          2HD1      LEU1181 -16.937  -1.233   6.469
  586   3HD1  LEU1181          1HD1      LEU1181 -15.209  -0.885   6.395
  587   1HD2  LEU1181          2HD2      LEU1181 -17.275   0.393   4.514
  588   2HD2  LEU1181          1HD2      LEU1181 -16.646   2.034   4.666
  589   3HD2  LEU1181          3HD2      LEU1181 -15.533   0.673   4.518
  590    H    ARG1182           HN       ARG1182 -18.188  -1.462   7.685
  591    HA   ARG1182           HA       ARG1182 -20.629  -2.368   8.800
  592   1HB   ARG1182           HB2      ARG1182 -19.243  -3.949  10.071
  593   2HB   ARG1182           HB1      ARG1182 -18.790  -3.905   8.373
  594   1HG   ARG1182           HG2      ARG1182 -16.878  -2.500   8.902
  595   2HG   ARG1182           HG1      ARG1182 -17.341  -2.499  10.604
  596   1HD   ARG1182           HD2      ARG1182 -17.057  -4.931  10.677
  597   2HD   ARG1182           HD1      ARG1182 -16.582  -4.924   8.979
  598    HE   ARG1182           HE       ARG1182 -14.875  -3.177  10.272
  599   1HH1  ARG1182          1HH1      ARG1182 -15.671  -6.565  10.437
  600   2HH1  ARG1182          2HH1      ARG1182 -14.094  -7.042  10.971
  601   1HH2  ARG1182          1HH2      ARG1182 -12.797  -3.795  10.974
  602   2HH2  ARG1182          2HH2      ARG1182 -12.460  -5.467  11.277
  603    H    TRP1183           HN       TRP1183 -18.818   0.251   9.567
  604    HA   TRP1183           HA       TRP1183 -19.492   0.166  12.426
  605   1HB   TRP1183           HB2      TRP1183 -17.729   2.227  11.115
  606   2HB   TRP1183           HB1      TRP1183 -17.772   1.734  12.807
  607    HD1  TRP1183           HD1      TRP1183 -16.648   0.371   9.369
  608    HE1  TRP1183           HE1      TRP1183 -14.749  -1.321   9.757
  609    HE3  TRP1183           HE3      TRP1183 -16.638   0.310  14.484
  610    HZ2  TRP1183           HZ2      TRP1183 -13.416  -2.508  11.926
  611    HZ3  TRP1183           HZ3      TRP1183 -15.012  -1.133  15.639
  612    HH2  TRP1183           HH2      TRP1183 -13.434  -2.513  14.386
  613    H    THR1184           HN       THR1184 -20.415   1.458   9.448
  614    HA   THR1184           HA       THR1184 -21.768   3.179   8.783
  615    HB   THR1184           HB       THR1184 -23.862   3.398  10.055
  616    HG1  THR1184           HG1      THR1184 -23.791   1.697  11.937
  617   1HG2  THR1184          2HG2      THR1184 -22.884   0.549   9.830
  618   2HG2  THR1184          1HG2      THR1184 -24.571   1.050   9.935
  619   3HG2  THR1184          3HG2      THR1184 -23.602   1.505   8.534
  620    H    ALA1185           HN       ALA1185 -20.062   4.770   9.077
  621    HA   ALA1185           HA       ALA1185 -20.851   6.790  11.040
  622   1HB   ALA1185           HB3      ALA1185 -18.553   7.185  11.734
  623   2HB   ALA1185           HB1      ALA1185 -18.001   5.868  10.700
  624   3HB   ALA1185           HB2      ALA1185 -19.035   5.525  12.087
  625    H    LYS1186           HN       LYS1186 -21.233   6.623   8.184
  626    HA   LYS1186           HA       LYS1186 -21.195   8.017   6.400
  627   1HB   LYS1186           HB2      LYS1186 -19.756   9.813   8.346
  628   2HB   LYS1186           HB1      LYS1186 -20.174  10.305   6.710
  629   1HG   LYS1186           HG2      LYS1186 -22.539   9.977   7.209
  630   2HG   LYS1186           HG1      LYS1186 -22.124   9.463   8.845
  631   1HD   LYS1186           HD2      LYS1186 -21.479  12.167   7.676
  632   2HD   LYS1186           HD1      LYS1186 -22.861  11.825   8.718
  633   1HE   LYS1186           HE2      LYS1186 -21.340  11.122  10.503
  634   2HE   LYS1186           HE1      LYS1186 -19.959  11.469   9.461
  635   1HZ   LYS1186           HZ1      LYS1186 -21.953  13.459  10.405
  636   2HZ   LYS1186           HZ3      LYS1186 -20.379  13.278  11.000
  637   3HZ   LYS1186           HZ2      LYS1186 -20.628  13.790   9.407
  638    H    GLN1187           HN       GLN1187 -20.068   7.054   4.882
  639    HA   GLN1187           HA       GLN1187 -18.363   6.605   3.454
  640   1HB   GLN1187           HB2      GLN1187 -17.726   8.965   3.690
  641   2HB   GLN1187           HB1      GLN1187 -16.798   8.577   5.133
  642   1HG   GLN1187           HG2      GLN1187 -15.424   7.036   3.677
  643   2HG   GLN1187           HG1      GLN1187 -16.229   7.781   2.295
  644   1HE2  GLN1187          1HE2      GLN1187 -15.838   9.958   1.832
  645   2HE2  GLN1187          2HE2      GLN1187 -14.455  10.784   2.455
  646    H    LYS1188           HN       LYS1188 -15.988   7.200   5.936
  647    HA   LYS1188           HA       LYS1188 -14.469   5.781   6.907
  648   1HB   LYS1188           HB2      LYS1188 -16.622   5.406   8.214
  649   2HB   LYS1188           HB1      LYS1188 -16.849   3.953   7.252
  650   1HG   LYS1188           HG2      LYS1188 -15.880   3.375   9.375
  651   2HG   LYS1188           HG1      LYS1188 -14.700   3.088   8.094
  652   1HD   LYS1188           HD2      LYS1188 -13.614   5.218   8.617
  653   2HD   LYS1188           HD1      LYS1188 -14.793   5.505   9.898
  654   1HE   LYS1188           HE2      LYS1188 -14.021   3.494  11.056
  655   2HE   LYS1188           HE1      LYS1188 -12.844   3.206   9.775
  656   1HZ   LYS1188           HZ1      LYS1188 -12.904   5.577  11.564
  657   2HZ   LYS1188           HZ3      LYS1188 -11.827   4.277  11.683
  658   3HZ   LYS1188           HZ2      LYS1188 -11.774   5.299  10.337
  659    H    LEU1189           HN       LEU1189 -15.230   5.442   4.011
  660    HA   LEU1189           HA       LEU1189 -14.815   2.627   3.453
  661   1HB   LEU1189           HB2      LEU1189 -14.816   4.819   1.421
  662   2HB   LEU1189           HB1      LEU1189 -15.316   3.150   1.243
  663    HG   LEU1189           HG       LEU1189 -16.837   5.097   2.960
  664   1HD1  LEU1189          2HD1      LEU1189 -17.272   4.462   0.046
  665   2HD1  LEU1189          1HD1      LEU1189 -18.358   5.403   1.070
  666   3HD1  LEU1189          3HD1      LEU1189 -16.742   6.010   0.707
  667   1HD2  LEU1189          2HD2      LEU1189 -17.235   2.701   3.328
  668   2HD2  LEU1189          1HD2      LEU1189 -18.651   3.519   2.667
  669   3HD2  LEU1189          3HD2      LEU1189 -17.641   2.519   1.623
  670    H    TYR1190           HN       TYR1190 -12.683   4.599   4.608
  671    HA   TYR1190           HA       TYR1190 -10.626   4.044   2.578
  672   1HB   TYR1190           HB2      TYR1190 -10.876   6.237   4.617
  673   2HB   TYR1190           HB1      TYR1190  -9.326   5.845   3.879
  674    HD1  TYR1190           HD1      TYR1190 -12.277   5.408   1.804
  675    HD2  TYR1190           HD2      TYR1190  -9.285   8.183   3.030
  676    HE1  TYR1190           HE1      TYR1190 -12.823   6.844  -0.115
  677    HE2  TYR1190           HE2      TYR1190  -9.828   9.621   1.113
  678    HH   TYR1190           HH       TYR1190 -10.852   9.416  -1.112
  679    H    SER1191           HN       SER1191  -8.824   2.941   3.069
  680    HA   SER1191           HA       SER1191  -8.078   2.340   5.795
  681   1HB   SER1191           HB2      SER1191  -9.163   0.213   3.940
  682   2HB   SER1191           HB1      SER1191  -8.133  -0.168   5.320
  683    HG   SER1191           HG       SER1191 -10.651   1.148   5.390
  684    H    ARG1192           HN       ARG1192  -6.330   0.363   5.519
  685    HA   ARG1192           HA       ARG1192  -4.408   1.384   3.548
  686   1HB   ARG1192           HB2      ARG1192  -3.804   1.328   6.008
  687   2HB   ARG1192           HB1      ARG1192  -3.856  -0.424   5.908
  688   1HG   ARG1192           HG2      ARG1192  -2.063  -0.431   4.294
  689   2HG   ARG1192           HG1      ARG1192  -2.050   1.333   4.260
  690   1HD   ARG1192           HD2      ARG1192  -0.247   0.409   5.653
  691   2HD   ARG1192           HD1      ARG1192  -1.366   1.412   6.576
  692    HE   ARG1192           HE       ARG1192  -2.145  -1.304   6.706
  693   1HH1  ARG1192          1HH1      ARG1192   0.256   0.914   7.916
  694   2HH1  ARG1192          2HH1      ARG1192   0.528   0.024   9.376
  695   1HH2  ARG1192          1HH2      ARG1192  -1.792  -2.482   8.626
  696   2HH2  ARG1192          2HH2      ARG1192  -0.635  -1.907   9.780
  697    H    THR1193           HN       THR1193  -4.227   0.219   1.744
  698    HA   THR1193           HA       THR1193  -5.507  -1.987   0.985
  699    HB   THR1193           HB       THR1193  -2.620  -1.391   0.313
  700    HG1  THR1193           HG1      THR1193  -3.458   0.031  -1.001
  701   1HG2  THR1193          3HG2      THR1193  -3.150  -3.722  -0.206
  702   2HG2  THR1193          2HG2      THR1193  -4.578  -3.202  -1.104
  703   3HG2  THR1193          1HG2      THR1193  -2.966  -2.773  -1.683
  704    H    GLY1194           HN       GLY1194  -5.825  -3.863   1.913
  705   1HA   GLY1194           HA1      GLY1194  -3.579  -5.121   3.352
  706   2HA   GLY1194           HA2      GLY1194  -4.639  -6.047   2.296
  707    H    GLU1195           HN       GLU1195  -6.211  -3.559   3.987
  708    HA   GLU1195           HA       GLU1195  -6.914  -5.307   6.232
  709   1HB   GLU1195           HB2      GLU1195  -7.547  -2.395   5.728
  710   2HB   GLU1195           HB1      GLU1195  -8.010  -3.292   7.167
  711   1HG   GLU1195           HG2      GLU1195  -5.621  -3.687   7.646
  712   2HG   GLU1195           HG1      GLU1195  -5.207  -2.687   6.253
  713    H    SER1196           HN       SER1196  -9.051  -5.835   6.753
  714    HA   SER1196           HA       SER1196 -10.746  -6.281   4.494
  715   1HB   SER1196           HB2      SER1196 -12.287  -7.303   6.134
  716   2HB   SER1196           HB1      SER1196 -10.640  -7.907   6.323
  717    HG   SER1196           HG       SER1196 -12.176  -6.696   8.130
  718    H    VAL1197           HN       VAL1197 -12.577  -5.244   3.881
  719    HA   VAL1197           HA       VAL1197 -13.501  -2.996   5.535
  720    HB   VAL1197           HB       VAL1197 -13.179  -2.870   2.532
  721   1HG1  VAL1197          3HG1      VAL1197 -15.048  -1.548   3.365
  722   2HG1  VAL1197          2HG1      VAL1197 -13.989  -0.771   4.542
  723   3HG1  VAL1197          1HG1      VAL1197 -13.739  -0.499   2.818
  724   1HG2  VAL1197          2HG2      VAL1197 -11.548  -1.553   4.702
  725   2HG2  VAL1197          1HG2      VAL1197 -11.005  -2.838   3.625
  726   3HG2  VAL1197          3HG2      VAL1197 -11.393  -1.247   2.973
  727    H    GLU1198           HN       GLU1198 -15.343  -3.988   6.209
  728    HA   GLU1198           HA       GLU1198 -17.108  -5.232   4.258
  729   1HB   GLU1198           HB2      GLU1198 -17.143  -6.568   6.113
  730   2HB   GLU1198           HB1      GLU1198 -16.867  -5.228   7.218
  731   1HG   GLU1198           HG2      GLU1198 -19.149  -4.554   7.083
  732   2HG   GLU1198           HG1      GLU1198 -19.472  -5.726   5.802
  733    H    PHE1199           HN       PHE1199 -18.568  -4.077   3.223
  734    HA   PHE1199           HA       PHE1199 -19.452  -1.519   4.296
  735   1HB   PHE1199           HB2      PHE1199 -20.041  -2.812   1.621
  736   2HB   PHE1199           HB1      PHE1199 -20.454  -1.165   2.083
  737    HD1  PHE1199           HD1      PHE1199 -18.972   0.576   1.673
  738    HD2  PHE1199           HD2      PHE1199 -17.561  -3.439   1.591
  739    HE1  PHE1199           HE1      PHE1199 -16.806   1.362   0.794
  740    HE2  PHE1199           HE2      PHE1199 -15.398  -2.664   0.718
  741    HZ   PHE1199           HZ       PHE1199 -15.017  -0.264   0.320
  742    H    VAL1200           HN       VAL1200 -21.615  -1.022   4.710
  743    HA   VAL1200           HA       VAL1200 -23.367  -3.361   5.045
  744    HB   VAL1200           HB       VAL1200 -24.631  -1.991   6.659
  745   1HG1  VAL1200          3HG1      VAL1200 -21.674  -2.145   7.232
  746   2HG1  VAL1200          2HG1      VAL1200 -22.947  -1.969   8.441
  747   3HG1  VAL1200          1HG1      VAL1200 -22.850  -3.437   7.468
  748   1HG2  VAL1200          2HG2      VAL1200 -24.167   0.210   5.725
  749   2HG2  VAL1200          1HG2      VAL1200 -23.724   0.149   7.430
  750   3HG2  VAL1200          3HG2      VAL1200 -22.472   0.064   6.191
  751    H    CYS1201           HN       CYS1201 -25.727  -2.927   4.739
  752    HA   CYS1201           HA       CYS1201 -26.076  -1.356   2.294
  753   1HB   CYS1201           HB2      CYS1201 -27.744  -3.537   3.550
  754   2HB   CYS1201           HB1      CYS1201 -28.273  -2.596   2.159
  755    H    LYS1202           HN       LYS1202 -25.948  -0.222   5.033
  756    HA   LYS1202           HA       LYS1202 -26.991   1.357   6.300
  757   1HB   LYS1202           HB2      LYS1202 -27.059   2.479   4.085
  758   2HB   LYS1202           HB1      LYS1202 -28.644   1.774   3.804
  759   1HG   LYS1202           HG2      LYS1202 -29.569   3.021   5.650
  760   2HG   LYS1202           HG1      LYS1202 -27.973   3.669   6.044
  761   1HD   LYS1202           HD2      LYS1202 -27.878   4.791   3.887
  762   2HD   LYS1202           HD1      LYS1202 -29.447   4.108   3.444
  763   1HE   LYS1202           HE2      LYS1202 -28.898   6.023   5.715
  764   2HE   LYS1202           HE1      LYS1202 -29.680   6.419   4.185
  765   1HZ   LYS1202           HZ3      LYS1202 -30.734   4.485   6.177
  766   2HZ   LYS1202           HZ2      LYS1202 -31.271   6.078   5.997
  767   3HZ   LYS1202           HZ1      LYS1202 -31.496   4.964   4.745
  768    H    ARG1203           HN       ARG1203 -28.012   0.338   7.903
  769    HA   ARG1203           HA       ARG1203 -29.800  -1.499   8.226
  770   1HB   ARG1203           HB2      ARG1203 -30.167   1.209   9.497
  771   2HB   ARG1203           HB1      ARG1203 -30.774  -0.315  10.124
  772   1HG   ARG1203           HG2      ARG1203 -28.475  -1.112  10.400
  773   2HG   ARG1203           HG1      ARG1203 -27.879   0.434   9.791
  774   1HD   ARG1203           HD2      ARG1203 -29.551   0.033  12.268
  775   2HD   ARG1203           HD1      ARG1203 -27.818   0.354  12.233
  776    HE   ARG1203           HE       ARG1203 -29.066   2.408  10.839
  777   1HH1  ARG1203          1HH1      ARG1203 -28.978   1.147  14.085
  778   2HH1  ARG1203          2HH1      ARG1203 -29.295   2.680  14.827
  779   1HH2  ARG1203          1HH2      ARG1203 -29.483   4.430  11.806
  780   2HH2  ARG1203          2HH2      ARG1203 -29.582   4.545  13.531
  781    H    GLY1204           HN       GLY1204 -31.300  -2.030   6.718
  782   1HA   GLY1204           HA1      GLY1204 -33.345  -0.009   6.067
  783   2HA   GLY1204           HA2      GLY1204 -33.814  -1.609   6.615
  784    H    TYR1205           HN       TYR1205 -31.540  -0.272   4.205
  785    HA   TYR1205           HA       TYR1205 -32.966  -1.397   2.016
  786   1HB   TYR1205           HB2      TYR1205 -30.118  -0.415   2.010
  787   2HB   TYR1205           HB1      TYR1205 -31.192  -0.562   0.628
  788    HD1  TYR1205           HD1      TYR1205 -32.782   1.143   0.114
  789    HD2  TYR1205           HD2      TYR1205 -30.509   1.363   3.701
  790    HE1  TYR1205           HE1      TYR1205 -33.520   3.465   0.429
  791    HE2  TYR1205           HE2      TYR1205 -31.243   3.688   4.025
  792    HH   TYR1205           HH       TYR1205 -32.083   5.561   2.669
  793    H    ARG1206           HN       ARG1206 -32.600  -3.186   0.809
  794    HA   ARG1206           HA       ARG1206 -30.657  -5.115   1.896
  795   1HB   ARG1206           HB2      ARG1206 -32.159  -6.881   1.103
  796   2HB   ARG1206           HB1      ARG1206 -32.978  -5.807   2.229
  797   1HG   ARG1206           HG2      ARG1206 -34.599  -5.848   0.680
  798   2HG   ARG1206           HG1      ARG1206 -33.607  -4.618  -0.104
  799   1HD   ARG1206           HD2      ARG1206 -34.281  -6.340  -1.692
  800   2HD   ARG1206           HD1      ARG1206 -32.532  -6.337  -1.461
  801    HE   ARG1206           HE       ARG1206 -33.663  -8.189   0.310
  802   1HH1  ARG1206          1HH1      ARG1206 -33.169  -7.734  -3.110
  803   2HH1  ARG1206          2HH1      ARG1206 -33.110  -9.430  -3.458
  804   1HH2  ARG1206          1HH2      ARG1206 -33.585 -10.423  -0.139
  805   2HH2  ARG1206          2HH2      ARG1206 -33.346 -10.958  -1.769
  806    H    LEU1207           HN       LEU1207 -29.240  -6.075   0.556
  807    HA   LEU1207           HA       LEU1207 -28.189  -5.069  -1.658
  808   1HB   LEU1207           HB2      LEU1207 -28.650  -7.986  -1.078
  809   2HB   LEU1207           HB1      LEU1207 -27.680  -7.441  -2.431
  810    HG   LEU1207           HG       LEU1207 -27.072  -6.659   0.415
  811   1HD1  LEU1207          3HD1      LEU1207 -27.030  -9.096   0.233
  812   2HD1  LEU1207          2HD1      LEU1207 -25.958  -8.975  -1.162
  813   3HD1  LEU1207          1HD1      LEU1207 -25.405  -8.439   0.423
  814   1HD2  LEU1207          3HD2      LEU1207 -26.089  -5.254  -1.328
  815   2HD2  LEU1207          2HD2      LEU1207 -24.851  -6.195  -0.492
  816   3HD2  LEU1207          1HD2      LEU1207 -25.399  -6.684  -2.096
  817    H    SER1208           HN       SER1208 -28.660  -4.693  -3.728
  818    HA   SER1208           HA       SER1208 -31.315  -5.323  -4.682
  819   1HB   SER1208           HB2      SER1208 -29.041  -3.728  -5.872
  820   2HB   SER1208           HB1      SER1208 -30.592  -3.959  -6.678
  821    HG   SER1208           HG       SER1208 -30.160  -2.022  -5.195
  822    H    SER1209           HN       SER1209 -28.878  -7.260  -4.429
  823    HA   SER1209           HA       SER1209 -28.367  -9.258  -5.395
  824   1HB   SER1209           HB2      SER1209 -30.696  -9.448  -6.127
  825   2HB   SER1209           HB1      SER1209 -30.344  -8.458  -7.544
  826    HG   SER1209           HG       SER1209 -28.960 -10.864  -7.004
  827    H    ARG1210           HN       ARG1210 -28.747  -6.763  -7.922
  828    HA   ARG1210           HA       ARG1210 -26.649  -7.664  -9.548
  829   1HB   ARG1210           HB2      ARG1210 -26.750  -5.456 -10.597
  830   2HB   ARG1210           HB1      ARG1210 -28.363  -6.101 -10.330
  831   1HG   ARG1210           HG2      ARG1210 -28.603  -4.690  -8.350
  832   2HG   ARG1210           HG1      ARG1210 -26.984  -4.042  -8.620
  833   1HD   ARG1210           HD2      ARG1210 -28.694  -2.520  -9.464
  834   2HD   ARG1210           HD1      ARG1210 -27.690  -3.144 -10.773
  835    HE   ARG1210           HE       ARG1210 -29.983  -4.759 -10.470
  836   1HH1  ARG1210          1HH1      ARG1210 -29.008  -1.613 -11.605
  837   2HH1  ARG1210          2HH1      ARG1210 -30.302  -1.483 -12.749
  838   1HH2  ARG1210          1HH2      ARG1210 -31.688  -4.598 -11.973
  839   2HH2  ARG1210          2HH2      ARG1210 -31.826  -3.179 -12.959
  840    H    SER1211           HN       SER1211 -26.580  -6.224  -6.505
  841    HA   SER1211           HA       SER1211 -24.243  -4.666  -6.627
  842   1HB   SER1211           HB2      SER1211 -25.422  -6.206  -4.301
  843   2HB   SER1211           HB1      SER1211 -24.174  -4.966  -4.167
  844    HG   SER1211           HG       SER1211 -26.241  -4.022  -5.591
  845    H    HIS1212           HN       HIS1212 -22.243  -5.308  -5.255
  846    HA   HIS1212           HA       HIS1212 -21.261  -7.829  -6.360
  847   1HB   HIS1212           HB2      HIS1212 -19.773  -5.523  -5.086
  848   2HB   HIS1212           HB1      HIS1212 -19.017  -6.966  -5.756
  849    HD1  HIS1212           HD1      HIS1212 -20.378  -3.678  -6.692
  850    HD2  HIS1212           HD2      HIS1212 -19.216  -7.172  -8.614
  851    HE1  HIS1212           HE1      HIS1212 -20.151  -3.065  -9.121
  852    HE2  HIS1212           HE2      HIS1212 -19.363  -5.174 -10.250
  853    H    THR1213           HN       THR1213 -19.764  -6.468  -3.536
  854    HA   THR1213           HA       THR1213 -20.973  -8.492  -1.811
  855    HB   THR1213           HB       THR1213 -18.829  -9.242  -0.960
  856    HG1  THR1213           HG1      THR1213 -17.500  -7.852  -3.031
  857   1HG2  THR1213          1HG2      THR1213 -19.082  -9.369  -3.957
  858   2HG2  THR1213          3HG2      THR1213 -17.964 -10.361  -3.019
  859   3HG2  THR1213          2HG2      THR1213 -19.705 -10.525  -2.778
  860    H    LEU1214           HN       LEU1214 -20.809  -8.085   0.418
  861    HA   LEU1214           HA       LEU1214 -20.558  -5.279   1.080
  862   1HB   LEU1214           HB2      LEU1214 -21.340  -7.698   2.708
  863   2HB   LEU1214           HB1      LEU1214 -21.232  -6.083   3.379
  864    HG   LEU1214           HG       LEU1214 -23.532  -6.549   2.925
  865   1HD1  LEU1214          3HD1      LEU1214 -22.392  -4.720   0.820
  866   2HD1  LEU1214          2HD1      LEU1214 -24.085  -4.779   1.308
  867   3HD1  LEU1214          1HD1      LEU1214 -22.851  -4.277   2.464
  868   1HD2  LEU1214          2HD2      LEU1214 -23.213  -8.350   1.313
  869   2HD2  LEU1214          1HD2      LEU1214 -24.348  -7.142   0.712
  870   3HD2  LEU1214          3HD2      LEU1214 -22.694  -7.179   0.101
  871    H    ARG1215           HN       ARG1215 -19.300  -8.258   2.561
  872    HA   ARG1215           HA       ARG1215 -17.041  -6.748   3.627
  873   1HB   ARG1215           HB2      ARG1215 -18.149  -8.222   5.187
  874   2HB   ARG1215           HB1      ARG1215 -17.952  -9.590   4.100
  875   1HG   ARG1215           HG2      ARG1215 -15.529  -9.467   4.382
  876   2HG   ARG1215           HG1      ARG1215 -15.726  -8.086   5.465
  877   1HD   ARG1215           HD2      ARG1215 -15.397 -10.151   6.721
  878   2HD   ARG1215           HD1      ARG1215 -16.997  -9.473   7.017
  879    HE   ARG1215           HE       ARG1215 -17.176 -11.332   4.925
  880   1HH1  ARG1215          1HH1      ARG1215 -16.579 -11.224   8.357
  881   2HH1  ARG1215          2HH1      ARG1215 -17.215 -12.809   8.646
  882   1HH2  ARG1215          1HH2      ARG1215 -18.015 -13.418   5.298
  883   2HH2  ARG1215          2HH2      ARG1215 -18.031 -14.056   6.909
  884    H    THR1216           HN       THR1216 -15.095  -6.764   2.750
  885    HA   THR1216           HA       THR1216 -14.122  -9.023   1.235
  886    HB   THR1216           HB       THR1216 -15.485  -7.769  -0.430
  887    HG1  THR1216           HG1      THR1216 -13.936  -8.831  -1.475
  888   1HG2  THR1216          1HG2      THR1216 -13.497  -5.589   0.179
  889   2HG2  THR1216          3HG2      THR1216 -14.487  -5.624  -1.280
  890   3HG2  THR1216          2HG2      THR1216 -15.256  -5.514   0.303
  891    H    THR1217           HN       THR1217 -12.111  -7.613  -0.157
  892    HA   THR1217           HA       THR1217 -10.532  -6.431   2.024
  893    HB   THR1217           HB       THR1217  -9.684  -8.548   0.052
  894    HG1  THR1217           HG1      THR1217  -8.979  -9.551   1.986
  895   1HG2  THR1217          3HG2      THR1217  -8.060  -6.634   0.045
  896   2HG2  THR1217          2HG2      THR1217  -7.817  -6.911   1.771
  897   3HG2  THR1217          1HG2      THR1217  -7.380  -8.163   0.609
  898    H    CYS1218           HN       CYS1218  -9.591  -4.557   1.528
  899    HA   CYS1218           HA       CYS1218  -9.990  -3.471  -1.105
  900   1HB   CYS1218           HB2      CYS1218  -8.865  -1.446  -0.109
  901   2HB   CYS1218           HB1      CYS1218 -10.343  -1.959   0.695
  902    H    TRP1219           HN       TRP1219  -8.411  -2.848  -2.555
  903    HA   TRP1219           HA       TRP1219  -5.636  -3.153  -2.115
  904   1HB   TRP1219           HB2      TRP1219  -6.876  -5.580  -2.442
  905   2HB   TRP1219           HB1      TRP1219  -6.397  -5.198  -4.092
  906    HD1  TRP1219           HD1      TRP1219  -3.668  -4.641  -4.395
  907    HE1  TRP1219           HE1      TRP1219  -1.685  -5.787  -3.229
  908    HE3  TRP1219           HE3      TRP1219  -6.120  -6.712  -0.417
  909    HZ2  TRP1219           HZ2      TRP1219  -1.207  -7.351  -0.952
  910    HZ3  TRP1219           HZ3      TRP1219  -4.823  -8.023   1.214
  911    HH2  TRP1219           HH2      TRP1219  -2.415  -8.337   0.951
  912    H    ASP1220           HN       ASP1220  -4.483  -2.212  -3.734
  913    HA   ASP1220           HA       ASP1220  -4.140  -0.758  -5.451
  914   1HB   ASP1220           HB2      ASP1220  -4.559  -1.650  -7.640
  915   2HB   ASP1220           HB1      ASP1220  -4.129  -2.988  -6.582
  916    H    GLY1221           HN       GLY1221  -6.727  -0.493  -3.866
  917   1HA   GLY1221           HA1      GLY1221  -7.801   1.654  -5.472
  918   2HA   GLY1221           HA2      GLY1221  -8.266   1.243  -3.831
  919    H    LYS1222           HN       LYS1222  -9.089  -1.379  -4.120
  920    HA   LYS1222           HA       LYS1222 -11.609  -0.966  -5.511
  921   1HB   LYS1222           HB2      LYS1222 -10.116  -2.032  -7.181
  922   2HB   LYS1222           HB1      LYS1222  -9.900  -3.385  -6.081
  923   1HG   LYS1222           HG2      LYS1222 -12.290  -3.871  -6.203
  924   2HG   LYS1222           HG1      LYS1222 -12.504  -2.517  -7.315
  925   1HD   LYS1222           HD2      LYS1222 -12.391  -4.558  -8.586
  926   2HD   LYS1222           HD1      LYS1222 -10.927  -3.619  -8.882
  927   1HE   LYS1222           HE2      LYS1222  -9.715  -5.002  -7.266
  928   2HE   LYS1222           HE1      LYS1222 -11.178  -5.942  -6.975
  929   1HZ   LYS1222           HZ1      LYS1222 -11.149  -6.633  -9.291
  930   2HZ   LYS1222           HZ3      LYS1222  -9.743  -5.734  -9.567
  931   3HZ   LYS1222           HZ2      LYS1222  -9.706  -7.062  -8.521
  932    H    LEU1223           HN       LEU1223 -13.291  -1.984  -4.559
  933    HA   LEU1223           HA       LEU1223 -12.757  -4.031  -2.528
  934   1HB   LEU1223           HB2      LEU1223 -14.380  -1.562  -1.981
  935   2HB   LEU1223           HB1      LEU1223 -14.107  -2.892  -0.871
  936    HG   LEU1223           HG       LEU1223 -11.573  -2.255  -1.232
  937   1HD1  LEU1223          2HD1      LEU1223 -12.001  -0.582  -2.951
  938   2HD1  LEU1223          1HD1      LEU1223 -13.002   0.330  -1.821
  939   3HD1  LEU1223          3HD1      LEU1223 -11.275   0.144  -1.516
  940   1HD2  LEU1223          3HD2      LEU1223 -12.809  -2.229   0.864
  941   2HD2  LEU1223          2HD2      LEU1223 -11.735  -0.836   0.727
  942   3HD2  LEU1223          1HD2      LEU1223 -13.469  -0.647   0.457
  943    H    GLU1224           HN       GLU1224 -14.477  -3.118  -5.132
  944    HA   GLU1224           HA       GLU1224 -16.448  -3.739  -6.105
  945   1HB   GLU1224           HB2      GLU1224 -15.520  -6.007  -4.490
  946   2HB   GLU1224           HB1      GLU1224 -17.230  -6.069  -4.904
  947   1HG   GLU1224           HG2      GLU1224 -16.627  -5.824  -7.280
  948   2HG   GLU1224           HG1      GLU1224 -14.922  -5.829  -6.827
  949    H    TYR1225           HN       TYR1225 -17.323  -1.830  -4.909
  950    HA   TYR1225           HA       TYR1225 -18.827  -2.273  -2.526
  951   1HB   TYR1225           HB2      TYR1225 -19.740   0.042  -3.040
  952   2HB   TYR1225           HB1      TYR1225 -18.004  -0.087  -2.790
  953    HD1  TYR1225           HD1      TYR1225 -20.638   0.742  -5.139
  954    HD2  TYR1225           HD2      TYR1225 -16.461   0.070  -4.711
  955    HE1  TYR1225           HE1      TYR1225 -20.242   1.876  -7.286
  956    HE2  TYR1225           HE2      TYR1225 -16.050   1.194  -6.856
  957    HH   TYR1225           HH       TYR1225 -17.275   1.717  -8.927
  958    HA   PRO1226           HA       PRO1226 -22.502  -3.937  -4.361
  959   1HB   PRO1226           HB2      PRO1226 -24.098  -3.660  -2.179
  960   2HB   PRO1226           HB1      PRO1226 -22.862  -4.917  -2.310
  961   1HG   PRO1226           HG2      PRO1226 -22.715  -2.256  -0.925
  962   2HG   PRO1226           HG1      PRO1226 -22.207  -3.850  -0.333
  963   1HD   PRO1226           HD2      PRO1226 -20.451  -2.084  -1.327
  964   2HD   PRO1226           HD1      PRO1226 -20.265  -3.830  -1.595
  965    H    THR1227           HN       THR1227 -24.981  -2.886  -3.060
  966    HA   THR1227           HA       THR1227 -25.154  -0.111  -3.856
  967    HB   THR1227           HB       THR1227 -26.846  -2.170  -5.288
  968    HG1  THR1227           HG1      THR1227 -25.611  -1.715  -7.073
  969   1HG2  THR1227          3HG2      THR1227 -26.696   0.836  -5.560
  970   2HG2  THR1227          2HG2      THR1227 -27.648  -0.236  -6.587
  971   3HG2  THR1227          1HG2      THR1227 -28.036  -0.081  -4.873
  972    H    CYS1228           HN       CYS1228 -27.193  -2.947  -3.319
  973    HA   CYS1228           HA       CYS1228 -28.832  -3.407  -1.814
  974   1HB   CYS1228           HB2      CYS1228 -27.744  -1.126  -0.172
  975   2HB   CYS1228           HB1      CYS1228 -28.578  -2.569   0.403
  976    H    ALA1229           HN       ALA1229 -30.915  -2.752  -1.143
  977    HA   ALA1229           HA       ALA1229 -31.841  -0.074  -1.393
  978   1HB   ALA1229           HB3      ALA1229 -32.617  -1.995  -3.572
  979   2HB   ALA1229           HB2      ALA1229 -33.293  -0.385  -3.325
  980   3HB   ALA1229           HB1      ALA1229 -31.594  -0.572  -3.761
  981    H    LYS1230           HN       LYS1230 -33.599   0.177  -0.218
  982    HA   LYS1230           HA       LYS1230 -35.884  -1.234  -0.065
  983   1HB   LYS1230           HB2      LYS1230 -34.031  -2.973   0.880
  984   2HB   LYS1230           HB1      LYS1230 -34.576  -2.217   2.370
  985   1HG   LYS1230           HG2      LYS1230 -36.930  -2.739   1.068
  986   2HG   LYS1230           HG1      LYS1230 -35.924  -4.120   0.629
  987   1HD   LYS1230           HD2      LYS1230 -36.386  -3.151   3.451
  988   2HD   LYS1230           HD1      LYS1230 -37.256  -4.485   2.692
  989   1HE   LYS1230           HE2      LYS1230 -35.141  -5.682   2.385
  990   2HE   LYS1230           HE1      LYS1230 -34.279  -4.352   3.158
  991   1HZ   LYS1230           HZ1      LYS1230 -35.530  -4.769   5.184
  992   2HZ   LYS1230           HZ3      LYS1230 -36.353  -6.047   4.442
  993   3HZ   LYS1230           HZ2      LYS1230 -34.686  -6.155   4.707
  994    H    ARG1231           HN       ARG1231 -34.862  -1.156   3.093
  995    HA   ARG1231           HA       ARG1231 -35.654   0.103   4.835
  996   1HB   ARG1231           HB2      ARG1231 -33.449   1.018   4.393
  997   2HB   ARG1231           HB1      ARG1231 -34.116   2.121   3.200
  998   1HG   ARG1231           HG2      ARG1231 -33.700   3.351   5.197
  999   2HG   ARG1231           HG1      ARG1231 -35.447   3.187   5.014
 1000   1HD   ARG1231           HD2      ARG1231 -33.787   1.349   6.725
 1001   2HD   ARG1231           HD1      ARG1231 -34.545   2.817   7.340
 1002    HE   ARG1231           HE       ARG1231 -36.533   1.343   6.087
 1003   1HH1  ARG1231          1HH1      ARG1231 -34.376   0.993   8.800
 1004   2HH1  ARG1231          2HH1      ARG1231 -35.459  -0.018   9.696
 1005   1HH2  ARG1231          1HH2      ARG1231 -37.966   0.014   7.260
 1006   2HH2  ARG1231          2HH2      ARG1231 -37.501  -0.575   8.820

  No H/Q in entry =        1006
  Start of MODEL    2
    1    H1   GLU1103           HT2      GLU1103  42.455  -1.099  -1.470
    2    H2   GLU1103           HT1      GLU1103  43.879  -0.247  -1.801
    3    H3   GLU1103           HT3      GLU1103  42.693   0.440  -0.806
    4    HA   GLU1103           HA       GLU1103  42.636   1.442  -2.980
    5   1HB   GLU1103           HB2      GLU1103  42.074  -1.376  -3.925
    6   2HB   GLU1103           HB1      GLU1103  41.996   0.066  -4.927
    7   1HG   GLU1103           HG2      GLU1103  44.380   0.448  -4.569
    8   2HG   GLU1103           HG1      GLU1103  44.459  -0.999  -3.564
    9    H    ALA1104           HN       ALA1104  40.867  -0.128  -0.775
   10    HA   ALA1104           HA       ALA1104  38.705  -0.039  -0.086
   11   1HB   ALA1104           HB2      ALA1104  37.303   1.789  -0.865
   12   2HB   ALA1104           HB3      ALA1104  38.416   2.095  -2.198
   13   3HB   ALA1104           HB1      ALA1104  38.940   2.358  -0.535
   14    H    GLU1105           HN       GLU1105  37.954   0.814  -3.433
   15    HA   GLU1105           HA       GLU1105  36.726  -0.217  -5.041
   16   1HB   GLU1105           HB2      GLU1105  37.739  -2.735  -3.708
   17   2HB   GLU1105           HB1      GLU1105  36.979  -2.658  -5.291
   18   1HG   GLU1105           HG2      GLU1105  39.571  -1.338  -4.514
   19   2HG   GLU1105           HG1      GLU1105  39.400  -2.815  -5.463
   20    H    PHE1106           HN       PHE1106  35.703   0.163  -2.143
   21    HA   PHE1106           HA       PHE1106  33.638  -1.815  -1.880
   22   1HB   PHE1106           HB2      PHE1106  34.071   0.817  -0.455
   23   2HB   PHE1106           HB1      PHE1106  32.829  -0.355  -0.027
   24    HD1  PHE1106           HD1      PHE1106  33.579  -2.684   0.662
   25    HD2  PHE1106           HD2      PHE1106  36.222   0.642   0.417
   26    HE1  PHE1106           HE1      PHE1106  35.175  -3.851   2.126
   27    HE2  PHE1106           HE2      PHE1106  37.824  -0.519   1.880
   28    HZ   PHE1106           HZ       PHE1106  37.302  -2.769   2.736
   29    H    GLY1107           HN       GLY1107  31.653  -1.789  -2.731
   30   1HA   GLY1107           HA1      GLY1107  30.071  -1.126  -4.300
   31   2HA   GLY1107           HA2      GLY1107  30.906   0.410  -4.446
   32    H    LYS1108           HN       LYS1108  30.911   1.347  -1.874
   33    HA   LYS1108           HA       LYS1108  28.640   1.136  -0.342
   34   1HB   LYS1108           HB2      LYS1108  30.276   3.605  -0.946
   35   2HB   LYS1108           HB1      LYS1108  29.042   3.532   0.304
   36   1HG   LYS1108           HG2      LYS1108  30.340   1.638   1.326
   37   2HG   LYS1108           HG1      LYS1108  31.632   2.018   0.185
   38   1HD   LYS1108           HD2      LYS1108  30.440   4.007   2.110
   39   2HD   LYS1108           HD1      LYS1108  31.898   3.067   2.439
   40   1HE   LYS1108           HE2      LYS1108  32.977   4.052   0.478
   41   2HE   LYS1108           HE1      LYS1108  31.519   4.984   0.141
   42   1HZ   LYS1108           HZ2      LYS1108  31.799   6.114   2.263
   43   2HZ   LYS1108           HZ1      LYS1108  33.205   5.227   2.574
   44   3HZ   LYS1108           HZ3      LYS1108  33.163   6.322   1.284
   45    H    CYS1109           HN       CYS1109  26.585   1.520  -0.633
   46    HA   CYS1109           HA       CYS1109  25.704   2.741  -3.098
   47   1HB   CYS1109           HB2      CYS1109  23.399   2.197  -1.837
   48   2HB   CYS1109           HB1      CYS1109  24.304   0.991  -2.745
   49    H    GLY1110           HN       GLY1110  23.491   4.015  -2.678
   50   1HA   GLY1110           HA1      GLY1110  23.463   6.470  -2.425
   51   2HA   GLY1110           HA2      GLY1110  24.204   6.224  -0.849
   52    HA   PRO1111           HA       PRO1111  20.096   6.822   0.783
   53   1HB   PRO1111           HB2      PRO1111  18.986   8.194  -1.627
   54   2HB   PRO1111           HB1      PRO1111  18.892   8.658   0.076
   55   1HG   PRO1111           HG2      PRO1111  20.569   9.898  -1.586
   56   2HG   PRO1111           HG1      PRO1111  21.038   9.542   0.087
   57   1HD   PRO1111           HD2      PRO1111  21.876   8.209  -2.442
   58   2HD   PRO1111           HD1      PRO1111  22.792   8.469  -0.945
   59    HA   PRO1112           HA       PRO1112  18.148   3.211  -0.966
   60   1HB   PRO1112           HB2      PRO1112  15.973   3.137   0.689
   61   2HB   PRO1112           HB1      PRO1112  17.579   2.568   1.153
   62   1HG   PRO1112           HG2      PRO1112  16.249   5.185   1.746
   63   2HG   PRO1112           HG1      PRO1112  17.211   4.149   2.819
   64   1HD   PRO1112           HD2      PRO1112  18.247   6.348   1.662
   65   2HD   PRO1112           HD1      PRO1112  19.220   4.888   1.936
   66    HA   PRO1113           HA       PRO1113  14.979   5.398  -3.388
   67   1HB   PRO1113           HB2      PRO1113  15.788   4.541  -5.798
   68   2HB   PRO1113           HB1      PRO1113  16.654   5.817  -4.936
   69   1HG   PRO1113           HG2      PRO1113  17.437   3.018  -5.427
   70   2HG   PRO1113           HG1      PRO1113  18.452   4.420  -5.053
   71   1HD   PRO1113           HD2      PRO1113  17.506   2.364  -3.264
   72   2HD   PRO1113           HD1      PRO1113  18.588   3.724  -2.907
   73    HA   PRO1114           HA       PRO1114  12.852   1.337  -3.670
   74   1HB   PRO1114           HB2      PRO1114  11.058   1.644  -1.769
   75   2HB   PRO1114           HB1      PRO1114  12.759   1.441  -1.335
   76   1HG   PRO1114           HG2      PRO1114  11.087   3.905  -1.348
   77   2HG   PRO1114           HG1      PRO1114  12.395   3.442  -0.246
   78   1HD   PRO1114           HD2      PRO1114  12.580   5.130  -2.534
   79   2HD   PRO1114           HD1      PRO1114  13.912   4.536  -1.524
   80    H    ILE1115           HN       ILE1115  10.154   1.330  -3.070
   81    HA   ILE1115           HA       ILE1115   8.844   1.843  -5.397
   82    HB   ILE1115           HB       ILE1115   6.782   2.147  -3.761
   83   1HG1  ILE1115          2HG1      ILE1115   9.046   1.214  -1.984
   84   2HG1  ILE1115          1HG1      ILE1115   8.004   2.612  -1.747
   85   1HG2  ILE1115          1HG2      ILE1115   8.420  -0.354  -4.115
   86   2HG2  ILE1115          3HG2      ILE1115   6.781  -0.338  -3.462
   87   3HG2  ILE1115          2HG2      ILE1115   7.078   0.205  -5.114
   88   1HD1  ILE1115          2HD1      ILE1115   7.105  -0.254  -1.609
   89   2HD1  ILE1115          1HD1      ILE1115   7.481   0.771  -0.222
   90   3HD1  ILE1115          3HD1      ILE1115   6.124   1.173  -1.278
   91    H    ASP1116           HN       ASP1116   7.614   3.497  -6.259
   92    HA   ASP1116           HA       ASP1116   8.382   6.158  -5.476
   93   1HB   ASP1116           HB2      ASP1116   8.102   5.405  -7.868
   94   2HB   ASP1116           HB1      ASP1116   6.365   5.360  -7.581
   95    H    ASN1117           HN       ASN1117   6.839   4.633  -3.594
   96    HA   ASN1117           HA       ASN1117   4.907   6.604  -2.880
   97   1HB   ASN1117           HB2      ASN1117   4.025   3.916  -3.892
   98   2HB   ASN1117           HB1      ASN1117   3.084   4.748  -2.659
   99   1HD2  ASN1117          1HD2      ASN1117   3.620   7.390  -3.634
  100   2HD2  ASN1117          2HD2      ASN1117   2.716   7.581  -5.094
  101    H    GLY1118           HN       GLY1118   7.265   4.628  -2.084
  102   1HA   GLY1118           HA1      GLY1118   7.071   2.959  -0.145
  103   2HA   GLY1118           HA2      GLY1118   6.255   4.286   0.664
  104    H    ASP1119           HN       ASP1119   8.816   2.746   1.124
  105    HA   ASP1119           HA       ASP1119  11.149   4.058   0.797
  106   1HB   ASP1119           HB2      ASP1119   9.956   6.111   1.647
  107   2HB   ASP1119           HB1      ASP1119   9.779   5.299   3.200
  108    H    ILE1120           HN       ILE1120  12.640   3.825   2.915
  109    HA   ILE1120           HA       ILE1120  12.502   1.114   3.658
  110    HB   ILE1120           HB       ILE1120  14.292   1.596   5.248
  111   1HG1  ILE1120          2HG1      ILE1120  13.851   4.500   4.520
  112   2HG1  ILE1120          1HG1      ILE1120  13.402   3.763   6.056
  113   1HG2  ILE1120          3HG2      ILE1120  14.614   3.024   2.613
  114   2HG2  ILE1120          2HG2      ILE1120  15.934   2.499   3.659
  115   3HG2  ILE1120          1HG2      ILE1120  14.870   1.306   2.912
  116   1HD1  ILE1120          3HD1      ILE1120  16.200   3.966   4.980
  117   2HD1  ILE1120          2HD1      ILE1120  15.489   5.016   6.205
  118   3HD1  ILE1120          1HD1      ILE1120  15.724   3.300   6.542
  119    H    THR1121           HN       THR1121  12.649   0.537   6.129
  120    HA   THR1121           HA       THR1121  10.266   1.724   7.388
  121    HB   THR1121           HB       THR1121   9.886  -0.383   8.504
  122    HG1  THR1121           HG1      THR1121  11.436  -1.816   8.703
  123   1HG2  THR1121          2HG2      THR1121   9.006  -0.156   6.224
  124   2HG2  THR1121          1HG2      THR1121  10.501  -0.829   5.577
  125   3HG2  THR1121          3HG2      THR1121   9.443  -1.828   6.574
  126    H    SER1122           HN       SER1122  12.671   3.040   7.751
  127    HA   SER1122           HA       SER1122  12.977   2.775  10.628
  128   1HB   SER1122           HB2      SER1122  15.353   2.611   8.758
  129   2HB   SER1122           HB1      SER1122  15.448   2.758  10.512
  130    HG   SER1122           HG       SER1122  14.016   0.758  10.392
  131    H    PHE1123           HN       PHE1123  15.168   4.406   8.394
  132    HA   PHE1123           HA       PHE1123  13.908   6.958   8.591
  133   1HB   PHE1123           HB2      PHE1123  14.901   6.688  10.872
  134   2HB   PHE1123           HB1      PHE1123  16.488   6.588  10.121
  135    HD1  PHE1123           HD1      PHE1123  13.620   8.798  10.779
  136    HD2  PHE1123           HD2      PHE1123  17.621   8.529   9.357
  137    HE1  PHE1123           HE1      PHE1123  13.802  11.251  10.841
  138    HE2  PHE1123           HE2      PHE1123  17.812  10.981   9.416
  139    HZ   PHE1123           HZ       PHE1123  15.901  12.345  10.159
  140    HA   PRO1124           HA       PRO1124  15.953   7.233   4.642
  141   1HB   PRO1124           HB2      PRO1124  16.019  10.099   5.514
  142   2HB   PRO1124           HB1      PRO1124  15.591   9.415   3.941
  143   1HG   PRO1124           HG2      PRO1124  13.700  10.193   5.652
  144   2HG   PRO1124           HG1      PRO1124  13.492   8.740   4.659
  145   1HD   PRO1124           HD2      PRO1124  14.017   8.982   7.564
  146   2HD   PRO1124           HD1      PRO1124  13.222   7.677   6.664
  147    H    LEU1125           HN       LEU1125  18.016   7.250   3.927
  148    HA   LEU1125           HA       LEU1125  20.111   8.110   5.814
  149   1HB   LEU1125           HB2      LEU1125  20.197   5.936   3.715
  150   2HB   LEU1125           HB1      LEU1125  21.573   6.436   4.675
  151    HG   LEU1125           HG       LEU1125  20.704   4.401   5.587
  152   1HD1  LEU1125          3HD1      LEU1125  19.911   6.737   7.317
  153   2HD1  LEU1125          2HD1      LEU1125  20.185   5.087   7.876
  154   3HD1  LEU1125          1HD1      LEU1125  21.518   6.023   7.200
  155   1HD2  LEU1125          2HD2      LEU1125  18.435   4.554   4.661
  156   2HD2  LEU1125          1HD2      LEU1125  18.431   4.155   6.379
  157   3HD2  LEU1125          3HD2      LEU1125  18.047   5.794   5.855
  158    H    SER1126           HN       SER1126  22.252   7.930   4.107
  159    HA   SER1126           HA       SER1126  21.740   9.614   1.791
  160   1HB   SER1126           HB2      SER1126  22.076  11.257   3.565
  161   2HB   SER1126           HB1      SER1126  23.570  10.458   4.052
  162    HG   SER1126           HG       SER1126  23.977  12.260   2.713
  163    H    VAL1127           HN       VAL1127  24.017   7.927   3.850
  164    HA   VAL1127           HA       VAL1127  25.439   6.994   1.448
  165    HB   VAL1127           HB       VAL1127  26.723   7.538   4.134
  166   1HG1  VAL1127          2HG1      VAL1127  27.520   5.640   2.529
  167   2HG1  VAL1127          1HG1      VAL1127  28.192   6.976   1.594
  168   3HG1  VAL1127          3HG1      VAL1127  28.703   6.727   3.263
  169   1HG2  VAL1127          3HG2      VAL1127  26.172   9.620   2.988
  170   2HG2  VAL1127          2HG2      VAL1127  27.915   9.349   2.994
  171   3HG2  VAL1127          1HG2      VAL1127  26.979   9.042   1.531
  172    H    TYR1128           HN       TYR1128  24.828   4.952   1.232
  173    HA   TYR1128           HA       TYR1128  24.349   3.352   3.639
  174   1HB   TYR1128           HB2      TYR1128  23.034   3.557   1.103
  175   2HB   TYR1128           HB1      TYR1128  23.600   1.906   1.329
  176    HD1  TYR1128           HD1      TYR1128  23.206   1.165   3.979
  177    HD2  TYR1128           HD2      TYR1128  20.835   3.847   1.682
  178    HE1  TYR1128           HE1      TYR1128  21.277   0.689   5.426
  179    HE2  TYR1128           HE2      TYR1128  18.901   3.381   3.123
  180    HH   TYR1128           HH       TYR1128  19.165   1.758   6.090
  181    H    ALA1129           HN       ALA1129  25.518   1.641   4.154
  182    HA   ALA1129           HA       ALA1129  28.023   1.183   2.890
  183   1HB   ALA1129           HB2      ALA1129  27.673   0.811   5.287
  184   2HB   ALA1129           HB1      ALA1129  26.577  -0.522   4.921
  185   3HB   ALA1129           HB3      ALA1129  28.284  -0.640   4.492
  186    HA   PRO1130           HA       PRO1130  26.896  -1.677  -0.282
  187   1HB   PRO1130           HB2      PRO1130  29.153  -3.216  -0.388
  188   2HB   PRO1130           HB1      PRO1130  29.035  -1.596  -1.086
  189   1HG   PRO1130           HG2      PRO1130  30.217  -2.460   1.525
  190   2HG   PRO1130           HG1      PRO1130  30.827  -1.274   0.356
  191   1HD   PRO1130           HD2      PRO1130  29.549  -0.539   2.618
  192   2HD   PRO1130           HD1      PRO1130  29.411   0.387   1.110
  193    H    ALA1131           HN       ALA1131  26.179  -3.780  -0.612
  194    HA   ALA1131           HA       ALA1131  25.321  -5.811  -0.071
  195   1HB   ALA1131           HB3      ALA1131  27.673  -6.406   0.262
  196   2HB   ALA1131           HB1      ALA1131  26.614  -7.273   1.375
  197   3HB   ALA1131           HB2      ALA1131  27.558  -5.897   1.947
  198    H    SER1132           HN       SER1132  24.637  -3.270   1.497
  199    HA   SER1132           HA       SER1132  23.715  -4.400   4.024
  200   1HB   SER1132           HB2      SER1132  23.565  -1.609   2.876
  201   2HB   SER1132           HB1      SER1132  22.841  -2.069   4.417
  202    HG   SER1132           HG       SER1132  25.542  -2.656   3.938
  203    H    SER1133           HN       SER1133  21.574  -4.676   4.599
  204    HA   SER1133           HA       SER1133  19.594  -4.297   2.458
  205   1HB   SER1133           HB2      SER1133  19.609  -6.701   4.284
  206   2HB   SER1133           HB1      SER1133  18.641  -6.440   2.836
  207    HG   SER1133           HG       SER1133  20.338  -7.774   2.294
  208    H    VAL1134           HN       VAL1134  17.508  -3.803   3.085
  209    HA   VAL1134           HA       VAL1134  16.911  -3.592   5.933
  210    HB   VAL1134           HB       VAL1134  16.012  -1.283   5.644
  211   1HG1  VAL1134          2HG1      VAL1134  18.974  -1.644   5.231
  212   2HG1  VAL1134          1HG1      VAL1134  18.197  -0.171   5.812
  213   3HG1  VAL1134          3HG1      VAL1134  18.114  -1.649   6.771
  214   1HG2  VAL1134          3HG2      VAL1134  15.835  -1.286   3.207
  215   2HG2  VAL1134          2HG2      VAL1134  16.794   0.076   3.785
  216   3HG2  VAL1134          1HG2      VAL1134  17.594  -1.329   3.078
  217    H    GLU1135           HN       GLU1135  14.601  -2.802   6.234
  218    HA   GLU1135           HA       GLU1135  12.904  -4.324   4.420
  219   1HB   GLU1135           HB2      GLU1135  12.202  -3.056   7.069
  220   2HB   GLU1135           HB1      GLU1135  11.264  -4.246   6.186
  221   1HG   GLU1135           HG2      GLU1135  12.992  -5.911   6.542
  222   2HG   GLU1135           HG1      GLU1135  13.982  -4.718   7.382
  223    H    TYR1136           HN       TYR1136  11.249  -3.466   3.261
  224    HA   TYR1136           HA       TYR1136  11.122  -0.533   3.165
  225   1HB   TYR1136           HB2      TYR1136  10.670  -2.679   1.128
  226   2HB   TYR1136           HB1      TYR1136   9.881  -1.118   0.930
  227    HD1  TYR1136           HD1      TYR1136  12.677  -0.076   2.491
  228    HD2  TYR1136           HD2      TYR1136  11.577  -1.939  -1.167
  229    HE1  TYR1136           HE1      TYR1136  14.702   0.827   1.425
  230    HE2  TYR1136           HE2      TYR1136  13.586  -1.042  -2.244
  231    HH   TYR1136           HH       TYR1136  15.174   0.815  -1.932
  232    H    GLN1137           HN       GLN1137   8.986   0.383   2.575
  233    HA   GLN1137           HA       GLN1137   6.601  -1.085   3.121
  234   1HB   GLN1137           HB2      GLN1137   7.511  -0.768   5.424
  235   2HB   GLN1137           HB1      GLN1137   7.424   0.970   5.180
  236   1HG   GLN1137           HG2      GLN1137   5.010   0.829   4.923
  237   2HG   GLN1137           HG1      GLN1137   5.084  -0.921   5.130
  238   1HE2  GLN1137          1HE2      GLN1137   7.074   1.316   6.924
  239   2HE2  GLN1137          2HE2      GLN1137   6.325   1.057   8.459
  240    H    CYS1138           HN       CYS1138   4.682   0.196   2.838
  241    HA   CYS1138           HA       CYS1138   5.188   2.524   1.144
  242   1HB   CYS1138           HB2      CYS1138   2.706   0.845   1.542
  243   2HB   CYS1138           HB1      CYS1138   2.803   2.239   0.471
  244    H    GLN1139           HN       GLN1139   4.424   4.532   1.553
  245    HA   GLN1139           HA       GLN1139   3.572   5.089   4.266
  246   1HB   GLN1139           HB2      GLN1139   3.915   7.079   2.024
  247   2HB   GLN1139           HB1      GLN1139   3.967   7.386   3.754
  248   1HG   GLN1139           HG2      GLN1139   6.035   6.079   3.912
  249   2HG   GLN1139           HG1      GLN1139   5.985   5.818   2.170
  250   1HE2  GLN1139          1HE2      GLN1139   4.968   8.510   1.652
  251   2HE2  GLN1139          2HE2      GLN1139   6.314   9.574   1.857
  252    H    ASN1140           HN       ASN1140   1.928   7.202   4.119
  253    HA   ASN1140           HA       ASN1140  -0.319   7.638   4.102
  254   1HB   ASN1140           HB2      ASN1140   0.710   8.037   1.672
  255   2HB   ASN1140           HB1      ASN1140  -0.467   6.795   1.257
  256   1HD2  ASN1140          1HD2      ASN1140  -2.254   7.696   3.449
  257   2HD2  ASN1140          2HD2      ASN1140  -3.013   9.127   2.850
  258    H    LEU1141           HN       LEU1141  -2.290   6.504   2.340
  259    HA   LEU1141           HA       LEU1141  -3.071   4.268   3.916
  260   1HB   LEU1141           HB2      LEU1141  -4.241   5.254   1.315
  261   2HB   LEU1141           HB1      LEU1141  -5.016   4.166   2.451
  262    HG   LEU1141           HG       LEU1141  -4.268   7.025   3.075
  263   1HD1  LEU1141          1HD1      LEU1141  -6.942   5.842   2.340
  264   2HD1  LEU1141          3HD1      LEU1141  -6.660   7.496   2.882
  265   3HD1  LEU1141          2HD1      LEU1141  -5.983   6.942   1.350
  266   1HD2  LEU1141          1HD2      LEU1141  -5.965   5.024   4.562
  267   2HD2  LEU1141          3HD2      LEU1141  -4.361   5.584   5.036
  268   3HD2  LEU1141          2HD2      LEU1141  -5.719   6.710   5.018
  269    H    TYR1142           HN       TYR1142  -0.748   4.362   1.653
  270    HA   TYR1142           HA       TYR1142  -1.403   2.127   0.009
  271   1HB   TYR1142           HB2      TYR1142   1.242   3.456   0.622
  272   2HB   TYR1142           HB1      TYR1142   1.049   2.158  -0.552
  273    HD1  TYR1142           HD1      TYR1142   0.051   5.637   0.230
  274    HD2  TYR1142           HD2      TYR1142   0.299   2.600  -2.743
  275    HE1  TYR1142           HE1      TYR1142  -0.506   7.294  -1.500
  276    HE2  TYR1142           HE2      TYR1142  -0.259   4.251  -4.480
  277    HH   TYR1142           HH       TYR1142  -0.217   7.596  -3.922
  278    H    GLN1143           HN       GLN1143  -0.045   0.129  -0.042
  279    HA   GLN1143           HA       GLN1143   1.037  -0.738   2.509
  280   1HB   GLN1143           HB2      GLN1143  -1.592  -1.203   2.162
  281   2HB   GLN1143           HB1      GLN1143  -0.941  -2.621   1.351
  282   1HG   GLN1143           HG2      GLN1143  -0.337  -1.788   4.179
  283   2HG   GLN1143           HG1      GLN1143  -1.459  -3.060   3.695
  284   1HE2  GLN1143          1HE2      GLN1143  -0.663  -4.999   2.918
  285   2HE2  GLN1143          2HE2      GLN1143   0.989  -5.464   3.111
  286    H    LEU1144           HN       LEU1144   2.924  -1.601   1.975
  287    HA   LEU1144           HA       LEU1144   3.600  -2.416  -0.640
  288   1HB   LEU1144           HB2      LEU1144   5.225  -1.568   1.004
  289   2HB   LEU1144           HB1      LEU1144   5.011  -3.023   1.956
  290    HG   LEU1144           HG       LEU1144   5.864  -3.364  -0.875
  291   1HD1  LEU1144          1HD1      LEU1144   7.710  -2.408   1.311
  292   2HD1  LEU1144          3HD1      LEU1144   8.206  -2.987  -0.279
  293   3HD1  LEU1144          2HD1      LEU1144   7.258  -1.507  -0.136
  294   1HD2  LEU1144          1HD2      LEU1144   5.461  -5.295   0.559
  295   2HD2  LEU1144          3HD2      LEU1144   7.164  -5.182   0.113
  296   3HD2  LEU1144          2HD2      LEU1144   6.638  -4.687   1.723
  297    H    GLU1145           HN       GLU1145   4.254  -4.483  -1.379
  298    HA   GLU1145           HA       GLU1145   3.206  -6.798   0.066
  299   1HB   GLU1145           HB2      GLU1145   1.419  -6.082  -1.469
  300   2HB   GLU1145           HB1      GLU1145   2.543  -6.166  -2.817
  301   1HG   GLU1145           HG2      GLU1145   1.110  -8.114  -2.770
  302   2HG   GLU1145           HG1      GLU1145   2.788  -8.569  -2.472
  303    H    GLY1146           HN       GLY1146   4.537  -8.506  -0.039
  304   1HA   GLY1146           HA1      GLY1146   6.523  -8.615  -2.209
  305   2HA   GLY1146           HA2      GLY1146   6.006  -9.982  -1.233
  306    H    ASN1147           HN       ASN1147   8.605  -9.822  -1.460
  307    HA   ASN1147           HA       ASN1147   9.514  -9.394   1.194
  308   1HB   ASN1147           HB2      ASN1147  11.783  -9.906   0.193
  309   2HB   ASN1147           HB1      ASN1147  10.552 -11.141  -0.047
  310   1HD2  ASN1147          1HD2      ASN1147  12.571  -8.782  -1.547
  311   2HD2  ASN1147          2HD2      ASN1147  12.224  -9.215  -3.183
  312    H    LYS1148           HN       LYS1148   9.350  -7.293   1.830
  313    HA   LYS1148           HA       LYS1148  10.229  -5.101   0.229
  314   1HB   LYS1148           HB2      LYS1148  10.031  -3.893   2.532
  315   2HB   LYS1148           HB1      LYS1148   8.585  -4.460   1.709
  316   1HG   LYS1148           HG2      LYS1148   8.476  -4.962   4.074
  317   2HG   LYS1148           HG1      LYS1148   8.558  -6.451   3.132
  318   1HD   LYS1148           HD2      LYS1148  11.004  -6.533   3.588
  319   2HD   LYS1148           HD1      LYS1148  10.808  -5.140   4.656
  320   1HE   LYS1148           HE2      LYS1148   9.398  -6.370   6.130
  321   2HE   LYS1148           HE1      LYS1148   9.280  -7.713   4.993
  322   1HZ   LYS1148           HZ3      LYS1148  11.752  -6.855   6.396
  323   2HZ   LYS1148           HZ2      LYS1148  10.813  -8.204   6.792
  324   3HZ   LYS1148           HZ1      LYS1148  11.632  -8.148   5.313
  325    H    ARG1149           HN       ARG1149  11.920  -7.397   1.963
  326    HA   ARG1149           HA       ARG1149  14.068  -5.647   2.816
  327   1HB   ARG1149           HB2      ARG1149  13.494  -7.573   4.202
  328   2HB   ARG1149           HB1      ARG1149  13.821  -8.661   2.862
  329   1HG   ARG1149           HG2      ARG1149  16.171  -8.010   2.896
  330   2HG   ARG1149           HG1      ARG1149  15.847  -6.900   4.230
  331   1HD   ARG1149           HD2      ARG1149  16.798  -8.992   5.043
  332   2HD   ARG1149           HD1      ARG1149  15.149  -8.774   5.629
  333    HE   ARG1149           HE       ARG1149  15.062 -10.275   3.267
  334   1HH1  ARG1149          1HH1      ARG1149  16.167 -10.563   6.559
  335   2HH1  ARG1149          2HH1      ARG1149  15.953 -12.281   6.616
  336   1HH2  ARG1149          1HH2      ARG1149  14.778 -12.536   3.333
  337   2HH2  ARG1149          2HH2      ARG1149  15.165 -13.402   4.782
  338    H    ILE1150           HN       ILE1150  15.436  -4.886   1.344
  339    HA   ILE1150           HA       ILE1150  16.437  -6.743  -0.710
  340    HB   ILE1150           HB       ILE1150  16.249  -5.228  -2.444
  341   1HG1  ILE1150          2HG1      ILE1150  17.326  -3.310  -1.456
  342   2HG1  ILE1150          1HG1      ILE1150  15.783  -2.793  -2.126
  343   1HG2  ILE1150          1HG2      ILE1150  13.878  -4.630  -0.684
  344   2HG2  ILE1150          3HG2      ILE1150  13.960  -4.349  -2.423
  345   3HG2  ILE1150          2HG2      ILE1150  14.046  -5.994  -1.790
  346   1HD1  ILE1150          2HD1      ILE1150  14.806  -2.826   0.110
  347   2HD1  ILE1150          1HD1      ILE1150  16.359  -3.329   0.776
  348   3HD1  ILE1150          3HD1      ILE1150  16.198  -1.746   0.012
  349    H    THR1151           HN       THR1151  18.399  -5.496  -1.863
  350    HA   THR1151           HA       THR1151  20.049  -4.134   0.122
  351    HB   THR1151           HB       THR1151  20.520  -6.604   0.304
  352    HG1  THR1151           HG1      THR1151  22.700  -5.048  -0.675
  353   1HG2  THR1151          3HG2      THR1151  20.245  -7.180  -2.063
  354   2HG2  THR1151          2HG2      THR1151  21.655  -6.198  -2.464
  355   3HG2  THR1151          1HG2      THR1151  21.841  -7.645  -1.474
  356    H    CYS1152           HN       CYS1152  21.857  -3.026  -0.799
  357    HA   CYS1152           HA       CYS1152  21.333  -2.126  -3.494
  358   1HB   CYS1152           HB2      CYS1152  23.025  -0.440  -3.060
  359   2HB   CYS1152           HB1      CYS1152  21.910  -0.526  -1.702
  360    H    ARG1153           HN       ARG1153  22.817  -2.190  -5.212
  361    HA   ARG1153           HA       ARG1153  25.021  -4.113  -4.900
  362   1HB   ARG1153           HB2      ARG1153  23.556  -4.030  -7.486
  363   2HB   ARG1153           HB1      ARG1153  24.390  -5.370  -6.710
  364   1HG   ARG1153           HG2      ARG1153  22.229  -6.056  -6.488
  365   2HG   ARG1153           HG1      ARG1153  22.417  -5.155  -4.981
  366   1HD   ARG1153           HD2      ARG1153  20.312  -4.627  -6.178
  367   2HD   ARG1153           HD1      ARG1153  21.350  -3.219  -5.942
  368    HE   ARG1153           HE       ARG1153  22.039  -4.166  -8.408
  369   1HH1  ARG1153          1HH1      ARG1153  19.052  -3.175  -6.918
  370   2HH1  ARG1153          2HH1      ARG1153  18.346  -2.628  -8.401
  371   1HH2  ARG1153          1HH2      ARG1153  21.118  -3.448 -10.363
  372   2HH2  ARG1153          2HH2      ARG1153  19.519  -2.784 -10.359
  373    H    ASN1154           HN       ASN1154  26.882  -3.175  -5.372
  374    HA   ASN1154           HA       ASN1154  28.454  -1.805  -6.279
  375   1HB   ASN1154           HB2      ASN1154  26.590  -1.896  -8.661
  376   2HB   ASN1154           HB1      ASN1154  28.252  -1.311  -8.696
  377   1HD2  ASN1154          1HD2      ASN1154  26.196  -4.094  -8.428
  378   2HD2  ASN1154          2HD2      ASN1154  27.423  -5.280  -8.697
  379    H    GLY1155           HN       GLY1155  26.089  -0.667  -4.861
  380   1HA   GLY1155           HA1      GLY1155  26.615   2.106  -5.574
  381   2HA   GLY1155           HA2      GLY1155  25.792   1.538  -4.132
  382    H    GLN1156           HN       GLN1156  23.992  -0.191  -5.772
  383    HA   GLN1156           HA       GLN1156  22.057   1.890  -6.414
  384   1HB   GLN1156           HB2      GLN1156  22.905  -0.225  -8.400
  385   2HB   GLN1156           HB1      GLN1156  21.487   0.798  -8.585
  386   1HG   GLN1156           HG2      GLN1156  22.918   2.776  -8.627
  387   2HG   GLN1156           HG1      GLN1156  24.339   1.749  -8.444
  388   1HE2  GLN1156          1HE2      GLN1156  23.232  -0.338 -10.164
  389   2HE2  GLN1156          2HE2      GLN1156  23.373   0.253 -11.781
  390    H    TRP1157           HN       TRP1157  20.618   1.281  -4.880
  391    HA   TRP1157           HA       TRP1157  20.064  -1.322  -4.045
  392   1HB   TRP1157           HB2      TRP1157  18.399   1.185  -3.956
  393   2HB   TRP1157           HB1      TRP1157  17.884  -0.327  -3.222
  394    HD1  TRP1157           HD1      TRP1157  20.495   2.436  -2.832
  395    HE1  TRP1157           HE1      TRP1157  21.439   2.327  -0.439
  396    HE3  TRP1157           HE3      TRP1157  18.282  -1.898  -1.319
  397    HZ2  TRP1157           HZ2      TRP1157  21.276   0.583   1.794
  398    HZ3  TRP1157           HZ3      TRP1157  18.726  -2.731   0.950
  399    HH2  TRP1157           HH2      TRP1157  20.192  -1.519   2.471
  400    H    SER1158           HN       SER1158  17.898  -2.364  -4.175
  401    HA   SER1158           HA       SER1158  16.920  -2.372  -6.951
  402   1HB   SER1158           HB2      SER1158  16.235  -4.741  -6.463
  403   2HB   SER1158           HB1      SER1158  17.977  -4.474  -6.434
  404    HG   SER1158           HG       SER1158  16.661  -5.616  -4.583
  405    H    GLU1159           HN       GLU1159  14.879  -1.784  -7.270
  406    HA   GLU1159           HA       GLU1159  13.190  -0.807  -5.297
  407   1HB   GLU1159           HB2      GLU1159  12.970  -0.241  -7.671
  408   2HB   GLU1159           HB1      GLU1159  12.468  -1.888  -8.028
  409   1HG   GLU1159           HG2      GLU1159  10.464  -1.577  -6.674
  410   2HG   GLU1159           HG1      GLU1159  10.968   0.072  -6.309
  411    HA   PRO1160           HA       PRO1160  11.499  -4.437  -3.385
  412   1HB   PRO1160           HB2      PRO1160   9.119  -3.419  -2.517
  413   2HB   PRO1160           HB1      PRO1160  10.662  -3.106  -1.718
  414   1HG   PRO1160           HG2      PRO1160   9.159  -1.403  -3.667
  415   2HG   PRO1160           HG1      PRO1160   9.974  -0.929  -2.165
  416   1HD   PRO1160           HD2      PRO1160  11.103  -0.531  -4.567
  417   2HD   PRO1160           HD1      PRO1160  12.067  -0.966  -3.141
  418    HA   PRO1161           HA       PRO1161   8.739  -6.704  -5.964
  419   1HB   PRO1161           HB2      PRO1161   6.776  -6.799  -3.719
  420   2HB   PRO1161           HB1      PRO1161   7.410  -8.113  -4.715
  421   1HG   PRO1161           HG2      PRO1161   8.304  -7.751  -2.239
  422   2HG   PRO1161           HG1      PRO1161   9.414  -8.207  -3.544
  423   1HD   PRO1161           HD2      PRO1161   9.029  -5.564  -2.218
  424   2HD   PRO1161           HD1      PRO1161  10.511  -6.302  -2.857
  425    H    LYS1162           HN       LYS1162   6.300  -5.100  -3.898
  426    HA   LYS1162           HA       LYS1162   5.583  -3.244  -5.984
  427   1HB   LYS1162           HB2      LYS1162   4.572  -5.462  -6.687
  428   2HB   LYS1162           HB1      LYS1162   3.539  -5.343  -5.270
  429   1HG   LYS1162           HG2      LYS1162   2.337  -4.583  -7.201
  430   2HG   LYS1162           HG1      LYS1162   2.646  -3.215  -6.133
  431   1HD   LYS1162           HD2      LYS1162   3.053  -2.542  -8.410
  432   2HD   LYS1162           HD1      LYS1162   4.591  -2.609  -7.546
  433   1HE   LYS1162           HE2      LYS1162   5.048  -4.802  -8.518
  434   2HE   LYS1162           HE1      LYS1162   3.505  -4.752  -9.370
  435   1HZ   LYS1162           HZ3      LYS1162   5.758  -2.857  -9.768
  436   2HZ   LYS1162           HZ2      LYS1162   5.336  -4.119 -10.812
  437   3HZ   LYS1162           HZ1      LYS1162   4.279  -2.817 -10.589
  438    H    CYS1163           HN       CYS1163   3.548  -2.011  -5.383
  439    HA   CYS1163           HA       CYS1163   3.237  -1.858  -2.462
  440   1HB   CYS1163           HB2      CYS1163   4.693  -0.030  -3.326
  441   2HB   CYS1163           HB1      CYS1163   3.364   0.501  -4.352
  442    H    LEU1164           HN       LEU1164   1.266  -2.895  -2.419
  443    HA   LEU1164           HA       LEU1164  -0.850  -2.529  -4.210
  444   1HB   LEU1164           HB2      LEU1164  -1.006  -3.243  -1.282
  445   2HB   LEU1164           HB1      LEU1164  -2.274  -3.490  -2.466
  446    HG   LEU1164           HG       LEU1164   0.423  -4.831  -2.524
  447   1HD1  LEU1164          2HD1      LEU1164  -2.261  -5.912  -1.707
  448   2HD1  LEU1164          1HD1      LEU1164  -0.779  -6.854  -1.880
  449   3HD1  LEU1164          3HD1      LEU1164  -0.890  -5.604  -0.640
  450   1HD2  LEU1164          2HD2      LEU1164  -0.539  -4.550  -4.743
  451   2HD2  LEU1164          1HD2      LEU1164  -0.573  -6.244  -4.254
  452   3HD2  LEU1164          3HD2      LEU1164  -2.047  -5.278  -4.189
  453    H    HIS1165           HN       HIS1165  -1.523  -0.528  -4.704
  454    HA   HIS1165           HA       HIS1165  -1.636   1.680  -3.012
  455   1HB   HIS1165           HB2      HIS1165  -3.443   1.078  -5.368
  456   2HB   HIS1165           HB1      HIS1165  -3.165   2.665  -4.659
  457    HD1  HIS1165           HD1      HIS1165  -1.394   4.015  -5.740
  458    HD2  HIS1165           HD2      HIS1165  -0.936  -0.043  -6.506
  459    HE1  HIS1165           HE1      HIS1165   0.525   3.849  -7.355
  460    HE2  HIS1165           HE2      HIS1165   0.838   1.379  -7.740
  461    HA   PRO1166           HA       PRO1166  -4.989   0.953  -0.245
  462   1HB   PRO1166           HB2      PRO1166  -6.240   3.419  -0.292
  463   2HB   PRO1166           HB1      PRO1166  -4.817   3.038   0.682
  464   1HG   PRO1166           HG2      PRO1166  -4.990   4.418  -1.965
  465   2HG   PRO1166           HG1      PRO1166  -3.958   4.790  -0.570
  466   1HD   PRO1166           HD2      PRO1166  -2.992   3.509  -2.719
  467   2HD   PRO1166           HD1      PRO1166  -2.457   3.096  -1.080
  468    H    CYS1167           HN       CYS1167  -7.339   0.797  -0.172
  469    HA   CYS1167           HA       CYS1167  -8.419   0.007  -2.669
  470   1HB   CYS1167           HB2      CYS1167 -10.606   0.208  -1.083
  471   2HB   CYS1167           HB1      CYS1167  -9.521  -1.178  -1.096
  472    H    VAL1168           HN       VAL1168  -7.961   2.052  -3.782
  473    HA   VAL1168           HA       VAL1168  -9.323   4.436  -3.159
  474    HB   VAL1168           HB       VAL1168  -7.422   4.555  -4.606
  475   1HG1  VAL1168          1HG1      VAL1168  -8.977   2.855  -6.551
  476   2HG1  VAL1168          3HG1      VAL1168  -7.419   3.614  -6.873
  477   3HG1  VAL1168          2HG1      VAL1168  -7.551   2.364  -5.637
  478   1HG2  VAL1168          1HG2      VAL1168  -9.122   6.256  -4.958
  479   2HG2  VAL1168          3HG2      VAL1168  -8.314   5.866  -6.477
  480   3HG2  VAL1168          2HG2      VAL1168  -9.926   5.230  -6.147
  481    H    ILE1169           HN       ILE1169 -11.457   3.964  -2.721
  482    HA   ILE1169           HA       ILE1169 -13.119   2.926  -4.892
  483    HB   ILE1169           HB       ILE1169 -13.249   2.123  -2.433
  484   1HG1  ILE1169          2HG1      ILE1169 -15.723   2.940  -3.970
  485   2HG1  ILE1169          1HG1      ILE1169 -14.837   1.429  -4.137
  486   1HG2  ILE1169          1HG2      ILE1169 -13.342   4.321  -1.399
  487   2HG2  ILE1169          3HG2      ILE1169 -14.862   4.660  -2.229
  488   3HG2  ILE1169          2HG2      ILE1169 -14.785   3.383  -1.014
  489   1HD1  ILE1169          3HD1      ILE1169 -16.306   2.323  -1.672
  490   2HD1  ILE1169          2HD1      ILE1169 -16.896   1.152  -2.857
  491   3HD1  ILE1169          1HD1      ILE1169 -15.465   0.788  -1.889
  492    H    SER1170           HN       SER1170 -15.525   4.152  -4.363
  493    HA   SER1170           HA       SER1170 -14.950   7.013  -4.774
  494   1HB   SER1170           HB2      SER1170 -16.969   5.337  -6.284
  495   2HB   SER1170           HB1      SER1170 -16.764   7.081  -6.450
  496    HG   SER1170           HG       SER1170 -14.929   5.035  -7.128
  497    H    ARG1171           HN       ARG1171 -15.961   8.297  -3.394
  498    HA   ARG1171           HA       ARG1171 -17.707   7.409  -1.394
  499   1HB   ARG1171           HB2      ARG1171 -18.087   9.798  -0.928
  500   2HB   ARG1171           HB1      ARG1171 -16.382   9.436  -1.154
  501   1HG   ARG1171           HG2      ARG1171 -16.509  10.298  -3.444
  502   2HG   ARG1171           HG1      ARG1171 -18.212  10.685  -3.192
  503   1HD   ARG1171           HD2      ARG1171 -16.884  12.676  -2.893
  504   2HD   ARG1171           HD1      ARG1171 -17.569  12.186  -1.344
  505    HE   ARG1171           HE       ARG1171 -15.081  11.026  -1.448
  506   1HH1  ARG1171          1HH1      ARG1171 -16.353  14.266  -1.611
  507   2HH1  ARG1171          2HH1      ARG1171 -14.945  14.991  -0.910
  508   1HH2  ARG1171          1HH2      ARG1171 -13.224  11.973  -0.524
  509   2HH2  ARG1171          2HH2      ARG1171 -13.166  13.688  -0.292
  510    H    GLU1172           HN       GLU1172 -18.366   8.969  -4.503
  511    HA   GLU1172           HA       GLU1172 -21.174   9.203  -4.078
  512   1HB   GLU1172           HB2      GLU1172 -19.815  10.564  -5.702
  513   2HB   GLU1172           HB1      GLU1172 -19.714   9.136  -6.723
  514   1HG   GLU1172           HG2      GLU1172 -22.149   9.114  -6.930
  515   2HG   GLU1172           HG1      GLU1172 -22.245  10.551  -5.913
  516    H    ILE1173           HN       ILE1173 -19.429   6.504  -4.211
  517    HA   ILE1173           HA       ILE1173 -21.607   4.972  -5.455
  518    HB   ILE1173           HB       ILE1173 -18.710   4.189  -5.712
  519   1HG1  ILE1173          2HG1      ILE1173 -19.229   6.359  -6.864
  520   2HG1  ILE1173          1HG1      ILE1173 -18.691   5.073  -7.941
  521   1HG2  ILE1173          2HG2      ILE1173 -21.203   3.243  -7.120
  522   2HG2  ILE1173          1HG2      ILE1173 -19.562   2.688  -7.456
  523   3HG2  ILE1173          3HG2      ILE1173 -20.299   2.361  -5.888
  524   1HD1  ILE1173          2HD1      ILE1173 -21.536   5.960  -7.523
  525   2HD1  ILE1173          1HD1      ILE1173 -20.518   6.335  -8.915
  526   3HD1  ILE1173          3HD1      ILE1173 -21.006   4.669  -8.601
  527    H    MET1174           HN       MET1174 -19.530   5.457  -2.814
  528    HA   MET1174           HA       MET1174 -20.158   2.794  -1.739
  529   1HB   MET1174           HB2      MET1174 -18.262   3.046  -0.252
  530   2HB   MET1174           HB1      MET1174 -17.752   3.274  -1.918
  531   1HG   MET1174           HG2      MET1174 -16.956   5.283  -1.467
  532   2HG   MET1174           HG1      MET1174 -18.488   5.787  -0.753
  533   1HE   MET1174           HE1      MET1174 -18.777   3.659   1.614
  534   2HE   MET1174           HE3      MET1174 -18.070   4.566   2.952
  535   3HE   MET1174           HE2      MET1174 -19.129   5.377   1.799
  536    H    GLU1175           HN       GLU1175 -20.139   6.243  -1.029
  537    HA   GLU1175           HA       GLU1175 -21.733   5.702   1.380
  538   1HB   GLU1175           HB2      GLU1175 -21.057   7.768   2.261
  539   2HB   GLU1175           HB1      GLU1175 -19.603   7.159   1.480
  540   1HG   GLU1175           HG2      GLU1175 -19.897   8.621  -0.375
  541   2HG   GLU1175           HG1      GLU1175 -21.501   9.098   0.181
  542    H    ASN1176           HN       ASN1176 -22.205   6.231  -1.768
  543    HA   ASN1176           HA       ASN1176 -24.598   7.890  -1.365
  544   1HB   ASN1176           HB2      ASN1176 -22.770   8.777  -2.866
  545   2HB   ASN1176           HB1      ASN1176 -23.167   7.465  -3.962
  546   1HD2  ASN1176          1HD2      ASN1176 -23.807   8.840  -5.595
  547   2HD2  ASN1176          2HD2      ASN1176 -25.282   9.735  -5.525
  548    H    TYR1177           HN       TYR1177 -23.359   4.873  -2.591
  549    HA   TYR1177           HA       TYR1177 -25.783   4.161  -3.972
  550   1HB   TYR1177           HB2      TYR1177 -23.144   2.882  -3.474
  551   2HB   TYR1177           HB1      TYR1177 -24.505   1.818  -3.817
  552    HD1  TYR1177           HD1      TYR1177 -24.155   5.190  -5.272
  553    HD2  TYR1177           HD2      TYR1177 -23.685   1.010  -5.913
  554    HE1  TYR1177           HE1      TYR1177 -23.871   5.596  -7.680
  555    HE2  TYR1177           HE2      TYR1177 -23.398   1.406  -8.323
  556    HH   TYR1177           HH       TYR1177 -23.975   3.109  -9.990
  557    H    ASN1178           HN       ASN1178 -26.129   4.883  -1.235
  558    HA   ASN1178           HA       ASN1178 -27.392   4.255   0.534
  559   1HB   ASN1178           HB2      ASN1178 -27.849   1.575  -0.766
  560   2HB   ASN1178           HB1      ASN1178 -28.902   2.445   0.347
  561   1HD2  ASN1178          1HD2      ASN1178 -30.108   4.198  -0.416
  562   2HD2  ASN1178          2HD2      ASN1178 -30.419   4.412  -2.101
  563    H    ILE1179           HN       ILE1179 -24.494   3.271  -0.075
  564    HA   ILE1179           HA       ILE1179 -24.386   1.322   2.126
  565    HB   ILE1179           HB       ILE1179 -21.982   0.982   1.031
  566   1HG1  ILE1179          2HG1      ILE1179 -23.716   1.610  -1.367
  567   2HG1  ILE1179          1HG1      ILE1179 -22.513   2.725  -0.729
  568   1HG2  ILE1179          2HG2      ILE1179 -23.622  -0.757   1.448
  569   2HG2  ILE1179          1HG2      ILE1179 -24.535  -0.261   0.022
  570   3HG2  ILE1179          3HG2      ILE1179 -22.919  -0.943  -0.159
  571   1HD1  ILE1179          3HD1      ILE1179 -20.769   1.039  -1.146
  572   2HD1  ILE1179          2HD1      ILE1179 -21.992  -0.015  -1.854
  573   3HD1  ILE1179          1HD1      ILE1179 -21.613   1.529  -2.615
  574    H    ALA1180           HN       ALA1180 -22.189   1.341   3.242
  575    HA   ALA1180           HA       ALA1180 -20.583   3.636   3.355
  576   1HB   ALA1180           HB2      ALA1180 -21.325   4.640   5.456
  577   2HB   ALA1180           HB1      ALA1180 -22.584   4.737   4.224
  578   3HB   ALA1180           HB3      ALA1180 -22.696   3.532   5.507
  579    H    LEU1181           HN       LEU1181 -18.848   3.359   4.770
  580    HA   LEU1181           HA       LEU1181 -17.961   0.863   5.352
  581   1HB   LEU1181           HB2      LEU1181 -17.389   3.532   6.527
  582   2HB   LEU1181           HB1      LEU1181 -16.757   2.128   7.365
  583    HG   LEU1181           HG       LEU1181 -15.120   3.136   5.814
  584   1HD1  LEU1181          3HD1      LEU1181 -14.968   0.772   6.366
  585   2HD1  LEU1181          2HD1      LEU1181 -16.049   0.378   5.029
  586   3HD1  LEU1181          1HD1      LEU1181 -14.456   1.063   4.705
  587   1HD2  LEU1181          1HD2      LEU1181 -16.664   3.956   4.114
  588   2HD2  LEU1181          3HD2      LEU1181 -15.434   2.914   3.400
  589   3HD2  LEU1181          2HD2      LEU1181 -17.064   2.298   3.667
  590    H    ARG1182           HN       ARG1182 -17.905  -0.517   7.146
  591    HA   ARG1182           HA       ARG1182 -20.324  -0.773   8.565
  592   1HB   ARG1182           HB2      ARG1182 -19.186  -2.581   9.792
  593   2HB   ARG1182           HB1      ARG1182 -18.947  -2.705   8.055
  594   1HG   ARG1182           HG2      ARG1182 -16.720  -1.739   8.283
  595   2HG   ARG1182           HG1      ARG1182 -16.959  -1.597  10.027
  596   1HD   ARG1182           HD2      ARG1182 -17.202  -4.025  10.190
  597   2HD   ARG1182           HD1      ARG1182 -16.965  -4.167   8.448
  598    HE   ARG1182           HE       ARG1182 -14.765  -2.812   9.455
  599   1HH1  ARG1182          1HH1      ARG1182 -16.243  -5.950   9.787
  600   2HH1  ARG1182          2HH1      ARG1182 -14.750  -6.760  10.125
  601   1HH2  ARG1182          1HH2      ARG1182 -12.795  -3.870   9.897
  602   2HH2  ARG1182          2HH2      ARG1182 -12.789  -5.578  10.188
  603    H    TRP1183           HN       TRP1183 -17.845   1.347   9.049
  604    HA   TRP1183           HA       TRP1183 -18.070   1.424  11.956
  605   1HB   TRP1183           HB2      TRP1183 -16.418   3.279  10.248
  606   2HB   TRP1183           HB1      TRP1183 -16.170   2.834  11.934
  607    HD1  TRP1183           HD1      TRP1183 -16.082   1.097   8.461
  608    HE1  TRP1183           HE1      TRP1183 -14.259  -0.714   8.524
  609    HE3  TRP1183           HE3      TRP1183 -14.618   1.580  13.338
  610    HZ2  TRP1183           HZ2      TRP1183 -12.435  -1.782  10.374
  611    HZ3  TRP1183           HZ3      TRP1183 -12.819   0.122  14.175
  612    HH2  TRP1183           HH2      TRP1183 -11.750  -1.525  12.721
  613    H    THR1184           HN       THR1184 -19.798   2.511   9.437
  614    HA   THR1184           HA       THR1184 -21.208   4.254   9.004
  615    HB   THR1184           HB       THR1184 -22.652   4.895  10.852
  616    HG1  THR1184           HG1      THR1184 -21.790   5.025  12.773
  617   1HG2  THR1184          3HG2      THR1184 -21.843   1.987  11.008
  618   2HG2  THR1184          2HG2      THR1184 -23.362   2.663  11.597
  619   3HG2  THR1184          1HG2      THR1184 -22.997   2.685   9.871
  620    H    ALA1185           HN       ALA1185 -18.426   4.996   9.377
  621    HA   ALA1185           HA       ALA1185 -18.409   7.487  10.831
  622   1HB   ALA1185           HB2      ALA1185 -16.319   6.297   9.012
  623   2HB   ALA1185           HB3      ALA1185 -16.416   6.067  10.758
  624   3HB   ALA1185           HB1      ALA1185 -16.096   7.670  10.096
  625    H    LYS1186           HN       LYS1186 -19.615   6.605   7.878
  626    HA   LYS1186           HA       LYS1186 -20.449   7.802   6.146
  627   1HB   LYS1186           HB2      LYS1186 -21.050   9.519   7.799
  628   2HB   LYS1186           HB1      LYS1186 -19.442  10.216   7.663
  629   1HG   LYS1186           HG2      LYS1186 -19.869  10.764   5.325
  630   2HG   LYS1186           HG1      LYS1186 -21.477  10.051   5.449
  631   1HD   LYS1186           HD2      LYS1186 -20.587  12.281   7.255
  632   2HD   LYS1186           HD1      LYS1186 -21.289  12.593   5.666
  633   1HE   LYS1186           HE2      LYS1186 -23.037  12.731   7.290
  634   2HE   LYS1186           HE1      LYS1186 -23.274  11.257   6.353
  635   1HZ   LYS1186           HZ1      LYS1186 -21.963  11.348   9.014
  636   2HZ   LYS1186           HZ3      LYS1186 -23.591  10.957   8.764
  637   3HZ   LYS1186           HZ2      LYS1186 -22.376   9.963   8.134
  638    H    GLN1187           HN       GLN1187 -19.380   7.349   4.382
  639    HA   GLN1187           HA       GLN1187 -17.970   7.622   2.618
  640   1HB   GLN1187           HB2      GLN1187 -17.974  10.030   3.062
  641   2HB   GLN1187           HB1      GLN1187 -16.705   9.821   4.261
  642   1HG   GLN1187           HG2      GLN1187 -15.209   8.989   2.489
  643   2HG   GLN1187           HG1      GLN1187 -16.478   9.306   1.306
  644   1HE2  GLN1187          1HE2      GLN1187 -17.005  11.430   0.791
  645   2HE2  GLN1187          2HE2      GLN1187 -15.965  12.754   1.178
  646    H    LYS1188           HN       LYS1188 -15.468   8.634   4.869
  647    HA   LYS1188           HA       LYS1188 -13.602   7.602   5.672
  648   1HB   LYS1188           HB2      LYS1188 -15.142   5.842   6.494
  649   2HB   LYS1188           HB1      LYS1188 -15.002   5.017   4.948
  650   1HG   LYS1188           HG2      LYS1188 -13.589   3.941   6.565
  651   2HG   LYS1188           HG1      LYS1188 -12.586   4.734   5.347
  652   1HD   LYS1188           HD2      LYS1188 -12.225   6.617   6.864
  653   2HD   LYS1188           HD1      LYS1188 -13.235   5.833   8.081
  654   1HE   LYS1188           HE2      LYS1188 -11.669   3.960   8.179
  655   2HE   LYS1188           HE1      LYS1188 -10.662   4.735   6.956
  656   1HZ   LYS1188           HZ2      LYS1188 -10.298   6.577   8.479
  657   2HZ   LYS1188           HZ1      LYS1188 -11.259   5.828   9.652
  658   3HZ   LYS1188           HZ3      LYS1188  -9.799   5.118   9.173
  659    H    LEU1189           HN       LEU1189 -14.838   7.164   2.574
  660    HA   LEU1189           HA       LEU1189 -13.974   6.824   0.527
  661   1HB   LEU1189           HB2      LEU1189 -11.538   7.898   1.933
  662   2HB   LEU1189           HB1      LEU1189 -11.619   7.638   0.201
  663    HG   LEU1189           HG       LEU1189 -13.340   9.542   1.796
  664   1HD1  LEU1189          2HD1      LEU1189 -11.136  10.033  -0.202
  665   2HD1  LEU1189          1HD1      LEU1189 -12.143  11.273   0.546
  666   3HD1  LEU1189          3HD1      LEU1189 -11.047  10.310   1.537
  667   1HD2  LEU1189          1HD2      LEU1189 -13.284   8.967  -1.164
  668   2HD2  LEU1189          3HD2      LEU1189 -14.603   8.606  -0.050
  669   3HD2  LEU1189          2HD2      LEU1189 -14.174  10.282  -0.394
  670    H    TYR1190           HN       TYR1190 -10.796   6.137   1.799
  671    HA   TYR1190           HA       TYR1190 -11.172   3.354   0.898
  672   1HB   TYR1190           HB2      TYR1190  -8.440   4.431   0.757
  673   2HB   TYR1190           HB1      TYR1190  -9.329   3.447  -0.399
  674    HD1  TYR1190           HD1      TYR1190 -11.465   4.874  -1.415
  675    HD2  TYR1190           HD2      TYR1190  -7.755   6.461  -0.058
  676    HE1  TYR1190           HE1      TYR1190 -11.790   6.851  -2.844
  677    HE2  TYR1190           HE2      TYR1190  -8.073   8.441  -1.481
  678    HH   TYR1190           HH       TYR1190 -11.035   9.186  -2.961
  679    H    SER1191           HN       SER1191  -8.794   2.303   1.498
  680    HA   SER1191           HA       SER1191  -8.172   2.699   4.303
  681   1HB   SER1191           HB2      SER1191  -9.591   0.311   3.227
  682   2HB   SER1191           HB1      SER1191  -8.431   0.089   4.529
  683    HG   SER1191           HG       SER1191  -9.656   1.409   5.826
  684    H    ARG1192           HN       ARG1192  -6.530   0.812   4.919
  685    HA   ARG1192           HA       ARG1192  -4.434   0.966   2.912
  686   1HB   ARG1192           HB2      ARG1192  -3.990   1.413   5.348
  687   2HB   ARG1192           HB1      ARG1192  -4.323  -0.285   5.665
  688   1HG   ARG1192           HG2      ARG1192  -2.474  -0.859   4.085
  689   2HG   ARG1192           HG1      ARG1192  -2.082   0.861   4.018
  690   1HD   ARG1192           HD2      ARG1192  -1.863   0.801   6.521
  691   2HD   ARG1192           HD1      ARG1192  -1.997  -0.955   6.417
  692    HE   ARG1192           HE       ARG1192   0.013  -0.387   4.700
  693   1HH1  ARG1192          1HH1      ARG1192  -0.603   0.449   8.027
  694   2HH1  ARG1192          2HH1      ARG1192   1.075   0.529   8.451
  695   1HH2  ARG1192          1HH2      ARG1192   2.223  -0.282   5.249
  696   2HH2  ARG1192          2HH2      ARG1192   2.680   0.115   6.871
  697    H    THR1193           HN       THR1193  -4.227  -0.582   1.438
  698    HA   THR1193           HA       THR1193  -5.727  -2.770   1.060
  699    HB   THR1193           HB       THR1193  -2.779  -2.496   0.462
  700    HG1  THR1193           HG1      THR1193  -4.319  -1.073  -0.591
  701   1HG2  THR1193          1HG2      THR1193  -3.546  -4.898   0.566
  702   2HG2  THR1193          3HG2      THR1193  -4.648  -4.521  -0.758
  703   3HG2  THR1193          2HG2      THR1193  -2.904  -4.377  -0.992
  704    H    GLY1194           HN       GLY1194  -6.204  -4.509   2.177
  705   1HA   GLY1194           HA1      GLY1194  -4.262  -5.476   4.178
  706   2HA   GLY1194           HA2      GLY1194  -5.139  -6.590   3.136
  707    H    GLU1195           HN       GLU1195  -6.622  -3.710   4.396
  708    HA   GLU1195           HA       GLU1195  -7.927  -5.144   6.563
  709   1HB   GLU1195           HB2      GLU1195  -8.016  -2.250   5.688
  710   2HB   GLU1195           HB1      GLU1195  -8.948  -2.892   7.036
  711   1HG   GLU1195           HG2      GLU1195  -5.945  -2.893   6.816
  712   2HG   GLU1195           HG1      GLU1195  -6.911  -1.777   7.780
  713    H    SER1196           HN       SER1196 -10.188  -5.363   6.752
  714    HA   SER1196           HA       SER1196 -11.521  -5.802   4.236
  715   1HB   SER1196           HB2      SER1196 -13.374  -6.655   5.631
  716   2HB   SER1196           HB1      SER1196 -11.832  -7.384   6.080
  717    HG   SER1196           HG       SER1196 -12.697  -6.785   7.980
  718    H    VAL1197           HN       VAL1197 -12.989  -4.540   3.259
  719    HA   VAL1197           HA       VAL1197 -13.850  -2.105   4.682
  720    HB   VAL1197           HB       VAL1197 -13.712  -2.383   1.683
  721   1HG1  VAL1197          3HG1      VAL1197 -13.801   0.009   3.520
  722   2HG1  VAL1197          2HG1      VAL1197 -13.697   0.070   1.761
  723   3HG1  VAL1197          1HG1      VAL1197 -15.132  -0.600   2.536
  724   1HG2  VAL1197          1HG2      VAL1197 -11.467  -2.754   2.563
  725   2HG2  VAL1197          3HG2      VAL1197 -11.575  -1.189   1.759
  726   3HG2  VAL1197          2HG2      VAL1197 -11.587  -1.279   3.520
  727    H    GLU1198           HN       GLU1198 -15.760  -2.905   5.516
  728    HA   GLU1198           HA       GLU1198 -17.706  -4.077   3.678
  729   1HB   GLU1198           HB2      GLU1198 -17.786  -5.374   5.556
  730   2HB   GLU1198           HB1      GLU1198 -17.315  -4.056   6.619
  731   1HG   GLU1198           HG2      GLU1198 -19.509  -3.189   6.677
  732   2HG   GLU1198           HG1      GLU1198 -20.032  -4.235   5.354
  733    H    PHE1199           HN       PHE1199 -19.300  -2.916   2.800
  734    HA   PHE1199           HA       PHE1199 -19.859  -0.262   3.926
  735   1HB   PHE1199           HB2      PHE1199 -20.772  -1.229   1.226
  736   2HB   PHE1199           HB1      PHE1199 -20.572   0.428   1.788
  737    HD1  PHE1199           HD1      PHE1199 -18.504   1.551   1.591
  738    HD2  PHE1199           HD2      PHE1199 -18.777  -2.609   0.741
  739    HE1  PHE1199           HE1      PHE1199 -16.252   1.614   0.596
  740    HE2  PHE1199           HE2      PHE1199 -16.529  -2.562  -0.247
  741    HZ   PHE1199           HZ       PHE1199 -15.263  -0.451  -0.319
  742    H    VAL1200           HN       VAL1200 -21.324  -0.854   5.551
  743    HA   VAL1200           HA       VAL1200 -23.482  -2.579   5.335
  744    HB   VAL1200           HB       VAL1200 -24.532  -1.351   7.157
  745   1HG1  VAL1200          1HG1      VAL1200 -21.533  -1.524   7.418
  746   2HG1  VAL1200          3HG1      VAL1200 -22.646  -1.325   8.772
  747   3HG1  VAL1200          2HG1      VAL1200 -22.708  -2.787   7.785
  748   1HG2  VAL1200          1HG2      VAL1200 -24.195   0.916   6.323
  749   2HG2  VAL1200          3HG2      VAL1200 -23.610   0.761   7.980
  750   3HG2  VAL1200          2HG2      VAL1200 -22.465   0.785   6.640
  751    H    CYS1201           HN       CYS1201 -25.819  -1.998   5.171
  752    HA   CYS1201           HA       CYS1201 -26.225  -0.407   2.794
  753   1HB   CYS1201           HB2      CYS1201 -28.323  -1.802   4.458
  754   2HB   CYS1201           HB1      CYS1201 -28.467  -1.262   2.789
  755    H    LYS1202           HN       LYS1202 -25.443   1.516   4.133
  756    HA   LYS1202           HA       LYS1202 -25.857   3.299   5.594
  757   1HB   LYS1202           HB2      LYS1202 -26.262   4.055   3.328
  758   2HB   LYS1202           HB1      LYS1202 -27.924   3.487   3.403
  759   1HG   LYS1202           HG2      LYS1202 -28.297   5.117   5.271
  760   2HG   LYS1202           HG1      LYS1202 -26.695   5.772   4.921
  761   1HD   LYS1202           HD2      LYS1202 -27.387   6.293   2.646
  762   2HD   LYS1202           HD1      LYS1202 -28.977   5.589   2.957
  763   1HE   LYS1202           HE2      LYS1202 -29.384   7.278   4.682
  764   2HE   LYS1202           HE1      LYS1202 -27.797   7.982   4.368
  765   1HZ   LYS1202           HZ2      LYS1202 -30.029   7.813   2.415
  766   2HZ   LYS1202           HZ1      LYS1202 -29.545   9.206   3.243
  767   3HZ   LYS1202           HZ3      LYS1202 -28.507   8.490   2.116
  768    H    ARG1203           HN       ARG1203 -26.578   2.381   7.540
  769    HA   ARG1203           HA       ARG1203 -28.089   1.584   9.094
  770   1HB   ARG1203           HB2      ARG1203 -28.687   4.407   8.357
  771   2HB   ARG1203           HB1      ARG1203 -29.601   3.621   9.634
  772   1HG   ARG1203           HG2      ARG1203 -27.458   3.129  10.786
  773   2HG   ARG1203           HG1      ARG1203 -26.628   4.067   9.543
  774   1HD   ARG1203           HD2      ARG1203 -27.017   5.412  11.537
  775   2HD   ARG1203           HD1      ARG1203 -27.916   6.043  10.158
  776    HE   ARG1203           HE       ARG1203 -29.556   4.283  11.617
  777   1HH1  ARG1203          1HH1      ARG1203 -28.103   7.442  11.856
  778   2HH1  ARG1203          2HH1      ARG1203 -29.340   8.074  12.892
  779   1HH2  ARG1203          1HH2      ARG1203 -31.189   5.108  12.979
  780   2HH2  ARG1203          2HH2      ARG1203 -31.093   6.747  13.530
  781    H    GLY1204           HN       GLY1204 -29.063  -0.034   7.573
  782   1HA   GLY1204           HA1      GLY1204 -31.877   0.679   7.006
  783   2HA   GLY1204           HA2      GLY1204 -31.406  -0.870   7.690
  784    H    TYR1205           HN       TYR1205 -32.673   0.213   5.056
  785    HA   TYR1205           HA       TYR1205 -32.849  -0.537   2.921
  786   1HB   TYR1205           HB2      TYR1205 -29.855  -0.411   3.128
  787   2HB   TYR1205           HB1      TYR1205 -30.714  -0.686   1.623
  788    HD1  TYR1205           HD1      TYR1205 -29.771   1.777   4.139
  789    HD2  TYR1205           HD2      TYR1205 -32.008   1.123   0.590
  790    HE1  TYR1205           HE1      TYR1205 -29.907   4.204   3.785
  791    HE2  TYR1205           HE2      TYR1205 -32.154   3.547   0.223
  792    HH   TYR1205           HH       TYR1205 -31.994   5.611   1.468
  793    H    ARG1206           HN       ARG1206 -32.383  -2.330   1.384
  794    HA   ARG1206           HA       ARG1206 -31.522  -4.786   2.739
  795   1HB   ARG1206           HB2      ARG1206 -33.414  -6.030   1.914
  796   2HB   ARG1206           HB1      ARG1206 -34.003  -4.646   2.821
  797   1HG   ARG1206           HG2      ARG1206 -34.637  -3.503   0.858
  798   2HG   ARG1206           HG1      ARG1206 -33.749  -4.629  -0.171
  799   1HD   ARG1206           HD2      ARG1206 -35.283  -6.422   0.463
  800   2HD   ARG1206           HD1      ARG1206 -36.169  -5.302   1.498
  801    HE   ARG1206           HE       ARG1206 -36.094  -4.238  -1.087
  802   1HH1  ARG1206          1HH1      ARG1206 -37.483  -6.933   0.630
  803   2HH1  ARG1206          2HH1      ARG1206 -38.859  -7.055  -0.415
  804   1HH2  ARG1206          1HH2      ARG1206 -37.901  -4.393  -2.467
  805   2HH2  ARG1206          2HH2      ARG1206 -39.096  -5.611  -2.176
  806    H    LEU1207           HN       LEU1207 -30.146  -5.928   1.578
  807    HA   LEU1207           HA       LEU1207 -28.913  -5.189  -0.710
  808   1HB   LEU1207           HB2      LEU1207 -29.465  -7.931   0.374
  809   2HB   LEU1207           HB1      LEU1207 -28.544  -7.716  -1.101
  810    HG   LEU1207           HG       LEU1207 -27.798  -6.546   1.581
  811   1HD1  LEU1207          3HD1      LEU1207 -27.635  -8.989   1.553
  812   2HD1  LEU1207          2HD1      LEU1207 -26.640  -8.903   0.100
  813   3HD1  LEU1207          1HD1      LEU1207 -26.044  -8.231   1.617
  814   1HD2  LEU1207          2HD2      LEU1207 -27.022  -5.228  -0.340
  815   2HD2  LEU1207          1HD2      LEU1207 -25.682  -6.005   0.511
  816   3HD2  LEU1207          3HD2      LEU1207 -26.265  -6.672  -1.015
  817    H    SER1208           HN       SER1208 -29.163  -5.365  -2.884
  818    HA   SER1208           HA       SER1208 -31.834  -6.125  -3.818
  819   1HB   SER1208           HB2      SER1208 -31.082  -3.855  -4.380
  820   2HB   SER1208           HB1      SER1208 -29.666  -4.518  -5.194
  821    HG   SER1208           HG       SER1208 -31.162  -4.161  -6.766
  822    H    SER1209           HN       SER1209 -29.299  -7.817  -3.263
  823    HA   SER1209           HA       SER1209 -28.593  -9.852  -4.007
  824   1HB   SER1209           HB2      SER1209 -30.824 -10.270  -4.920
  825   2HB   SER1209           HB1      SER1209 -30.413  -9.364  -6.376
  826    HG   SER1209           HG       SER1209 -29.924 -11.937  -5.802
  827    H    ARG1210           HN       ARG1210 -28.789  -7.394  -6.568
  828    HA   ARG1210           HA       ARG1210 -26.388  -8.357  -7.833
  829   1HB   ARG1210           HB2      ARG1210 -28.030  -5.864  -8.314
  830   2HB   ARG1210           HB1      ARG1210 -26.673  -6.378  -9.310
  831   1HG   ARG1210           HG2      ARG1210 -27.884  -8.445  -9.860
  832   2HG   ARG1210           HG1      ARG1210 -29.256  -7.874  -8.908
  833   1HD   ARG1210           HD2      ARG1210 -29.482  -5.940 -10.377
  834   2HD   ARG1210           HD1      ARG1210 -28.092  -6.480 -11.317
  835    HE   ARG1210           HE       ARG1210 -30.124  -8.473 -11.187
  836   1HH1  ARG1210          1HH1      ARG1210 -29.208  -5.514 -12.782
  837   2HH1  ARG1210          2HH1      ARG1210 -30.113  -5.857 -14.218
  838   1HH2  ARG1210          1HH2      ARG1210 -31.317  -8.933 -13.074
  839   2HH2  ARG1210          2HH2      ARG1210 -31.313  -7.801 -14.383
  840    H    SER1211           HN       SER1211 -26.628  -7.085  -4.993
  841    HA   SER1211           HA       SER1211 -24.791  -4.855  -5.193
  842   1HB   SER1211           HB2      SER1211 -25.911  -6.257  -2.754
  843   2HB   SER1211           HB1      SER1211 -25.018  -4.736  -2.751
  844    HG   SER1211           HG       SER1211 -27.435  -5.140  -4.174
  845    H    HIS1212           HN       HIS1212 -24.360  -8.037  -5.491
  846    HA   HIS1212           HA       HIS1212 -22.609  -9.463  -5.299
  847   1HB   HIS1212           HB2      HIS1212 -21.050  -6.917  -4.810
  848   2HB   HIS1212           HB1      HIS1212 -20.342  -8.487  -5.172
  849    HD1  HIS1212           HD1      HIS1212 -20.191  -9.161  -7.595
  850    HD2  HIS1212           HD2      HIS1212 -22.480  -5.742  -7.010
  851    HE1  HIS1212           HE1      HIS1212 -20.637  -8.249  -9.895
  852    HE2  HIS1212           HE2      HIS1212 -21.957  -6.138  -9.512
  853    H    THR1213           HN       THR1213 -20.986  -7.331  -3.058
  854    HA   THR1213           HA       THR1213 -21.946  -8.849  -0.758
  855    HB   THR1213           HB       THR1213 -19.781  -9.477   0.025
  856    HG1  THR1213           HG1      THR1213 -18.956  -7.572  -1.766
  857   1HG2  THR1213          1HG2      THR1213 -20.062 -10.099  -2.914
  858   2HG2  THR1213          3HG2      THR1213 -18.945 -10.923  -1.824
  859   3HG2  THR1213          2HG2      THR1213 -20.686 -11.047  -1.563
  860    H    LEU1214           HN       LEU1214 -21.489  -7.866   1.274
  861    HA   LEU1214           HA       LEU1214 -21.311  -4.978   1.121
  862   1HB   LEU1214           HB2      LEU1214 -21.761  -6.877   3.424
  863   2HB   LEU1214           HB1      LEU1214 -21.662  -5.139   3.618
  864    HG   LEU1214           HG       LEU1214 -23.971  -5.783   3.609
  865   1HD1  LEU1214          1HD1      LEU1214 -23.187  -4.504   0.996
  866   2HD1  LEU1214          3HD1      LEU1214 -24.809  -4.489   1.689
  867   3HD1  LEU1214          2HD1      LEU1214 -23.485  -3.681   2.527
  868   1HD2  LEU1214          3HD2      LEU1214 -23.752  -7.920   2.465
  869   2HD2  LEU1214          2HD2      LEU1214 -25.005  -6.927   1.721
  870   3HD2  LEU1214          1HD2      LEU1214 -23.429  -7.083   0.948
  871    H    ARG1215           HN       ARG1215 -19.654  -7.527   2.955
  872    HA   ARG1215           HA       ARG1215 -17.453  -5.737   3.562
  873   1HB   ARG1215           HB2      ARG1215 -18.294  -7.265   5.291
  874   2HB   ARG1215           HB1      ARG1215 -17.879  -8.642   4.280
  875   1HG   ARG1215           HG2      ARG1215 -15.519  -8.045   4.421
  876   2HG   ARG1215           HG1      ARG1215 -15.930  -6.652   5.425
  877   1HD   ARG1215           HD2      ARG1215 -16.433  -9.544   6.114
  878   2HD   ARG1215           HD1      ARG1215 -15.156  -8.529   6.782
  879    HE   ARG1215           HE       ARG1215 -17.626  -7.282   7.232
  880   1HH1  ARG1215          1HH1      ARG1215 -15.827 -10.088   8.251
  881   2HH1  ARG1215          2HH1      ARG1215 -16.569 -10.154   9.815
  882   1HH2  ARG1215          1HH2      ARG1215 -18.606  -7.362   9.288
  883   2HH2  ARG1215          2HH2      ARG1215 -18.148  -8.605  10.404
  884    H    THR1216           HN       THR1216 -15.961  -5.416   2.052
  885    HA   THR1216           HA       THR1216 -15.155  -7.689   0.362
  886    HB   THR1216           HB       THR1216 -16.064  -5.717  -0.854
  887    HG1  THR1216           HG1      THR1216 -13.399  -5.706  -1.609
  888   1HG2  THR1216          1HG2      THR1216 -13.627  -4.336   0.265
  889   2HG2  THR1216          3HG2      THR1216 -14.650  -3.696  -1.020
  890   3HG2  THR1216          2HG2      THR1216 -15.311  -3.932   0.597
  891    H    THR1217           HN       THR1217 -12.764  -6.713  -0.574
  892    HA   THR1217           HA       THR1217 -11.124  -6.527   1.866
  893    HB   THR1217           HB       THR1217 -10.680  -8.225  -0.581
  894    HG1  THR1217           HG1      THR1217 -10.968  -8.672   2.200
  895   1HG2  THR1217          2HG2      THR1217  -8.591  -7.029  -0.123
  896   2HG2  THR1217          1HG2      THR1217  -8.659  -7.547   1.562
  897   3HG2  THR1217          3HG2      THR1217  -8.444  -8.741   0.280
  898    H    CYS1218           HN       CYS1218  -9.895  -4.790   1.957
  899    HA   CYS1218           HA       CYS1218  -9.621  -2.923  -0.139
  900   1HB   CYS1218           HB2      CYS1218  -9.397  -2.419   2.306
  901   2HB   CYS1218           HB1      CYS1218  -7.848  -3.254   2.297
  902    H    TRP1219           HN       TRP1219  -8.637  -3.559  -2.015
  903    HA   TRP1219           HA       TRP1219  -5.839  -4.239  -1.908
  904   1HB   TRP1219           HB2      TRP1219  -7.283  -6.382  -1.511
  905   2HB   TRP1219           HB1      TRP1219  -7.567  -6.293  -3.244
  906    HD1  TRP1219           HD1      TRP1219  -5.135  -6.194  -4.745
  907    HE1  TRP1219           HE1      TRP1219  -3.056  -7.667  -4.376
  908    HE3  TRP1219           HE3      TRP1219  -5.982  -7.628   0.091
  909    HZ2  TRP1219           HZ2      TRP1219  -1.926  -9.220  -2.331
  910    HZ3  TRP1219           HZ3      TRP1219  -4.349  -9.112   1.180
  911    HH2  TRP1219           HH2      TRP1219  -2.363  -9.893  -0.006
  912    H    ASP1220           HN       ASP1220  -4.797  -3.638  -3.698
  913    HA   ASP1220           HA       ASP1220  -4.355  -2.854  -5.792
  914   1HB   ASP1220           HB2      ASP1220  -5.575  -4.996  -6.413
  915   2HB   ASP1220           HB1      ASP1220  -7.005  -3.992  -6.649
  916    H    GLY1221           HN       GLY1221  -6.942  -1.814  -3.993
  917   1HA   GLY1221           HA1      GLY1221  -7.112   0.633  -5.572
  918   2HA   GLY1221           HA2      GLY1221  -7.692   0.414  -3.930
  919    H    LYS1222           HN       LYS1222  -9.000  -2.180  -4.966
  920    HA   LYS1222           HA       LYS1222 -11.374  -0.836  -6.073
  921   1HB   LYS1222           HB2      LYS1222 -10.353  -2.098  -7.860
  922   2HB   LYS1222           HB1      LYS1222 -10.266  -3.532  -6.849
  923   1HG   LYS1222           HG2      LYS1222 -12.079  -3.753  -8.410
  924   2HG   LYS1222           HG1      LYS1222 -12.727  -3.600  -6.777
  925   1HD   LYS1222           HD2      LYS1222 -14.045  -2.247  -8.264
  926   2HD   LYS1222           HD1      LYS1222 -13.110  -1.187  -7.207
  927   1HE   LYS1222           HE2      LYS1222 -11.461  -0.867  -8.987
  928   2HE   LYS1222           HE1      LYS1222 -12.392  -1.930 -10.042
  929   1HZ   LYS1222           HZ1      LYS1222 -14.234  -0.364  -9.924
  930   2HZ   LYS1222           HZ3      LYS1222 -13.328   0.657  -8.924
  931   3HZ   LYS1222           HZ2      LYS1222 -12.842   0.387 -10.520
  932    H    LEU1223           HN       LEU1223 -13.320  -1.436  -5.303
  933    HA   LEU1223           HA       LEU1223 -13.498  -3.640  -3.388
  934   1HB   LEU1223           HB2      LEU1223 -14.578  -0.900  -2.751
  935   2HB   LEU1223           HB1      LEU1223 -14.568  -2.308  -1.709
  936    HG   LEU1223           HG       LEU1223 -12.068  -0.907  -2.636
  937   1HD1  LEU1223          2HD1      LEU1223 -13.455   0.588  -1.276
  938   2HD1  LEU1223          1HD1      LEU1223 -13.535  -0.644  -0.016
  939   3HD1  LEU1223          3HD1      LEU1223 -11.989   0.099  -0.426
  940   1HD2  LEU1223          1HD2      LEU1223 -11.768  -3.242  -1.999
  941   2HD2  LEU1223          3HD2      LEU1223 -11.017  -2.156  -0.829
  942   3HD2  LEU1223          2HD2      LEU1223 -12.560  -2.926  -0.456
  943    H    GLU1224           HN       GLU1224 -15.484  -4.617  -3.299
  944    HA   GLU1224           HA       GLU1224 -17.272  -4.176  -5.472
  945   1HB   GLU1224           HB2      GLU1224 -17.629  -5.871  -2.987
  946   2HB   GLU1224           HB1      GLU1224 -18.639  -5.946  -4.424
  947   1HG   GLU1224           HG2      GLU1224 -16.713  -6.671  -5.742
  948   2HG   GLU1224           HG1      GLU1224 -15.703  -6.599  -4.299
  949    H    TYR1225           HN       TYR1225 -18.708  -2.570  -5.573
  950    HA   TYR1225           HA       TYR1225 -19.577  -1.231  -3.143
  951   1HB   TYR1225           HB2      TYR1225 -20.749  -0.483  -5.770
  952   2HB   TYR1225           HB1      TYR1225 -20.174   0.541  -4.461
  953    HD1  TYR1225           HD1      TYR1225 -17.941   1.349  -4.410
  954    HD2  TYR1225           HD2      TYR1225 -19.158  -1.401  -7.416
  955    HE1  TYR1225           HE1      TYR1225 -15.882   1.825  -5.680
  956    HE2  TYR1225           HE2      TYR1225 -17.105  -0.940  -8.688
  957    HH   TYR1225           HH       TYR1225 -14.469   0.743  -7.371
  958    HA   PRO1226           HA       PRO1226 -23.218  -3.938  -3.121
  959   1HB   PRO1226           HB2      PRO1226 -23.803  -2.361  -0.692
  960   2HB   PRO1226           HB1      PRO1226 -23.677  -4.112  -0.889
  961   1HG   PRO1226           HG2      PRO1226 -21.779  -2.705   0.387
  962   2HG   PRO1226           HG1      PRO1226 -21.380  -4.110  -0.618
  963   1HD   PRO1226           HD2      PRO1226 -21.126  -1.196  -1.234
  964   2HD   PRO1226           HD1      PRO1226 -20.028  -2.532  -1.632
  965    H    THR1227           HN       THR1227 -25.624  -3.128  -2.289
  966    HA   THR1227           HA       THR1227 -26.385  -0.483  -2.878
  967    HB   THR1227           HB       THR1227 -27.697  -1.681  -5.056
  968    HG1  THR1227           HG1      THR1227 -25.281  -1.921  -6.079
  969   1HG2  THR1227          3HG2      THR1227 -25.392   0.267  -4.995
  970   2HG2  THR1227          2HG2      THR1227 -26.461  -0.008  -6.370
  971   3HG2  THR1227          1HG2      THR1227 -27.105   0.670  -4.876
  972    H    CYS1228           HN       CYS1228 -27.554  -1.003  -0.977
  973    HA   CYS1228           HA       CYS1228 -29.707  -2.964  -1.258
  974   1HB   CYS1228           HB2      CYS1228 -29.055  -1.439   1.251
  975   2HB   CYS1228           HB1      CYS1228 -29.830  -3.012   1.088
  976    H    ALA1229           HN       ALA1229 -31.870  -2.311  -0.327
  977    HA   ALA1229           HA       ALA1229 -32.461   0.523  -0.504
  978   1HB   ALA1229           HB1      ALA1229 -33.750  -1.411  -2.408
  979   2HB   ALA1229           HB3      ALA1229 -34.082   0.315  -2.267
  980   3HB   ALA1229           HB2      ALA1229 -32.503  -0.237  -2.832
  981    H    LYS1230           HN       LYS1230 -33.330   0.578   1.491
  982    HA   LYS1230           HA       LYS1230 -35.974   0.048   1.937
  983   1HB   LYS1230           HB2      LYS1230 -34.825  -2.357   1.850
  984   2HB   LYS1230           HB1      LYS1230 -34.558  -1.992   3.550
  985   1HG   LYS1230           HG2      LYS1230 -36.956  -1.609   3.842
  986   2HG   LYS1230           HG1      LYS1230 -37.212  -1.995   2.140
  987   1HD   LYS1230           HD2      LYS1230 -37.734  -3.932   3.481
  988   2HD   LYS1230           HD1      LYS1230 -36.268  -4.248   2.552
  989   1HE   LYS1230           HE2      LYS1230 -36.034  -5.046   4.841
  990   2HE   LYS1230           HE1      LYS1230 -34.906  -3.732   4.512
  991   1HZ   LYS1230           HZ1      LYS1230 -37.493  -3.468   5.948
  992   2HZ   LYS1230           HZ3      LYS1230 -35.961  -3.472   6.667
  993   3HZ   LYS1230           HZ2      LYS1230 -36.407  -2.208   5.635
  994    H    ARG1231           HN       ARG1231 -34.322   2.134   2.571
  995    HA   ARG1231           HA       ARG1231 -33.283   2.132   5.162
  996   1HB   ARG1231           HB2      ARG1231 -33.561   4.643   4.968
  997   2HB   ARG1231           HB1      ARG1231 -32.599   3.870   3.728
  998   1HG   ARG1231           HG2      ARG1231 -34.417   4.000   2.162
  999   2HG   ARG1231           HG1      ARG1231 -35.499   4.615   3.414
 1000   1HD   ARG1231           HD2      ARG1231 -33.030   5.997   2.373
 1001   2HD   ARG1231           HD1      ARG1231 -34.695   6.413   1.967
 1002    HE   ARG1231           HE       ARG1231 -34.476   6.513   4.734
 1003   1HH1  ARG1231          1HH1      ARG1231 -33.141   8.156   1.966
 1004   2HH1  ARG1231          2HH1      ARG1231 -32.912   9.654   2.804
 1005   1HH2  ARG1231          1HH2      ARG1231 -34.179   8.482   5.844
 1006   2HH2  ARG1231          2HH2      ARG1231 -33.502   9.840   5.008

  No H/Q in entry =        1006
  Start of MODEL    3
    1    H1   GLU1103           HT1      GLU1103  33.643  -8.019  -4.529
    2    H2   GLU1103           HT3      GLU1103  34.675  -7.312  -5.669
    3    H3   GLU1103           HT2      GLU1103  33.942  -8.800  -5.998
    4    HA   GLU1103           HA       GLU1103  35.174  -9.865  -4.256
    5   1HB   GLU1103           HB2      GLU1103  36.828  -8.242  -6.194
    6   2HB   GLU1103           HB1      GLU1103  37.500  -9.517  -5.190
    7   1HG   GLU1103           HG2      GLU1103  37.089 -10.421  -7.345
    8   2HG   GLU1103           HG1      GLU1103  35.899 -11.103  -6.238
    9    H    ALA1104           HN       ALA1104  34.810  -6.623  -3.839
   10    HA   ALA1104           HA       ALA1104  37.070  -6.213  -2.062
   11   1HB   ALA1104           HB2      ALA1104  36.199  -3.953  -1.796
   12   2HB   ALA1104           HB1      ALA1104  36.317  -4.382  -3.502
   13   3HB   ALA1104           HB3      ALA1104  34.748  -4.394  -2.695
   14    H    GLU1105           HN       GLU1105  36.549  -5.170   0.121
   15    HA   GLU1105           HA       GLU1105  34.617  -6.902   1.480
   16   1HB   GLU1105           HB2      GLU1105  36.847  -5.201   2.608
   17   2HB   GLU1105           HB1      GLU1105  35.812  -6.273   3.541
   18   1HG   GLU1105           HG2      GLU1105  37.716  -7.113   1.366
   19   2HG   GLU1105           HG1      GLU1105  37.984  -7.277   3.101
   20    H    PHE1106           HN       PHE1106  35.525  -3.503   1.134
   21    HA   PHE1106           HA       PHE1106  33.167  -2.693   2.666
   22   1HB   PHE1106           HB2      PHE1106  35.430  -1.030   1.537
   23   2HB   PHE1106           HB1      PHE1106  34.128  -0.428   2.558
   24    HD1  PHE1106           HD1      PHE1106  34.046  -0.973   4.926
   25    HD2  PHE1106           HD2      PHE1106  37.243  -2.312   2.454
   26    HE1  PHE1106           HE1      PHE1106  35.372  -1.499   6.931
   27    HE2  PHE1106           HE2      PHE1106  38.574  -2.840   4.455
   28    HZ   PHE1106           HZ       PHE1106  37.638  -2.434   6.697
   29    H    GLY1107           HN       GLY1107  31.609  -1.250   1.816
   30   1HA   GLY1107           HA1      GLY1107  30.679  -1.810  -0.731
   31   2HA   GLY1107           HA2      GLY1107  31.628  -0.340  -0.860
   32    H    LYS1108           HN       LYS1108  31.065   1.249   1.082
   33    HA   LYS1108           HA       LYS1108  28.531   1.304   2.204
   34   1HB   LYS1108           HB2      LYS1108  30.275   3.610   1.325
   35   2HB   LYS1108           HB1      LYS1108  28.838   3.783   2.324
   36   1HG   LYS1108           HG2      LYS1108  29.933   2.225   3.970
   37   2HG   LYS1108           HG1      LYS1108  31.408   2.387   3.013
   38   1HD   LYS1108           HD2      LYS1108  29.894   4.700   4.213
   39   2HD   LYS1108           HD1      LYS1108  31.293   3.930   4.963
   40   1HE   LYS1108           HE2      LYS1108  31.248   5.296   2.274
   41   2HE   LYS1108           HE1      LYS1108  31.937   5.955   3.758
   42   1HZ   LYS1108           HZ1      LYS1108  33.521   4.129   3.790
   43   2HZ   LYS1108           HZ3      LYS1108  32.862   3.502   2.362
   44   3HZ   LYS1108           HZ2      LYS1108  33.643   5.003   2.346
   45    H    CYS1109           HN       CYS1109  26.574   1.573   1.440
   46    HA   CYS1109           HA       CYS1109  26.248   2.099  -1.393
   47   1HB   CYS1109           HB2      CYS1109  23.726   1.708  -0.516
   48   2HB   CYS1109           HB1      CYS1109  24.815   0.405  -0.980
   49    H    GLY1110           HN       GLY1110  23.972   3.268  -1.765
   50   1HA   GLY1110           HA1      GLY1110  23.907   5.740  -2.093
   51   2HA   GLY1110           HA2      GLY1110  24.145   5.858  -0.354
   52    HA   PRO1111           HA       PRO1111  19.718   6.358  -0.223
   53   1HB   PRO1111           HB2      PRO1111  18.740   7.362  -2.626
   54   2HB   PRO1111           HB1      PRO1111  19.335   8.330  -1.275
   55   1HG   PRO1111           HG2      PRO1111  20.711   7.542  -3.798
   56   2HG   PRO1111           HG1      PRO1111  20.831   9.050  -2.873
   57   1HD   PRO1111           HD2      PRO1111  22.757   7.166  -2.800
   58   2HD   PRO1111           HD1      PRO1111  22.359   8.164  -1.387
   59    HA   PRO1112           HA       PRO1112  18.860   2.283  -1.971
   60   1HB   PRO1112           HB2      PRO1112  16.541   1.952  -0.501
   61   2HB   PRO1112           HB1      PRO1112  18.163   1.532   0.055
   62   1HG   PRO1112           HG2      PRO1112  16.543   3.982   0.611
   63   2HG   PRO1112           HG1      PRO1112  17.579   3.049   1.708
   64   1HD   PRO1112           HD2      PRO1112  18.404   5.365   0.647
   65   2HD   PRO1112           HD1      PRO1112  19.525   4.007   0.885
   66    HA   PRO1113           HA       PRO1113  16.145   4.091  -5.189
   67   1HB   PRO1113           HB2      PRO1113  16.524   1.277  -6.115
   68   2HB   PRO1113           HB1      PRO1113  16.609   2.783  -7.036
   69   1HG   PRO1113           HG2      PRO1113  18.833   1.503  -6.335
   70   2HG   PRO1113           HG1      PRO1113  18.752   3.274  -6.284
   71   1HD   PRO1113           HD2      PRO1113  18.676   1.308  -4.047
   72   2HD   PRO1113           HD1      PRO1113  19.375   2.937  -4.094
   73    HA   PRO1114           HA       PRO1114  12.660   1.995  -3.179
   74   1HB   PRO1114           HB2      PRO1114  11.011   4.060  -3.075
   75   2HB   PRO1114           HB1      PRO1114  12.460   4.035  -2.060
   76   1HG   PRO1114           HG2      PRO1114  12.008   5.425  -4.678
   77   2HG   PRO1114           HG1      PRO1114  12.729   6.070  -3.192
   78   1HD   PRO1114           HD2      PRO1114  14.182   5.110  -5.322
   79   2HD   PRO1114           HD1      PRO1114  14.777   5.144  -3.650
   80    H    ILE1115           HN       ILE1115  10.179   2.274  -3.708
   81    HA   ILE1115           HA       ILE1115   9.863   1.774  -6.592
   82    HB   ILE1115           HB       ILE1115   7.665   0.696  -5.771
   83   1HG1  ILE1115          2HG1      ILE1115   9.243   0.719  -3.186
   84   2HG1  ILE1115          1HG1      ILE1115   7.775   1.641  -3.491
   85   1HG2  ILE1115          1HG2      ILE1115  10.338  -0.537  -5.137
   86   2HG2  ILE1115          3HG2      ILE1115   8.821  -1.426  -5.276
   87   3HG2  ILE1115          2HG2      ILE1115   9.488  -0.594  -6.682
   88   1HD1  ILE1115          2HD1      ILE1115   7.969  -1.359  -3.473
   89   2HD1  ILE1115          1HD1      ILE1115   7.355  -0.356  -2.157
   90   3HD1  ILE1115          3HD1      ILE1115   6.502  -0.405  -3.702
   91    H    ASP1116           HN       ASP1116   7.440   2.169  -7.242
   92    HA   ASP1116           HA       ASP1116   6.960   4.951  -7.003
   93   1HB   ASP1116           HB2      ASP1116   6.278   3.651  -8.987
   94   2HB   ASP1116           HB1      ASP1116   5.117   2.763  -8.005
   95    H    ASN1117           HN       ASN1117   6.300   5.866  -5.174
   96    HA   ASN1117           HA       ASN1117   4.932   6.408  -3.425
   97   1HB   ASN1117           HB2      ASN1117   3.356   3.941  -4.208
   98   2HB   ASN1117           HB1      ASN1117   2.849   5.150  -3.027
   99   1HD2  ASN1117          1HD2      ASN1117   1.682   4.252  -5.601
  100   2HD2  ASN1117          2HD2      ASN1117   1.467   5.696  -6.524
  101    H    GLY1118           HN       GLY1118   7.228   4.416  -3.431
  102   1HA   GLY1118           HA1      GLY1118   7.789   2.490  -2.039
  103   2HA   GLY1118           HA2      GLY1118   6.590   3.053  -0.886
  104    H    ASP1119           HN       ASP1119   8.802   2.537   0.314
  105    HA   ASP1119           HA       ASP1119  10.914   4.368   0.273
  106   1HB   ASP1119           HB2      ASP1119   9.076   5.972   0.902
  107   2HB   ASP1119           HB1      ASP1119   8.875   5.061   2.396
  108    H    ILE1120           HN       ILE1120  12.137   4.376   2.426
  109    HA   ILE1120           HA       ILE1120  12.641   1.734   3.189
  110    HB   ILE1120           HB       ILE1120  13.392   3.787   5.153
  111   1HG1  ILE1120          2HG1      ILE1120  14.201   3.986   2.248
  112   2HG1  ILE1120          1HG1      ILE1120  13.469   5.235   3.244
  113   1HG2  ILE1120          1HG2      ILE1120  14.899   1.776   3.500
  114   2HG2  ILE1120          3HG2      ILE1120  15.589   2.735   4.810
  115   3HG2  ILE1120          2HG2      ILE1120  14.326   1.553   5.154
  116   1HD1  ILE1120          1HD1      ILE1120  15.513   5.336   4.594
  117   2HD1  ILE1120          3HD1      ILE1120  16.247   4.128   3.540
  118   3HD1  ILE1120          2HD1      ILE1120  15.803   5.709   2.895
  119    H    THR1121           HN       THR1121  10.144   3.730   4.062
  120    HA   THR1121           HA       THR1121   8.376   3.505   5.464
  121    HB   THR1121           HB       THR1121   7.815   1.451   6.428
  122    HG1  THR1121           HG1      THR1121   9.565   0.999   7.715
  123   1HG2  THR1121          1HG2      THR1121   9.652   0.799   4.118
  124   2HG2  THR1121          3HG2      THR1121   8.388  -0.255   4.752
  125   3HG2  THR1121          2HG2      THR1121   7.959   1.279   3.997
  126    H    SER1122           HN       SER1122  11.110   4.570   6.252
  127    HA   SER1122           HA       SER1122  10.415   4.999   9.052
  128   1HB   SER1122           HB2      SER1122  12.000   3.090   9.063
  129   2HB   SER1122           HB1      SER1122  13.181   4.089   8.219
  130    HG   SER1122           HG       SER1122  13.614   5.107  10.019
  131    H    PHE1123           HN       PHE1123  13.445   5.623   7.377
  132    HA   PHE1123           HA       PHE1123  12.775   8.409   6.911
  133   1HB   PHE1123           HB2      PHE1123  13.567   8.359   9.261
  134   2HB   PHE1123           HB1      PHE1123  15.075   7.632   8.720
  135    HD1  PHE1123           HD1      PHE1123  16.817   8.942   7.808
  136    HD2  PHE1123           HD2      PHE1123  13.017  10.687   8.598
  137    HE1  PHE1123           HE1      PHE1123  17.776  11.181   7.454
  138    HE2  PHE1123           HE2      PHE1123  13.968  12.928   8.245
  139    HZ   PHE1123           HZ       PHE1123  16.351  13.177   7.673
  140    HA   PRO1124           HA       PRO1124  15.380   7.356   3.456
  141   1HB   PRO1124           HB2      PRO1124  15.361  10.192   2.764
  142   2HB   PRO1124           HB1      PRO1124  14.628   8.831   1.911
  143   1HG   PRO1124           HG2      PRO1124  13.163  10.716   3.190
  144   2HG   PRO1124           HG1      PRO1124  12.634   9.031   3.031
  145   1HD   PRO1124           HD2      PRO1124  13.874  10.414   5.380
  146   2HD   PRO1124           HD1      PRO1124  12.545   9.237   5.336
  147    H    LEU1125           HN       LEU1125  17.533   7.134   3.345
  148    HA   LEU1125           HA       LEU1125  19.209   9.259   4.505
  149   1HB   LEU1125           HB2      LEU1125  19.973   6.340   4.430
  150   2HB   LEU1125           HB1      LEU1125  20.800   7.648   5.254
  151    HG   LEU1125           HG       LEU1125  18.572   7.853   6.607
  152   1HD1  LEU1125          2HD1      LEU1125  17.312   6.280   5.209
  153   2HD1  LEU1125          1HD1      LEU1125  18.443   4.999   5.652
  154   3HD1  LEU1125          3HD1      LEU1125  17.419   5.733   6.884
  155   1HD2  LEU1125          1HD2      LEU1125  20.501   5.569   7.007
  156   2HD2  LEU1125          3HD2      LEU1125  20.731   7.229   7.554
  157   3HD2  LEU1125          2HD2      LEU1125  19.436   6.248   8.238
  158    H    SER1126           HN       SER1126  21.118   9.783   3.434
  159    HA   SER1126           HA       SER1126  21.124   9.104   0.608
  160   1HB   SER1126           HB2      SER1126  22.891  11.035   2.127
  161   2HB   SER1126           HB1      SER1126  22.772  10.888   0.374
  162    HG   SER1126           HG       SER1126  21.135  12.181   0.464
  163    H    VAL1127           HN       VAL1127  23.295   8.920   3.404
  164    HA   VAL1127           HA       VAL1127  25.046   7.127   1.870
  165    HB   VAL1127           HB       VAL1127  25.584   8.439   4.541
  166   1HG1  VAL1127          2HG1      VAL1127  26.776   6.329   4.238
  167   2HG1  VAL1127          1HG1      VAL1127  27.397   6.891   2.687
  168   3HG1  VAL1127          3HG1      VAL1127  27.891   7.694   4.178
  169   1HG2  VAL1127          3HG2      VAL1127  25.461  10.091   2.752
  170   2HG2  VAL1127          2HG2      VAL1127  27.125   9.889   3.302
  171   3HG2  VAL1127          1HG2      VAL1127  26.600   9.149   1.790
  172    H    TYR1128           HN       TYR1128  24.777   5.032   2.148
  173    HA   TYR1128           HA       TYR1128  23.621   4.085   4.685
  174   1HB   TYR1128           HB2      TYR1128  22.855   3.600   1.953
  175   2HB   TYR1128           HB1      TYR1128  23.299   2.085   2.731
  176    HD1  TYR1128           HD1      TYR1128  22.202   1.607   5.034
  177    HD2  TYR1128           HD2      TYR1128  20.728   4.468   2.253
  178    HE1  TYR1128           HE1      TYR1128  19.993   1.503   6.109
  179    HE2  TYR1128           HE2      TYR1128  18.516   4.376   3.319
  180    HH   TYR1128           HH       TYR1128  17.203   2.814   4.702
  181    H    ALA1129           HN       ALA1129  24.317   2.058   5.480
  182    HA   ALA1129           HA       ALA1129  27.139   1.580   5.018
  183   1HB   ALA1129           HB1      ALA1129  26.270   1.629   7.307
  184   2HB   ALA1129           HB2      ALA1129  26.987   0.064   6.926
  185   3HB   ALA1129           HB3      ALA1129  25.234   0.249   6.944
  186    HA   PRO1130           HA       PRO1130  26.675  -1.717   2.116
  187   1HB   PRO1130           HB2      PRO1130  28.796  -3.300   2.927
  188   2HB   PRO1130           HB1      PRO1130  28.920  -1.919   1.833
  189   1HG   PRO1130           HG2      PRO1130  29.486  -2.083   4.762
  190   2HG   PRO1130           HG1      PRO1130  30.348  -1.182   3.500
  191   1HD   PRO1130           HD2      PRO1130  28.665   0.032   5.209
  192   2HD   PRO1130           HD1      PRO1130  28.819   0.554   3.519
  193    H    ALA1131           HN       ALA1131  25.787  -3.735   1.964
  194    HA   ALA1131           HA       ALA1131  24.752  -5.662   2.570
  195   1HB   ALA1131           HB3      ALA1131  26.886  -6.243   3.620
  196   2HB   ALA1131           HB1      ALA1131  25.514  -6.887   4.520
  197   3HB   ALA1131           HB2      ALA1131  26.361  -5.458   5.110
  198    H    SER1132           HN       SER1132  24.104  -2.773   3.854
  199    HA   SER1132           HA       SER1132  22.444  -3.448   6.076
  200   1HB   SER1132           HB2      SER1132  21.568  -1.157   5.870
  201   2HB   SER1132           HB1      SER1132  23.332  -1.176   5.814
  202    HG   SER1132           HG       SER1132  22.794   0.078   4.133
  203    H    SER1133           HN       SER1133  20.191  -3.597   6.191
  204    HA   SER1133           HA       SER1133  18.746  -3.730   3.646
  205   1HB   SER1133           HB2      SER1133  18.076  -5.861   5.592
  206   2HB   SER1133           HB1      SER1133  18.126  -5.906   3.831
  207    HG   SER1133           HG       SER1133  19.805  -7.114   5.067
  208    H    VAL1134           HN       VAL1134  16.469  -3.544   3.820
  209    HA   VAL1134           HA       VAL1134  15.384  -2.804   6.433
  210    HB   VAL1134           HB       VAL1134  14.207  -0.837   5.356
  211   1HG1  VAL1134          2HG1      VAL1134  16.068  -0.605   6.949
  212   2HG1  VAL1134          1HG1      VAL1134  17.200  -0.602   5.596
  213   3HG1  VAL1134          3HG1      VAL1134  16.015   0.697   5.760
  214   1HG2  VAL1134          1HG2      VAL1134  16.333  -1.275   3.271
  215   2HG2  VAL1134          3HG2      VAL1134  14.586  -1.360   3.046
  216   3HG2  VAL1134          2HG2      VAL1134  15.353   0.184   3.421
  217    H    GLU1135           HN       GLU1135  12.985  -2.380   6.237
  218    HA   GLU1135           HA       GLU1135  11.813  -4.387   4.454
  219   1HB   GLU1135           HB2      GLU1135  10.778  -3.208   7.039
  220   2HB   GLU1135           HB1      GLU1135   9.952  -4.417   6.075
  221   1HG   GLU1135           HG2      GLU1135  11.745  -6.000   6.468
  222   2HG   GLU1135           HG1      GLU1135  12.634  -4.782   7.380
  223    H    TYR1136           HN       TYR1136  11.958  -2.681   2.772
  224    HA   TYR1136           HA       TYR1136  10.696  -0.238   2.805
  225   1HB   TYR1136           HB2      TYR1136  11.576  -2.120   0.752
  226   2HB   TYR1136           HB1      TYR1136  10.213  -1.131   0.240
  227    HD1  TYR1136           HD1      TYR1136  10.656   0.916  -0.715
  228    HD2  TYR1136           HD2      TYR1136  13.520  -0.760   1.941
  229    HE1  TYR1136           HE1      TYR1136  12.173   2.787  -1.180
  230    HE2  TYR1136           HE2      TYR1136  15.048   1.110   1.485
  231    HH   TYR1136           HH       TYR1136  14.060   3.938  -0.108
  232    H    GLN1137           HN       GLN1137   8.717   0.382   1.565
  233    HA   GLN1137           HA       GLN1137   6.551  -1.277   1.077
  234   1HB   GLN1137           HB2      GLN1137   6.641  -1.818   3.478
  235   2HB   GLN1137           HB1      GLN1137   6.495  -0.112   3.873
  236   1HG   GLN1137           HG2      GLN1137   4.277  -0.132   2.707
  237   2HG   GLN1137           HG1      GLN1137   4.428  -1.885   2.608
  238   1HE2  GLN1137          1HE2      GLN1137   2.604  -2.191   3.892
  239   2HE2  GLN1137          2HE2      GLN1137   2.625  -1.912   5.596
  240    H    CYS1138           HN       CYS1138   4.486  -0.059   0.896
  241    HA   CYS1138           HA       CYS1138   5.047   2.695   0.103
  242   1HB   CYS1138           HB2      CYS1138   2.631   0.950  -0.426
  243   2HB   CYS1138           HB1      CYS1138   2.890   2.562  -1.084
  244    H    GLN1139           HN       GLN1139   4.076   4.455   1.012
  245    HA   GLN1139           HA       GLN1139   2.490   3.941   3.432
  246   1HB   GLN1139           HB2      GLN1139   3.181   6.230   4.118
  247   2HB   GLN1139           HB1      GLN1139   4.532   5.126   3.901
  248   1HG   GLN1139           HG2      GLN1139   5.341   6.982   2.859
  249   2HG   GLN1139           HG1      GLN1139   4.588   6.158   1.495
  250   1HE2  GLN1139          1HE2      GLN1139   4.269   8.026   0.329
  251   2HE2  GLN1139          2HE2      GLN1139   3.102   9.220   0.775
  252    H    ASN1140           HN       ASN1140   1.334   6.355   3.863
  253    HA   ASN1140           HA       ASN1140  -0.618   7.438   3.445
  254   1HB   ASN1140           HB2      ASN1140   1.139   8.444   1.834
  255   2HB   ASN1140           HB1      ASN1140   0.241   7.604   0.574
  256   1HD2  ASN1140          1HD2      ASN1140  -2.315   7.958   1.975
  257   2HD2  ASN1140          2HD2      ASN1140  -2.753   9.611   1.735
  258    H    LEU1141           HN       LEU1141  -1.338   4.987   3.665
  259    HA   LEU1141           HA       LEU1141  -3.075   3.585   3.221
  260   1HB   LEU1141           HB2      LEU1141  -3.589   5.377   0.848
  261   2HB   LEU1141           HB1      LEU1141  -4.653   4.098   1.400
  262    HG   LEU1141           HG       LEU1141  -3.914   6.509   3.061
  263   1HD1  LEU1141          2HD1      LEU1141  -5.164   7.185   1.076
  264   2HD1  LEU1141          1HD1      LEU1141  -6.405   5.987   1.444
  265   3HD1  LEU1141          3HD1      LEU1141  -6.144   7.348   2.534
  266   1HD2  LEU1141          1HD2      LEU1141  -4.569   4.542   4.353
  267   2HD2  LEU1141          3HD2      LEU1141  -5.790   5.811   4.450
  268   3HD2  LEU1141          2HD2      LEU1141  -6.052   4.413   3.409
  269    H    TYR1142           HN       TYR1142  -0.812   4.377   0.679
  270    HA   TYR1142           HA       TYR1142  -1.354   2.228  -1.052
  271   1HB   TYR1142           HB2      TYR1142   1.189   3.779  -0.549
  272   2HB   TYR1142           HB1      TYR1142   1.035   2.565  -1.814
  273    HD1  TYR1142           HD1      TYR1142  -0.090   5.887  -0.689
  274    HD2  TYR1142           HD2      TYR1142  -0.153   3.029  -3.839
  275    HE1  TYR1142           HE1      TYR1142  -0.990   7.594  -2.212
  276    HE2  TYR1142           HE2      TYR1142  -1.054   4.730  -5.370
  277    HH   TYR1142           HH       TYR1142  -2.303   6.843  -5.249
  278    H    GLN1143           HN       GLN1143  -0.159   0.275  -1.381
  279    HA   GLN1143           HA       GLN1143   1.472  -0.719   0.814
  280   1HB   GLN1143           HB2      GLN1143  -1.238  -1.224   0.867
  281   2HB   GLN1143           HB1      GLN1143  -0.604  -2.652   0.061
  282   1HG   GLN1143           HG2      GLN1143   0.296  -1.606   2.736
  283   2HG   GLN1143           HG1      GLN1143  -0.799  -2.963   2.474
  284   1HE2  GLN1143          1HE2      GLN1143   0.011  -4.902   1.694
  285   2HE2  GLN1143          2HE2      GLN1143   1.699  -5.266   1.703
  286    H    LEU1144           HN       LEU1144   3.206  -1.559  -0.186
  287    HA   LEU1144           HA       LEU1144   3.202  -2.184  -2.938
  288   1HB   LEU1144           HB2      LEU1144   5.473  -2.695  -2.742
  289   2HB   LEU1144           HB1      LEU1144   5.185  -1.429  -1.575
  290    HG   LEU1144           HG       LEU1144   6.494  -2.739  -0.304
  291   1HD1  LEU1144          3HD1      LEU1144   4.340  -2.735   0.845
  292   2HD1  LEU1144          2HD1      LEU1144   3.929  -4.255   0.053
  293   3HD1  LEU1144          1HD1      LEU1144   5.272  -4.191   1.192
  294   1HD2  LEU1144          2HD2      LEU1144   6.904  -4.327  -2.150
  295   2HD2  LEU1144          1HD2      LEU1144   6.913  -5.058  -0.544
  296   3HD2  LEU1144          3HD2      LEU1144   5.511  -5.255  -1.594
  297    H    GLU1145           HN       GLU1145   4.783  -4.533  -2.988
  298    HA   GLU1145           HA       GLU1145   3.342  -6.720  -1.869
  299   1HB   GLU1145           HB2      GLU1145   1.667  -6.194  -3.500
  300   2HB   GLU1145           HB1      GLU1145   2.872  -6.018  -4.767
  301   1HG   GLU1145           HG2      GLU1145   1.678  -8.090  -5.035
  302   2HG   GLU1145           HG1      GLU1145   3.362  -8.410  -4.626
  303    H    GLY1146           HN       GLY1146   4.728  -8.355  -1.701
  304   1HA   GLY1146           HA1      GLY1146   6.923  -8.544  -3.669
  305   2HA   GLY1146           HA2      GLY1146   6.235  -9.921  -2.819
  306    H    ASN1147           HN       ASN1147   8.969  -9.469  -2.831
  307    HA   ASN1147           HA       ASN1147   9.520  -9.433  -0.045
  308   1HB   ASN1147           HB2      ASN1147  11.922  -9.550  -0.779
  309   2HB   ASN1147           HB1      ASN1147  10.891 -10.814  -1.444
  310   1HD2  ASN1147          1HD2      ASN1147  12.848  -8.071  -2.122
  311   2HD2  ASN1147          2HD2      ASN1147  12.767  -8.167  -3.845
  312    H    LYS1148           HN       LYS1148   8.687  -7.387   0.575
  313    HA   LYS1148           HA       LYS1148   9.618  -4.928  -0.433
  314   1HB   LYS1148           HB2      LYS1148   8.783  -4.088   1.857
  315   2HB   LYS1148           HB1      LYS1148   7.623  -4.782   0.734
  316   1HG   LYS1148           HG2      LYS1148   7.096  -5.659   2.851
  317   2HG   LYS1148           HG1      LYS1148   7.909  -6.958   1.977
  318   1HD   LYS1148           HD2      LYS1148  10.003  -6.419   3.135
  319   2HD   LYS1148           HD1      LYS1148   9.177  -5.136   4.023
  320   1HE   LYS1148           HE2      LYS1148   7.681  -6.791   5.022
  321   2HE   LYS1148           HE1      LYS1148   8.496  -8.074   4.128
  322   1HZ   LYS1148           HZ3      LYS1148  10.542  -7.529   5.311
  323   2HZ   LYS1148           HZ2      LYS1148   9.733  -6.333   6.191
  324   3HZ   LYS1148           HZ1      LYS1148   9.307  -7.958   6.385
  325    H    ARG1149           HN       ARG1149  11.167  -7.235   1.509
  326    HA   ARG1149           HA       ARG1149  12.940  -5.282   2.756
  327   1HB   ARG1149           HB2      ARG1149  12.137  -7.213   4.083
  328   2HB   ARG1149           HB1      ARG1149  12.945  -8.299   2.960
  329   1HG   ARG1149           HG2      ARG1149  15.103  -7.326   3.567
  330   2HG   ARG1149           HG1      ARG1149  14.290  -6.248   4.705
  331   1HD   ARG1149           HD2      ARG1149  13.474  -8.185   5.957
  332   2HD   ARG1149           HD1      ARG1149  14.283  -9.262   4.819
  333    HE   ARG1149           HE       ARG1149  16.178  -7.488   5.869
  334   1HH1  ARG1149          1HH1      ARG1149  14.164 -10.141   6.893
  335   2HH1  ARG1149          2HH1      ARG1149  15.250 -10.653   8.140
  336   1HH2  ARG1149          1HH2      ARG1149  17.616  -8.158   7.508
  337   2HH2  ARG1149          2HH2      ARG1149  17.213  -9.526   8.490
  338    H    ILE1150           HN       ILE1150  14.700  -4.596   1.718
  339    HA   ILE1150           HA       ILE1150  16.028  -6.483  -0.110
  340    HB   ILE1150           HB       ILE1150  16.321  -4.951  -1.800
  341   1HG1  ILE1150          2HG1      ILE1150  17.259  -3.141  -0.410
  342   2HG1  ILE1150          1HG1      ILE1150  16.123  -2.533  -1.607
  343   1HG2  ILE1150          3HG2      ILE1150  13.980  -5.561  -1.640
  344   2HG2  ILE1150          2HG2      ILE1150  13.675  -4.183  -0.583
  345   3HG2  ILE1150          1HG2      ILE1150  14.150  -3.919  -2.260
  346   1HD1  ILE1150          2HD1      ILE1150  14.403  -2.378   0.132
  347   2HD1  ILE1150          1HD1      ILE1150  15.583  -2.927   1.323
  348   3HD1  ILE1150          3HD1      ILE1150  15.824  -1.393   0.485
  349    H    THR1151           HN       THR1151  18.252  -5.294  -0.795
  350    HA   THR1151           HA       THR1151  19.597  -4.161   1.518
  351    HB   THR1151           HB       THR1151  20.491  -6.784   0.294
  352    HG1  THR1151           HG1      THR1151  18.822  -7.165   1.733
  353   1HG2  THR1151          3HG2      THR1151  22.369  -5.334   0.948
  354   2HG2  THR1151          2HG2      THR1151  21.689  -5.202   2.570
  355   3HG2  THR1151          1HG2      THR1151  22.252  -6.763   1.976
  356    H    CYS1152           HN       CYS1152  21.705  -3.288   0.978
  357    HA   CYS1152           HA       CYS1152  21.870  -2.571  -1.837
  358   1HB   CYS1152           HB2      CYS1152  23.380  -0.836  -1.187
  359   2HB   CYS1152           HB1      CYS1152  22.032  -0.826  -0.062
  360    H    ARG1153           HN       ARG1153  23.209  -3.464  -3.206
  361    HA   ARG1153           HA       ARG1153  25.369  -5.159  -2.158
  362   1HB   ARG1153           HB2      ARG1153  24.219  -5.175  -4.949
  363   2HB   ARG1153           HB1      ARG1153  25.276  -6.377  -4.222
  364   1HG   ARG1153           HG2      ARG1153  23.188  -7.377  -4.161
  365   2HG   ARG1153           HG1      ARG1153  23.380  -6.730  -2.531
  366   1HD   ARG1153           HD2      ARG1153  22.050  -4.761  -3.170
  367   2HD   ARG1153           HD1      ARG1153  21.836  -5.445  -4.782
  368    HE   ARG1153           HE       ARG1153  20.537  -6.305  -2.331
  369   1HH1  ARG1153          1HH1      ARG1153  21.232  -6.965  -5.682
  370   2HH1  ARG1153          2HH1      ARG1153  19.912  -8.070  -5.871
  371   1HH2  ARG1153          1HH2      ARG1153  18.798  -7.759  -2.572
  372   2HH2  ARG1153          2HH2      ARG1153  18.529  -8.522  -4.103
  373    H    ASN1154           HN       ASN1154  27.367  -4.420  -2.295
  374    HA   ASN1154           HA       ASN1154  29.123  -3.054  -2.784
  375   1HB   ASN1154           HB2      ASN1154  29.753  -3.048  -5.193
  376   2HB   ASN1154           HB1      ASN1154  29.391  -4.649  -4.566
  377   1HD2  ASN1154          1HD2      ASN1154  27.649  -5.749  -5.328
  378   2HD2  ASN1154          2HD2      ASN1154  26.726  -5.240  -6.697
  379    H    GLY1155           HN       GLY1155  27.017  -1.504  -2.087
  380   1HA   GLY1155           HA1      GLY1155  27.673   0.955  -3.402
  381   2HA   GLY1155           HA2      GLY1155  26.532   0.749  -2.085
  382    H    GLN1156           HN       GLN1156  25.129  -1.369  -3.765
  383    HA   GLN1156           HA       GLN1156  23.441   0.535  -5.199
  384   1HB   GLN1156           HB2      GLN1156  25.017  -0.293  -6.886
  385   2HB   GLN1156           HB1      GLN1156  24.574  -1.949  -6.495
  386   1HG   GLN1156           HG2      GLN1156  23.479  -1.228  -8.526
  387   2HG   GLN1156           HG1      GLN1156  22.293  -1.520  -7.253
  388   1HE2  GLN1156          1HE2      GLN1156  21.196   0.215  -6.343
  389   2HE2  GLN1156          2HE2      GLN1156  21.156   1.772  -7.090
  390    H    TRP1157           HN       TRP1157  21.682   0.240  -3.927
  391    HA   TRP1157           HA       TRP1157  20.816  -2.201  -2.829
  392   1HB   TRP1157           HB2      TRP1157  19.287   0.317  -3.469
  393   2HB   TRP1157           HB1      TRP1157  18.599  -1.040  -2.599
  394    HD1  TRP1157           HD1      TRP1157  21.276   1.678  -2.192
  395    HE1  TRP1157           HE1      TRP1157  21.610   2.074   0.325
  396    HE3  TRP1157           HE3      TRP1157  18.360  -2.097  -0.413
  397    HZ2  TRP1157           HZ2      TRP1157  20.761   0.891   2.766
  398    HZ3  TRP1157           HZ3      TRP1157  18.171  -2.416   2.015
  399    HH2  TRP1157           HH2      TRP1157  19.346  -0.960   3.568
  400    H    SER1158           HN       SER1158  18.189  -2.406  -3.351
  401    HA   SER1158           HA       SER1158  17.823  -2.871  -6.209
  402   1HB   SER1158           HB2      SER1158  17.480  -4.969  -4.058
  403   2HB   SER1158           HB1      SER1158  16.810  -5.108  -5.683
  404    HG   SER1158           HG       SER1158  18.738  -6.091  -5.841
  405    H    GLU1159           HN       GLU1159  16.064  -1.800  -6.715
  406    HA   GLU1159           HA       GLU1159  14.220  -0.667  -5.008
  407   1HB   GLU1159           HB2      GLU1159  14.446   0.060  -7.301
  408   2HB   GLU1159           HB1      GLU1159  13.903  -1.503  -7.893
  409   1HG   GLU1159           HG2      GLU1159  11.699  -1.097  -6.895
  410   2HG   GLU1159           HG1      GLU1159  12.251   0.489  -6.359
  411    HA   PRO1160           HA       PRO1160  11.729  -3.973  -3.399
  412   1HB   PRO1160           HB2      PRO1160   9.504  -2.023  -3.716
  413   2HB   PRO1160           HB1      PRO1160   9.991  -2.956  -2.298
  414   1HG   PRO1160           HG2      PRO1160  10.522  -0.333  -2.528
  415   2HG   PRO1160           HG1      PRO1160  11.615  -1.449  -1.697
  416   1HD   PRO1160           HD2      PRO1160  11.903  -0.129  -4.339
  417   2HD   PRO1160           HD1      PRO1160  13.150  -0.699  -3.212
  418    HA   PRO1161           HA       PRO1161   9.708  -6.013  -6.730
  419   1HB   PRO1161           HB2      PRO1161   7.304  -6.352  -5.018
  420   2HB   PRO1161           HB1      PRO1161   8.258  -7.567  -5.873
  421   1HG   PRO1161           HG2      PRO1161   8.466  -7.290  -3.234
  422   2HG   PRO1161           HG1      PRO1161   9.895  -7.626  -4.228
  423   1HD   PRO1161           HD2      PRO1161   9.007  -5.054  -2.989
  424   2HD   PRO1161           HD1      PRO1161  10.646  -5.711  -3.176
  425    H    LYS1162           HN       LYS1162   6.682  -4.882  -5.261
  426    HA   LYS1162           HA       LYS1162   6.391  -2.801  -7.283
  427   1HB   LYS1162           HB2      LYS1162   4.598  -5.230  -7.206
  428   2HB   LYS1162           HB1      LYS1162   4.198  -3.747  -8.060
  429   1HG   LYS1162           HG2      LYS1162   6.166  -4.027  -9.477
  430   2HG   LYS1162           HG1      LYS1162   6.572  -5.513  -8.618
  431   1HD   LYS1162           HD2      LYS1162   4.010  -5.052 -10.140
  432   2HD   LYS1162           HD1      LYS1162   5.414  -5.913 -10.771
  433   1HE   LYS1162           HE2      LYS1162   5.217  -7.554  -8.965
  434   2HE   LYS1162           HE1      LYS1162   3.810  -6.693  -8.338
  435   1HZ   LYS1162           HZ3      LYS1162   3.997  -7.980 -11.009
  436   2HZ   LYS1162           HZ2      LYS1162   3.161  -8.596  -9.673
  437   3HZ   LYS1162           HZ1      LYS1162   2.647  -7.158 -10.402
  438    H    CYS1163           HN       CYS1163   4.342  -1.566  -7.011
  439    HA   CYS1163           HA       CYS1163   3.462  -1.618  -4.203
  440   1HB   CYS1163           HB2      CYS1163   4.802   0.397  -4.989
  441   2HB   CYS1163           HB1      CYS1163   3.428   0.792  -6.016
  442    H    LEU1164           HN       LEU1164   1.318  -1.636  -3.764
  443    HA   LEU1164           HA       LEU1164  -0.516  -1.665  -6.070
  444   1HB   LEU1164           HB2      LEU1164  -0.426  -3.291  -3.565
  445   2HB   LEU1164           HB1      LEU1164  -1.975  -2.982  -4.326
  446    HG   LEU1164           HG       LEU1164  -1.031  -5.152  -4.989
  447   1HD1  LEU1164          3HD1      LEU1164  -1.142  -3.135  -7.227
  448   2HD1  LEU1164          2HD1      LEU1164  -1.280  -4.884  -7.408
  449   3HD1  LEU1164          1HD1      LEU1164  -2.515  -3.989  -6.523
  450   1HD2  LEU1164          2HD2      LEU1164   1.337  -4.583  -4.826
  451   2HD2  LEU1164          1HD2      LEU1164   0.946  -5.263  -6.406
  452   3HD2  LEU1164          3HD2      LEU1164   1.182  -3.524  -6.228
  453    H    HIS1165           HN       HIS1165  -1.599   0.167  -6.183
  454    HA   HIS1165           HA       HIS1165  -1.933   2.083  -4.234
  455   1HB   HIS1165           HB2      HIS1165  -3.867   1.427  -6.469
  456   2HB   HIS1165           HB1      HIS1165  -3.793   2.950  -5.588
  457    HD1  HIS1165           HD1      HIS1165  -2.391   4.714  -6.616
  458    HD2  HIS1165           HD2      HIS1165  -1.358   0.923  -7.968
  459    HE1  HIS1165           HE1      HIS1165  -0.658   5.085  -8.400
  460    HE2  HIS1165           HE2      HIS1165  -0.110   2.782  -9.260
  461    HA   PRO1166           HA       PRO1166  -4.707   0.398  -1.240
  462   1HB   PRO1166           HB2      PRO1166  -6.043   2.709  -0.538
  463   2HB   PRO1166           HB1      PRO1166  -4.459   2.242   0.088
  464   1HG   PRO1166           HG2      PRO1166  -5.140   4.132  -2.128
  465   2HG   PRO1166           HG1      PRO1166  -3.913   4.290  -0.857
  466   1HD   PRO1166           HD2      PRO1166  -3.253   3.573  -3.353
  467   2HD   PRO1166           HD1      PRO1166  -2.430   2.873  -1.943
  468    H    CYS1167           HN       CYS1167  -7.053   0.249  -0.741
  469    HA   CYS1167           HA       CYS1167  -8.523  -0.119  -3.162
  470   1HB   CYS1167           HB2      CYS1167 -10.359  -0.749  -1.499
  471   2HB   CYS1167           HB1      CYS1167  -8.923  -1.761  -1.541
  472    H    VAL1168           HN       VAL1168  -8.237   2.313  -3.573
  473    HA   VAL1168           HA       VAL1168  -9.859   4.163  -2.193
  474    HB   VAL1168           HB       VAL1168  -8.085   5.033  -3.529
  475   1HG1  VAL1168          3HG1      VAL1168  -9.400   3.718  -5.902
  476   2HG1  VAL1168          2HG1      VAL1168  -7.992   4.778  -5.966
  477   3HG1  VAL1168          1HG1      VAL1168  -7.889   3.225  -5.138
  478   1HG2  VAL1168          3HG2      VAL1168 -10.734   5.676  -4.814
  479   2HG2  VAL1168          2HG2      VAL1168 -10.016   6.476  -3.417
  480   3HG2  VAL1168          1HG2      VAL1168  -9.261   6.626  -5.003
  481    H    ILE1169           HN       ILE1169 -11.910   3.238  -1.929
  482    HA   ILE1169           HA       ILE1169 -13.391   2.298  -4.204
  483    HB   ILE1169           HB       ILE1169 -13.598   1.638  -1.665
  484   1HG1  ILE1169          2HG1      ILE1169 -16.063   1.907  -3.394
  485   2HG1  ILE1169          1HG1      ILE1169 -14.819   0.684  -3.635
  486   1HG2  ILE1169          1HG2      ILE1169 -14.210   3.883  -0.908
  487   2HG2  ILE1169          3HG2      ILE1169 -15.662   3.820  -1.908
  488   3HG2  ILE1169          2HG2      ILE1169 -15.474   2.705  -0.554
  489   1HD1  ILE1169          2HD1      ILE1169 -15.276  -0.219  -1.420
  490   2HD1  ILE1169          1HD1      ILE1169 -16.526   1.002  -1.181
  491   3HD1  ILE1169          3HD1      ILE1169 -16.718  -0.221  -2.436
  492    H    SER1170           HN       SER1170 -15.819   3.180  -4.204
  493    HA   SER1170           HA       SER1170 -15.545   5.999  -4.925
  494   1HB   SER1170           HB2      SER1170 -17.766   4.030  -5.512
  495   2HB   SER1170           HB1      SER1170 -17.690   5.686  -6.110
  496    HG   SER1170           HG       SER1170 -15.639   5.053  -7.085
  497    H    ARG1171           HN       ARG1171 -15.651   7.030  -2.929
  498    HA   ARG1171           HA       ARG1171 -17.564   6.561  -0.920
  499   1HB   ARG1171           HB2      ARG1171 -16.999   8.860  -0.155
  500   2HB   ARG1171           HB1      ARG1171 -15.582   7.863  -0.454
  501   1HG   ARG1171           HG2      ARG1171 -15.252   8.959  -2.606
  502   2HG   ARG1171           HG1      ARG1171 -16.686   9.949  -2.325
  503   1HD   ARG1171           HD2      ARG1171 -15.628  10.938  -0.361
  504   2HD   ARG1171           HD1      ARG1171 -14.201   9.935  -0.616
  505    HE   ARG1171           HE       ARG1171 -14.567  11.326  -2.963
  506   1HH1  ARG1171          1HH1      ARG1171 -14.029  12.124   0.386
  507   2HH1  ARG1171          2HH1      ARG1171 -13.196  13.601   0.033
  508   1HH2  ARG1171          1HH2      ARG1171 -13.472  13.269  -3.436
  509   2HH2  ARG1171          2HH2      ARG1171 -12.880  14.252  -2.138
  510    H    GLU1172           HN       GLU1172 -17.581   8.693  -3.738
  511    HA   GLU1172           HA       GLU1172 -20.040   9.972  -3.148
  512   1HB   GLU1172           HB2      GLU1172 -18.268  10.795  -4.743
  513   2HB   GLU1172           HB1      GLU1172 -18.814   9.570  -5.879
  514   1HG   GLU1172           HG2      GLU1172 -19.770  11.725  -6.416
  515   2HG   GLU1172           HG1      GLU1172 -21.029  10.593  -5.926
  516    H    ILE1173           HN       ILE1173 -19.607   6.827  -3.545
  517    HA   ILE1173           HA       ILE1173 -22.162   6.454  -4.953
  518    HB   ILE1173           HB       ILE1173 -19.688   4.740  -5.008
  519   1HG1  ILE1173          2HG1      ILE1173 -20.006   6.711  -6.570
  520   2HG1  ILE1173          1HG1      ILE1173 -19.698   5.159  -7.346
  521   1HG2  ILE1173          1HG2      ILE1173 -21.611   3.284  -4.652
  522   2HG2  ILE1173          3HG2      ILE1173 -22.436   4.030  -6.021
  523   3HG2  ILE1173          2HG2      ILE1173 -20.965   3.095  -6.283
  524   1HD1  ILE1173          1HD1      ILE1173 -22.380   6.493  -7.043
  525   2HD1  ILE1173          3HD1      ILE1173 -21.415   6.409  -8.517
  526   3HD1  ILE1173          2HD1      ILE1173 -22.085   4.936  -7.817
  527    H    MET1174           HN       MET1174 -19.978   4.927  -2.557
  528    HA   MET1174           HA       MET1174 -22.056   3.309  -1.480
  529   1HB   MET1174           HB2      MET1174 -20.377   2.949   0.396
  530   2HB   MET1174           HB1      MET1174 -19.877   2.453  -1.214
  531   1HG   MET1174           HG2      MET1174 -18.424   4.275  -1.446
  532   2HG   MET1174           HG1      MET1174 -19.146   5.129  -0.083
  533   1HE   MET1174           HE3      MET1174 -19.432   2.835   2.078
  534   2HE   MET1174           HE2      MET1174 -17.915   3.009   2.961
  535   3HE   MET1174           HE1      MET1174 -18.807   4.441   2.450
  536    H    GLU1175           HN       GLU1175 -20.202   5.956   0.057
  537    HA   GLU1175           HA       GLU1175 -22.072   6.283   2.152
  538   1HB   GLU1175           HB2      GLU1175 -20.685   7.957   2.941
  539   2HB   GLU1175           HB1      GLU1175 -19.559   7.019   1.966
  540   1HG   GLU1175           HG2      GLU1175 -19.023   9.101   1.258
  541   2HG   GLU1175           HG1      GLU1175 -20.296   8.726   0.098
  542    H    ASN1176           HN       ASN1176 -22.418   6.913  -1.043
  543    HA   ASN1176           HA       ASN1176 -23.958   9.366  -0.774
  544   1HB   ASN1176           HB2      ASN1176 -22.433   9.058  -2.696
  545   2HB   ASN1176           HB1      ASN1176 -23.419   7.695  -3.207
  546   1HD2  ASN1176          1HD2      ASN1176 -23.924   8.651  -5.167
  547   2HD2  ASN1176          2HD2      ASN1176 -25.023   9.979  -5.287
  548    H    TYR1177           HN       TYR1177 -24.559   6.233  -2.378
  549    HA   TYR1177           HA       TYR1177 -27.274   6.406  -2.686
  550   1HB   TYR1177           HB2      TYR1177 -25.705   3.934  -1.920
  551   2HB   TYR1177           HB1      TYR1177 -27.343   3.929  -2.561
  552    HD1  TYR1177           HD1      TYR1177 -26.574   6.311  -4.554
  553    HD2  TYR1177           HD2      TYR1177 -24.996   2.451  -3.713
  554    HE1  TYR1177           HE1      TYR1177 -25.678   6.184  -6.840
  555    HE2  TYR1177           HE2      TYR1177 -24.091   2.314  -5.989
  556    HH   TYR1177           HH       TYR1177 -24.522   3.302  -8.204
  557    H    ASN1178           HN       ASN1178 -25.861   4.477  -0.076
  558    HA   ASN1178           HA       ASN1178 -27.087   5.662   2.084
  559   1HB   ASN1178           HB2      ASN1178 -29.030   4.270   2.521
  560   2HB   ASN1178           HB1      ASN1178 -29.215   5.033   0.946
  561   1HD2  ASN1178          1HD2      ASN1178 -29.055   3.772  -0.918
  562   2HD2  ASN1178          2HD2      ASN1178 -29.168   2.051  -0.870
  563    H    ILE1179           HN       ILE1179 -24.706   4.151   1.252
  564    HA   ILE1179           HA       ILE1179 -24.769   2.133   3.394
  565    HB   ILE1179           HB       ILE1179 -23.210   0.735   2.050
  566   1HG1  ILE1179          2HG1      ILE1179 -24.078   2.434  -0.288
  567   2HG1  ILE1179          1HG1      ILE1179 -22.539   2.660   0.537
  568   1HG2  ILE1179          1HG2      ILE1179 -25.919   1.253   0.833
  569   2HG2  ILE1179          3HG2      ILE1179 -24.946  -0.198   0.592
  570   3HG2  ILE1179          2HG2      ILE1179 -25.571   0.188   2.195
  571   1HD1  ILE1179          2HD1      ILE1179 -23.424   0.129  -0.819
  572   2HD1  ILE1179          1HD1      ILE1179 -22.322   1.327  -1.499
  573   3HD1  ILE1179          3HD1      ILE1179 -21.860   0.420  -0.058
  574    H    ALA1180           HN       ALA1180 -22.832   1.753   4.494
  575    HA   ALA1180           HA       ALA1180 -20.616   3.605   3.978
  576   1HB   ALA1180           HB3      ALA1180 -21.997   4.620   5.721
  577   2HB   ALA1180           HB2      ALA1180 -21.872   3.149   6.685
  578   3HB   ALA1180           HB1      ALA1180 -20.433   4.117   6.364
  579    H    LEU1181           HN       LEU1181 -20.213   2.158   6.946
  580    HA   LEU1181           HA       LEU1181 -19.344  -0.420   6.021
  581   1HB   LEU1181           HB2      LEU1181 -16.992   0.064   7.038
  582   2HB   LEU1181           HB1      LEU1181 -17.348   0.456   5.369
  583    HG   LEU1181           HG       LEU1181 -17.859   2.638   7.275
  584   1HD1  LEU1181          2HD1      LEU1181 -15.820   1.498   8.190
  585   2HD1  LEU1181          1HD1      LEU1181 -15.022   1.842   6.656
  586   3HD1  LEU1181          3HD1      LEU1181 -15.574   3.168   7.680
  587   1HD2  LEU1181          3HD2      LEU1181 -18.017   2.828   4.815
  588   2HD2  LEU1181          2HD2      LEU1181 -16.835   3.941   5.509
  589   3HD2  LEU1181          1HD2      LEU1181 -16.295   2.467   4.699
  590    H    ARG1182           HN       ARG1182 -17.808  -1.318   8.011
  591    HA   ARG1182           HA       ARG1182 -19.627  -1.753  10.093
  592   1HB   ARG1182           HB2      ARG1182 -17.573  -2.720  11.283
  593   2HB   ARG1182           HB1      ARG1182 -18.067  -3.454   9.764
  594   1HG   ARG1182           HG2      ARG1182 -16.335  -2.187   8.591
  595   2HG   ARG1182           HG1      ARG1182 -15.834  -1.470  10.123
  596   1HD   ARG1182           HD2      ARG1182 -15.288  -3.684  10.989
  597   2HD   ARG1182           HD1      ARG1182 -15.800  -4.412   9.468
  598    HE   ARG1182           HE       ARG1182 -13.837  -2.497   8.914
  599   1HH1  ARG1182          1HH1      ARG1182 -14.158  -5.585  10.496
  600   2HH1  ARG1182          2HH1      ARG1182 -12.525  -6.063  10.176
  601   1HH2  ARG1182          1HH2      ARG1182 -11.685  -3.119   8.488
  602   2HH2  ARG1182          2HH2      ARG1182 -11.119  -4.662   9.035
  603    H    TRP1183           HN       TRP1183 -18.072   1.049   9.523
  604    HA   TRP1183           HA       TRP1183 -17.885   1.712  12.386
  605   1HB   TRP1183           HB2      TRP1183 -16.518   3.093  10.065
  606   2HB   TRP1183           HB1      TRP1183 -16.331   3.496  11.770
  607    HD1  TRP1183           HD1      TRP1183 -15.686   0.476   9.429
  608    HE1  TRP1183           HE1      TRP1183 -13.618  -0.777  10.297
  609    HE3  TRP1183           HE3      TRP1183 -14.753   3.249  13.623
  610    HZ2  TRP1183           HZ2      TRP1183 -11.824  -0.611  12.453
  611    HZ3  TRP1183           HZ3      TRP1183 -12.835   2.633  15.035
  612    HH2  TRP1183           HH2      TRP1183 -11.400   0.742  14.462
  613    H    THR1184           HN       THR1184 -19.450   2.323   9.412
  614    HA   THR1184           HA       THR1184 -21.018   3.828   8.712
  615    HB   THR1184           HB       THR1184 -22.850   4.225  10.264
  616    HG1  THR1184           HG1      THR1184 -22.432   3.238  12.477
  617   1HG2  THR1184          3HG2      THR1184 -21.665   1.467  10.602
  618   2HG2  THR1184          2HG2      THR1184 -23.349   1.906  10.888
  619   3HG2  THR1184          1HG2      THR1184 -22.678   2.003   9.261
  620    H    ALA1185           HN       ALA1185 -18.481   4.985   9.676
  621    HA   ALA1185           HA       ALA1185 -19.177   7.443  11.013
  622   1HB   ALA1185           HB3      ALA1185 -16.580   6.612   9.727
  623   2HB   ALA1185           HB1      ALA1185 -17.019   6.359  11.416
  624   3HB   ALA1185           HB2      ALA1185 -16.817   7.996  10.792
  625    H    LYS1186           HN       LYS1186 -19.919   6.514   8.058
  626    HA   LYS1186           HA       LYS1186 -20.498   7.577   6.140
  627   1HB   LYS1186           HB2      LYS1186 -21.464   9.288   7.608
  628   2HB   LYS1186           HB1      LYS1186 -19.902  10.086   7.722
  629   1HG   LYS1186           HG2      LYS1186 -19.960  10.616   5.364
  630   2HG   LYS1186           HG1      LYS1186 -21.478   9.735   5.181
  631   1HD   LYS1186           HD2      LYS1186 -21.090  12.144   6.955
  632   2HD   LYS1186           HD1      LYS1186 -21.786  12.188   5.333
  633   1HE   LYS1186           HE2      LYS1186 -23.577  10.686   6.067
  634   2HE   LYS1186           HE1      LYS1186 -22.883  10.655   7.687
  635   1HZ   LYS1186           HZ3      LYS1186 -23.269  13.036   7.857
  636   2HZ   LYS1186           HZ2      LYS1186 -23.937  13.062   6.305
  637   3HZ   LYS1186           HZ1      LYS1186 -24.716  12.216   7.544
  638    H    GLN1187           HN       GLN1187 -18.977   6.914   4.764
  639    HA   GLN1187           HA       GLN1187 -17.178   6.969   3.388
  640   1HB   GLN1187           HB2      GLN1187 -17.982   9.264   2.919
  641   2HB   GLN1187           HB1      GLN1187 -16.964   9.866   4.221
  642   1HG   GLN1187           HG2      GLN1187 -15.068   8.658   2.886
  643   2HG   GLN1187           HG1      GLN1187 -16.201   8.817   1.543
  644   1HE2  GLN1187          1HE2      GLN1187 -13.591  10.071   1.977
  645   2HE2  GLN1187          2HE2      GLN1187 -13.866  11.774   1.886
  646    H    LYS1188           HN       LYS1188 -15.988   5.553   4.651
  647    HA   LYS1188           HA       LYS1188 -13.665   6.758   5.960
  648   1HB   LYS1188           HB2      LYS1188 -15.327   6.085   7.701
  649   2HB   LYS1188           HB1      LYS1188 -15.239   4.438   7.099
  650   1HG   LYS1188           HG2      LYS1188 -12.872   4.346   7.691
  651   2HG   LYS1188           HG1      LYS1188 -12.960   6.004   8.290
  652   1HD   LYS1188           HD2      LYS1188 -14.662   5.287   9.927
  653   2HD   LYS1188           HD1      LYS1188 -14.472   3.625   9.362
  654   1HE   LYS1188           HE2      LYS1188 -12.279   5.325  10.534
  655   2HE   LYS1188           HE1      LYS1188 -13.186   4.094  11.413
  656   1HZ   LYS1188           HZ3      LYS1188 -11.476   3.611   9.033
  657   2HZ   LYS1188           HZ2      LYS1188 -11.068   3.240  10.632
  658   3HZ   LYS1188           HZ1      LYS1188 -12.346   2.429   9.876
  659    H    LEU1189           HN       LEU1189 -14.355   5.533   3.402
  660    HA   LEU1189           HA       LEU1189 -13.377   2.922   3.133
  661   1HB   LEU1189           HB2      LEU1189 -12.982   3.842   0.699
  662   2HB   LEU1189           HB1      LEU1189 -14.586   3.501   1.311
  663    HG   LEU1189           HG       LEU1189 -14.199   5.685   0.004
  664   1HD1  LEU1189          3HD1      LEU1189 -15.592   5.649   2.666
  665   2HD1  LEU1189          2HD1      LEU1189 -15.805   6.904   1.447
  666   3HD1  LEU1189          1HD1      LEU1189 -16.274   5.242   1.093
  667   1HD2  LEU1189          1HD2      LEU1189 -12.193   6.421   1.179
  668   2HD2  LEU1189          3HD2      LEU1189 -13.492   7.604   1.313
  669   3HD2  LEU1189          2HD2      LEU1189 -13.116   6.551   2.676
  670    H    TYR1190           HN       TYR1190 -11.609   2.919   1.164
  671    HA   TYR1190           HA       TYR1190  -9.430   3.024   0.591
  672   1HB   TYR1190           HB2      TYR1190  -9.283   5.421   2.419
  673   2HB   TYR1190           HB1      TYR1190  -8.082   4.959   1.220
  674    HD1  TYR1190           HD1      TYR1190 -11.137   4.207  -0.263
  675    HD2  TYR1190           HD2      TYR1190  -8.746   7.558   0.851
  676    HE1  TYR1190           HE1      TYR1190 -12.285   5.589  -1.942
  677    HE2  TYR1190           HE2      TYR1190  -9.895   8.940  -0.824
  678    HH   TYR1190           HH       TYR1190 -12.750   7.966  -2.371
  679    H    SER1191           HN       SER1191  -8.106   1.513   1.226
  680    HA   SER1191           HA       SER1191  -7.025   1.515   3.928
  681   1HB   SER1191           HB2      SER1191  -8.731  -0.636   2.783
  682   2HB   SER1191           HB1      SER1191  -7.410  -1.085   3.854
  683    HG   SER1191           HG       SER1191  -8.688   0.932   4.985
  684    H    ARG1192           HN       ARG1192  -5.237  -0.124   4.139
  685    HA   ARG1192           HA       ARG1192  -3.478   0.119   1.912
  686   1HB   ARG1192           HB2      ARG1192  -3.289  -1.347   4.544
  687   2HB   ARG1192           HB1      ARG1192  -1.998  -1.343   3.359
  688   1HG   ARG1192           HG2      ARG1192  -1.852   1.095   3.525
  689   2HG   ARG1192           HG1      ARG1192  -3.133   1.075   4.738
  690   1HD   ARG1192           HD2      ARG1192  -1.738  -0.282   6.205
  691   2HD   ARG1192           HD1      ARG1192  -0.461  -0.299   4.989
  692    HE   ARG1192           HE       ARG1192  -1.072   2.363   5.559
  693   1HH1  ARG1192          1HH1      ARG1192   0.296  -0.422   7.145
  694   2HH1  ARG1192          2HH1      ARG1192   1.297   0.513   8.205
  695   1HH2  ARG1192          1HH2      ARG1192   0.242   3.601   6.950
  696   2HH2  ARG1192          2HH2      ARG1192   1.266   2.799   8.095
  697    H    THR1193           HN       THR1193  -3.597  -1.125   0.161
  698    HA   THR1193           HA       THR1193  -5.211  -3.188  -0.387
  699    HB   THR1193           HB       THR1193  -2.341  -2.978  -1.322
  700    HG1  THR1193           HG1      THR1193  -4.537  -1.516  -1.823
  701   1HG2  THR1193          2HG2      THR1193  -4.653  -4.527  -2.495
  702   2HG2  THR1193          1HG2      THR1193  -3.069  -4.323  -3.245
  703   3HG2  THR1193          3HG2      THR1193  -3.221  -5.217  -1.733
  704    H    GLY1194           HN       GLY1194  -5.568  -5.151   0.348
  705   1HA   GLY1194           HA1      GLY1194  -3.399  -6.526   1.810
  706   2HA   GLY1194           HA2      GLY1194  -4.591  -7.372   0.828
  707    H    GLU1195           HN       GLU1195  -5.605  -4.660   2.676
  708    HA   GLU1195           HA       GLU1195  -6.524  -6.292   4.907
  709   1HB   GLU1195           HB2      GLU1195  -6.634  -3.310   4.399
  710   2HB   GLU1195           HB1      GLU1195  -7.281  -4.089   5.837
  711   1HG   GLU1195           HG2      GLU1195  -4.401  -4.122   4.958
  712   2HG   GLU1195           HG1      GLU1195  -5.083  -3.123   6.241
  713    H    SER1196           HN       SER1196  -8.714  -6.453   5.510
  714    HA   SER1196           HA       SER1196 -10.540  -6.280   3.240
  715   1HB   SER1196           HB2      SER1196 -12.013  -7.728   4.574
  716   2HB   SER1196           HB1      SER1196 -10.397  -8.420   4.436
  717    HG   SER1196           HG       SER1196 -10.414  -6.886   6.585
  718    H    VAL1197           HN       VAL1197 -12.188  -4.890   3.107
  719    HA   VAL1197           HA       VAL1197 -12.732  -3.186   5.451
  720    HB   VAL1197           HB       VAL1197 -13.130  -2.472   2.539
  721   1HG1  VAL1197          1HG1      VAL1197 -13.397  -0.813   5.047
  722   2HG1  VAL1197          3HG1      VAL1197 -13.532  -0.204   3.398
  723   3HG1  VAL1197          2HG1      VAL1197 -14.717  -1.358   4.012
  724   1HG2  VAL1197          1HG2      VAL1197 -10.755  -2.630   3.126
  725   2HG2  VAL1197          3HG2      VAL1197 -11.239  -0.963   2.811
  726   3HG2  VAL1197          2HG2      VAL1197 -11.017  -1.521   4.472
  727    H    GLU1198           HN       GLU1198 -14.580  -3.726   6.392
  728    HA   GLU1198           HA       GLU1198 -16.682  -5.033   4.873
  729   1HB   GLU1198           HB2      GLU1198 -16.543  -6.115   6.884
  730   2HB   GLU1198           HB1      GLU1198 -16.034  -4.672   7.749
  731   1HG   GLU1198           HG2      GLU1198 -18.245  -3.859   7.894
  732   2HG   GLU1198           HG1      GLU1198 -18.836  -5.058   6.740
  733    H    PHE1199           HN       PHE1199 -18.345  -3.991   4.011
  734    HA   PHE1199           HA       PHE1199 -18.877  -1.242   4.885
  735   1HB   PHE1199           HB2      PHE1199 -19.665  -2.664   2.334
  736   2HB   PHE1199           HB1      PHE1199 -20.061  -0.994   2.724
  737    HD1  PHE1199           HD1      PHE1199 -18.620   0.712   2.104
  738    HD2  PHE1199           HD2      PHE1199 -17.170  -3.282   2.299
  739    HE1  PHE1199           HE1      PHE1199 -16.483   1.445   1.118
  740    HE2  PHE1199           HE2      PHE1199 -15.037  -2.562   1.323
  741    HZ   PHE1199           HZ       PHE1199 -14.686  -0.197   0.733
  742    H    VAL1200           HN       VAL1200 -21.128  -0.534   4.918
  743    HA   VAL1200           HA       VAL1200 -23.127  -2.622   5.366
  744    HB   VAL1200           HB       VAL1200 -23.854  -1.744   7.476
  745   1HG1  VAL1200          2HG1      VAL1200 -20.861  -2.103   7.493
  746   2HG1  VAL1200          1HG1      VAL1200 -21.908  -2.191   8.909
  747   3HG1  VAL1200          3HG1      VAL1200 -22.072  -3.379   7.617
  748   1HG2  VAL1200          2HG2      VAL1200 -23.426   0.614   7.078
  749   2HG2  VAL1200          1HG2      VAL1200 -22.712   0.106   8.608
  750   3HG2  VAL1200          3HG2      VAL1200 -21.688   0.333   7.190
  751    H    CYS1201           HN       CYS1201 -25.113  -0.916   6.372
  752    HA   CYS1201           HA       CYS1201 -25.366   1.143   4.289
  753   1HB   CYS1201           HB2      CYS1201 -27.928  -0.028   5.022
  754   2HB   CYS1201           HB1      CYS1201 -27.248   0.269   3.427
  755    H    LYS1202           HN       LYS1202 -26.422   3.017   4.920
  756    HA   LYS1202           HA       LYS1202 -26.186   4.014   7.400
  757   1HB   LYS1202           HB2      LYS1202 -28.623   4.525   5.691
  758   2HB   LYS1202           HB1      LYS1202 -27.977   5.584   6.936
  759   1HG   LYS1202           HG2      LYS1202 -26.078   6.110   5.639
  760   2HG   LYS1202           HG1      LYS1202 -26.421   4.813   4.488
  761   1HD   LYS1202           HD2      LYS1202 -27.133   6.793   3.429
  762   2HD   LYS1202           HD1      LYS1202 -28.598   6.000   4.021
  763   1HE   LYS1202           HE2      LYS1202 -28.621   7.473   5.966
  764   2HE   LYS1202           HE1      LYS1202 -27.147   8.258   5.399
  765   1HZ   LYS1202           HZ3      LYS1202 -29.756   8.248   3.979
  766   2HZ   LYS1202           HZ2      LYS1202 -29.106   9.550   4.841
  767   3HZ   LYS1202           HZ1      LYS1202 -28.342   9.002   3.435
  768    H    ARG1203           HN       ARG1203 -26.654   3.078   9.225
  769    HA   ARG1203           HA       ARG1203 -27.997   1.116  10.144
  770   1HB   ARG1203           HB2      ARG1203 -28.385   3.880  11.283
  771   2HB   ARG1203           HB1      ARG1203 -28.695   2.383  12.147
  772   1HG   ARG1203           HG2      ARG1203 -26.016   3.163  11.027
  773   2HG   ARG1203           HG1      ARG1203 -26.520   3.446  12.694
  774   1HD   ARG1203           HD2      ARG1203 -26.329   0.757  11.341
  775   2HD   ARG1203           HD1      ARG1203 -25.164   1.418  12.488
  776    HE   ARG1203           HE       ARG1203 -27.748   1.385  13.630
  777   1HH1  ARG1203          1HH1      ARG1203 -25.128  -0.732  12.737
  778   2HH1  ARG1203          2HH1      ARG1203 -25.510  -1.922  13.936
  779   1HH2  ARG1203          1HH2      ARG1203 -28.257  -0.176  15.212
  780   2HH2  ARG1203          2HH2      ARG1203 -27.289  -1.606  15.343
  781    H    GLY1204           HN       GLY1204 -29.613   0.411   8.719
  782   1HA   GLY1204           HA1      GLY1204 -32.078   1.967   8.568
  783   2HA   GLY1204           HA2      GLY1204 -32.169   0.415   9.387
  784    H    TYR1205           HN       TYR1205 -30.693   1.643   6.358
  785    HA   TYR1205           HA       TYR1205 -32.393   0.336   4.600
  786   1HB   TYR1205           HB2      TYR1205 -29.482   1.032   4.236
  787   2HB   TYR1205           HB1      TYR1205 -30.533   0.503   2.936
  788    HD1  TYR1205           HD1      TYR1205 -29.637   3.252   5.162
  789    HD2  TYR1205           HD2      TYR1205 -32.292   1.977   2.093
  790    HE1  TYR1205           HE1      TYR1205 -30.306   5.588   4.778
  791    HE2  TYR1205           HE2      TYR1205 -32.970   4.308   1.702
  792    HH   TYR1205           HH       TYR1205 -31.275   6.954   2.981
  793    H    ARG1206           HN       ARG1206 -32.682  -1.683   3.992
  794    HA   ARG1206           HA       ARG1206 -31.014  -3.756   5.164
  795   1HB   ARG1206           HB2      ARG1206 -32.750  -5.290   4.473
  796   2HB   ARG1206           HB1      ARG1206 -33.486  -3.903   5.266
  797   1HG   ARG1206           HG2      ARG1206 -33.982  -2.946   3.034
  798   2HG   ARG1206           HG1      ARG1206 -33.352  -4.426   2.305
  799   1HD   ARG1206           HD2      ARG1206 -35.773  -4.520   2.454
  800   2HD   ARG1206           HD1      ARG1206 -35.036  -5.735   3.499
  801    HE   ARG1206           HE       ARG1206 -35.495  -3.428   5.012
  802   1HH1  ARG1206          1HH1      ARG1206 -37.291  -5.928   3.381
  803   2HH1  ARG1206          2HH1      ARG1206 -38.646  -5.832   4.454
  804   1HH2  ARG1206          1HH2      ARG1206 -37.275  -3.296   6.429
  805   2HH2  ARG1206          2HH2      ARG1206 -38.638  -4.336   6.186
  806    H    LEU1207           HN       LEU1207 -29.759  -5.174   4.045
  807    HA   LEU1207           HA       LEU1207 -28.530  -4.442   1.695
  808   1HB   LEU1207           HB2      LEU1207 -27.770  -6.221   3.298
  809   2HB   LEU1207           HB1      LEU1207 -28.951  -7.298   2.579
  810    HG   LEU1207           HG       LEU1207 -27.771  -6.953   0.370
  811   1HD1  LEU1207          2HD1      LEU1207 -26.618  -4.872   0.942
  812   2HD1  LEU1207          1HD1      LEU1207 -25.658  -5.735   2.145
  813   3HD1  LEU1207          3HD1      LEU1207 -25.481  -6.122   0.433
  814   1HD2  LEU1207          2HD2      LEU1207 -27.465  -8.969   1.704
  815   2HD2  LEU1207          1HD2      LEU1207 -25.963  -8.505   0.902
  816   3HD2  LEU1207          3HD2      LEU1207 -26.183  -8.176   2.621
  817    H    SER1208           HN       SER1208 -29.155  -4.348  -0.352
  818    HA   SER1208           HA       SER1208 -31.742  -5.054  -1.188
  819   1HB   SER1208           HB2      SER1208 -29.255  -4.243  -2.672
  820   2HB   SER1208           HB1      SER1208 -30.751  -4.628  -3.521
  821    HG   SER1208           HG       SER1208 -30.073  -2.403  -2.094
  822    H    SER1209           HN       SER1209 -29.258  -7.098  -0.520
  823    HA   SER1209           HA       SER1209 -28.958  -9.328  -0.841
  824   1HB   SER1209           HB2      SER1209 -31.394  -9.546  -0.728
  825   2HB   SER1209           HB1      SER1209 -31.519  -9.166  -2.445
  826    HG   SER1209           HG       SER1209 -30.855 -11.520  -1.215
  827    H    ARG1210           HN       ARG1210 -30.414  -8.377  -3.959
  828    HA   ARG1210           HA       ARG1210 -28.658  -9.823  -5.558
  829   1HB   ARG1210           HB2      ARG1210 -30.132  -7.269  -6.228
  830   2HB   ARG1210           HB1      ARG1210 -29.403  -8.355  -7.403
  831   1HG   ARG1210           HG2      ARG1210 -30.927 -10.130  -6.726
  832   2HG   ARG1210           HG1      ARG1210 -31.646  -9.060  -5.520
  833   1HD   ARG1210           HD2      ARG1210 -33.013  -9.170  -7.542
  834   2HD   ARG1210           HD1      ARG1210 -32.378  -7.546  -7.281
  835    HE   ARG1210           HE       ARG1210 -30.657  -9.009  -8.978
  836   1HH1  ARG1210          1HH1      ARG1210 -33.751  -7.408  -8.946
  837   2HH1  ARG1210          2HH1      ARG1210 -33.728  -7.051 -10.640
  838   1HH2  ARG1210          1HH2      ARG1210 -30.618  -8.543 -11.209
  839   2HH2  ARG1210          2HH2      ARG1210 -31.948  -7.697 -11.927
  840    H    SER1211           HN       SER1211 -28.036  -7.099  -3.697
  841    HA   SER1211           HA       SER1211 -26.206  -5.641  -5.204
  842   1HB   SER1211           HB2      SER1211 -27.079  -4.845  -3.064
  843   2HB   SER1211           HB1      SER1211 -26.243  -6.146  -2.219
  844    HG   SER1211           HG       SER1211 -25.085  -3.981  -3.635
  845    H    HIS1212           HN       HIS1212 -23.785  -5.512  -4.472
  846    HA   HIS1212           HA       HIS1212 -22.558  -7.934  -5.315
  847   1HB   HIS1212           HB2      HIS1212 -21.217  -5.528  -4.069
  848   2HB   HIS1212           HB1      HIS1212 -20.459  -6.759  -5.075
  849    HD1  HIS1212           HD1      HIS1212 -21.037  -6.702  -7.640
  850    HD2  HIS1212           HD2      HIS1212 -22.471  -3.484  -5.438
  851    HE1  HIS1212           HE1      HIS1212 -21.681  -4.961  -9.336
  852    HE2  HIS1212           HE2      HIS1212 -22.625  -3.056  -7.984
  853    H    THR1213           HN       THR1213 -21.451  -6.168  -2.465
  854    HA   THR1213           HA       THR1213 -22.150  -8.149  -0.571
  855    HB   THR1213           HB       THR1213 -20.541  -9.610  -1.403
  856    HG1  THR1213           HG1      THR1213 -18.605  -8.987   0.157
  857   1HG2  THR1213          2HG2      THR1213 -18.656  -7.271  -1.693
  858   2HG2  THR1213          1HG2      THR1213 -18.269  -8.952  -2.062
  859   3HG2  THR1213          3HG2      THR1213 -19.490  -8.100  -3.006
  860    H    LEU1214           HN       LEU1214 -20.937  -7.832   1.519
  861    HA   LEU1214           HA       LEU1214 -20.640  -4.959   1.967
  862   1HB   LEU1214           HB2      LEU1214 -21.009  -7.285   3.849
  863   2HB   LEU1214           HB1      LEU1214 -20.690  -5.651   4.399
  864    HG   LEU1214           HG       LEU1214 -23.033  -6.009   4.580
  865   1HD1  LEU1214          2HD1      LEU1214 -22.449  -4.403   2.097
  866   2HD1  LEU1214          1HD1      LEU1214 -23.944  -4.330   3.033
  867   3HD1  LEU1214          3HD1      LEU1214 -22.421  -3.814   3.759
  868   1HD2  LEU1214          3HD2      LEU1214 -23.207  -7.939   3.096
  869   2HD2  LEU1214          2HD2      LEU1214 -24.428  -6.725   2.716
  870   3HD2  LEU1214          1HD2      LEU1214 -22.998  -6.887   1.697
  871    H    ARG1215           HN       ARG1215 -19.032  -7.921   3.107
  872    HA   ARG1215           HA       ARG1215 -16.608  -6.420   3.653
  873   1HB   ARG1215           HB2      ARG1215 -17.557  -8.298   5.116
  874   2HB   ARG1215           HB1      ARG1215 -16.943  -9.404   3.894
  875   1HG   ARG1215           HG2      ARG1215 -14.681  -8.477   4.244
  876   2HG   ARG1215           HG1      ARG1215 -15.329  -7.466   5.538
  877   1HD   ARG1215           HD2      ARG1215 -16.019  -9.461   6.761
  878   2HD   ARG1215           HD1      ARG1215 -15.397 -10.481   5.463
  879    HE   ARG1215           HE       ARG1215 -13.365  -8.769   6.436
  880   1HH1  ARG1215          1HH1      ARG1215 -15.174 -11.627   7.273
  881   2HH1  ARG1215          2HH1      ARG1215 -13.919 -12.287   8.267
  882   1HH2  ARG1215          1HH2      ARG1215 -11.707  -9.631   7.741
  883   2HH2  ARG1215          2HH2      ARG1215 -11.948 -11.152   8.533
  884    H    THR1216           HN       THR1216 -15.150  -6.055   2.131
  885    HA   THR1216           HA       THR1216 -14.696  -8.126   0.089
  886    HB   THR1216           HB       THR1216 -15.869  -6.431  -1.081
  887    HG1  THR1216           HG1      THR1216 -14.241  -6.947  -2.406
  888   1HG2  THR1216          3HG2      THR1216 -15.673  -4.641   0.571
  889   2HG2  THR1216          2HG2      THR1216 -13.974  -4.429   0.148
  890   3HG2  THR1216          1HG2      THR1216 -15.230  -4.066  -1.036
  891    H    THR1217           HN       THR1217 -12.575  -7.451  -1.176
  892    HA   THR1217           HA       THR1217 -10.516  -7.039   0.889
  893    HB   THR1217           HB       THR1217 -10.505  -8.659  -1.647
  894    HG1  THR1217           HG1      THR1217  -9.381  -9.890   0.397
  895   1HG2  THR1217          3HG2      THR1217  -8.431  -7.285  -1.563
  896   2HG2  THR1217          2HG2      THR1217  -8.074  -7.987   0.015
  897   3HG2  THR1217          1HG2      THR1217  -8.125  -9.016  -1.415
  898    H    CYS1218           HN       CYS1218  -8.840  -5.645   0.570
  899    HA   CYS1218           HA       CYS1218  -9.222  -3.583  -1.431
  900   1HB   CYS1218           HB2      CYS1218  -7.257  -3.904   0.844
  901   2HB   CYS1218           HB1      CYS1218  -7.238  -2.536  -0.266
  902    H    TRP1219           HN       TRP1219  -8.319  -3.735  -3.401
  903    HA   TRP1219           HA       TRP1219  -5.592  -4.512  -3.717
  904   1HB   TRP1219           HB2      TRP1219  -7.252  -6.658  -3.544
  905   2HB   TRP1219           HB1      TRP1219  -7.268  -6.368  -5.281
  906    HD1  TRP1219           HD1      TRP1219  -4.790  -6.404  -6.509
  907    HE1  TRP1219           HE1      TRP1219  -2.730  -7.838  -5.949
  908    HE3  TRP1219           HE3      TRP1219  -6.001  -7.764  -1.730
  909    HZ2  TRP1219           HZ2      TRP1219  -1.745  -9.340  -3.793
  910    HZ3  TRP1219           HZ3      TRP1219  -4.440  -9.205  -0.486
  911    HH2  TRP1219           HH2      TRP1219  -2.355  -9.978  -1.497
  912    H    ASP1220           HN       ASP1220  -4.786  -3.501  -5.413
  913    HA   ASP1220           HA       ASP1220  -4.625  -2.248  -7.304
  914   1HB   ASP1220           HB2      ASP1220  -5.295  -4.476  -8.267
  915   2HB   ASP1220           HB1      ASP1220  -6.958  -3.898  -8.292
  916    H    GLY1221           HN       GLY1221  -6.534  -1.466  -5.137
  917   1HA   GLY1221           HA1      GLY1221  -7.645   0.812  -6.455
  918   2HA   GLY1221           HA2      GLY1221  -7.848   0.390  -4.762
  919    H    LYS1222           HN       LYS1222  -8.723  -2.241  -6.587
  920    HA   LYS1222           HA       LYS1222 -11.408  -1.414  -7.242
  921   1HB   LYS1222           HB2      LYS1222  -9.752  -3.347  -8.220
  922   2HB   LYS1222           HB1      LYS1222 -10.802  -4.295  -7.175
  923   1HG   LYS1222           HG2      LYS1222 -11.781  -2.439  -9.331
  924   2HG   LYS1222           HG1      LYS1222 -11.562  -4.179  -9.526
  925   1HD   LYS1222           HD2      LYS1222 -13.181  -4.584  -7.737
  926   2HD   LYS1222           HD1      LYS1222 -13.398  -2.844  -7.538
  927   1HE   LYS1222           HE2      LYS1222 -15.201  -3.796  -8.868
  928   2HE   LYS1222           HE1      LYS1222 -14.231  -2.680  -9.828
  929   1HZ   LYS1222           HZ2      LYS1222 -14.005  -5.642  -9.872
  930   2HZ   LYS1222           HZ1      LYS1222 -14.743  -4.690 -11.060
  931   3HZ   LYS1222           HZ3      LYS1222 -13.076  -4.570 -10.794
  932    H    LEU1223           HN       LEU1223 -13.298  -2.013  -6.210
  933    HA   LEU1223           HA       LEU1223 -13.155  -3.682  -3.833
  934   1HB   LEU1223           HB2      LEU1223 -13.652  -0.752  -3.809
  935   2HB   LEU1223           HB1      LEU1223 -14.559  -1.753  -2.692
  936    HG   LEU1223           HG       LEU1223 -11.554  -1.499  -2.847
  937   1HD1  LEU1223          1HD1      LEU1223 -12.687   0.425  -1.861
  938   2HD1  LEU1223          3HD1      LEU1223 -13.536  -0.644  -0.745
  939   3HD1  LEU1223          2HD1      LEU1223 -11.782  -0.481  -0.647
  940   1HD2  LEU1223          2HD2      LEU1223 -12.241  -3.776  -2.258
  941   2HD2  LEU1223          1HD2      LEU1223 -11.500  -2.940  -0.893
  942   3HD2  LEU1223          3HD2      LEU1223 -13.252  -3.128  -0.967
  943    H    GLU1224           HN       GLU1224 -15.344  -3.969  -2.839
  944    HA   GLU1224           HA       GLU1224 -17.433  -3.938  -4.919
  945   1HB   GLU1224           HB2      GLU1224 -17.021  -5.954  -2.700
  946   2HB   GLU1224           HB1      GLU1224 -18.345  -5.971  -3.855
  947   1HG   GLU1224           HG2      GLU1224 -15.427  -6.258  -4.537
  948   2HG   GLU1224           HG1      GLU1224 -16.592  -7.577  -4.420
  949    H    TYR1225           HN       TYR1225 -18.577  -2.140  -4.360
  950    HA   TYR1225           HA       TYR1225 -19.358  -1.808  -1.560
  951   1HB   TYR1225           HB2      TYR1225 -20.375   0.396  -2.654
  952   2HB   TYR1225           HB1      TYR1225 -18.683   0.283  -2.182
  953    HD1  TYR1225           HD1      TYR1225 -20.941   0.993  -4.820
  954    HD2  TYR1225           HD2      TYR1225 -17.011  -0.417  -4.026
  955    HE1  TYR1225           HE1      TYR1225 -20.268   1.591  -7.110
  956    HE2  TYR1225           HE2      TYR1225 -16.323   0.172  -6.306
  957    HH   TYR1225           HH       TYR1225 -18.213   2.119  -8.350
  958    HA   PRO1226           HA       PRO1226 -23.330  -3.580  -2.464
  959   1HB   PRO1226           HB2      PRO1226 -24.517  -2.906  -0.112
  960   2HB   PRO1226           HB1      PRO1226 -23.368  -4.240  -0.262
  961   1HG   PRO1226           HG2      PRO1226 -22.896  -1.433   0.683
  962   2HG   PRO1226           HG1      PRO1226 -22.334  -2.958   1.394
  963   1HD   PRO1226           HD2      PRO1226 -20.733  -1.431  -0.129
  964   2HD   PRO1226           HD1      PRO1226 -20.643  -3.204  -0.167
  965    H    THR1227           HN       THR1227 -25.617  -2.385  -1.176
  966    HA   THR1227           HA       THR1227 -25.802   0.341  -2.105
  967    HB   THR1227           HB       THR1227 -27.516  -1.783  -3.405
  968    HG1  THR1227           HG1      THR1227 -26.383  -1.031  -5.318
  969   1HG2  THR1227          1HG2      THR1227 -28.722   0.314  -3.038
  970   2HG2  THR1227          3HG2      THR1227 -27.420   1.209  -3.823
  971   3HG2  THR1227          2HG2      THR1227 -28.393   0.070  -4.753
  972    H    CYS1228           HN       CYS1228 -27.669  -2.492  -1.134
  973    HA   CYS1228           HA       CYS1228 -29.353  -2.803   0.362
  974   1HB   CYS1228           HB2      CYS1228 -28.318  -0.293   1.695
  975   2HB   CYS1228           HB1      CYS1228 -29.237  -1.597   2.442
  976    H    ALA1229           HN       ALA1229 -31.328  -1.576   1.440
  977    HA   ALA1229           HA       ALA1229 -32.183   0.735  -0.049
  978   1HB   ALA1229           HB1      ALA1229 -33.614  -1.879  -0.459
  979   2HB   ALA1229           HB2      ALA1229 -32.610  -1.053  -1.650
  980   3HB   ALA1229           HB3      ALA1229 -34.111  -0.310  -1.095
  981    H    LYS1230           HN       LYS1230 -34.096   1.654   0.630
  982    HA   LYS1230           HA       LYS1230 -35.305   2.549   2.323
  983   1HB   LYS1230           HB2      LYS1230 -37.175   1.082   3.015
  984   2HB   LYS1230           HB1      LYS1230 -36.904   1.101   1.278
  985   1HG   LYS1230           HG2      LYS1230 -35.614  -1.027   1.551
  986   2HG   LYS1230           HG1      LYS1230 -36.170  -1.065   3.225
  987   1HD   LYS1230           HD2      LYS1230 -38.475  -1.139   2.502
  988   2HD   LYS1230           HD1      LYS1230 -37.983  -0.967   0.816
  989   1HE   LYS1230           HE2      LYS1230 -36.794  -3.105   0.951
  990   2HE   LYS1230           HE1      LYS1230 -37.300  -3.277   2.631
  991   1HZ   LYS1230           HZ2      LYS1230 -39.119  -3.149   0.286
  992   2HZ   LYS1230           HZ1      LYS1230 -38.717  -4.548   1.147
  993   3HZ   LYS1230           HZ3      LYS1230 -39.602  -3.316   1.899
  994    H    ARG1231           HN       ARG1231 -34.152   3.182   3.979
  995    HA   ARG1231           HA       ARG1231 -32.940   1.629   5.912
  996   1HB   ARG1231           HB2      ARG1231 -32.262   3.625   6.704
  997   2HB   ARG1231           HB1      ARG1231 -32.950   4.236   5.220
  998   1HG   ARG1231           HG2      ARG1231 -35.009   4.793   6.362
  999   2HG   ARG1231           HG1      ARG1231 -34.371   4.135   7.871
 1000   1HD   ARG1231           HD2      ARG1231 -34.167   6.548   7.869
 1001   2HD   ARG1231           HD1      ARG1231 -32.569   5.803   7.820
 1002    HE   ARG1231           HE       ARG1231 -33.315   6.292   5.193
 1003   1HH1  ARG1231          1HH1      ARG1231 -32.669   8.128   8.084
 1004   2HH1  ARG1231          2HH1      ARG1231 -32.118   9.529   7.226
 1005   1HH2  ARG1231          1HH2      ARG1231 -32.591   8.131   4.056
 1006   2HH2  ARG1231          2HH2      ARG1231 -32.074   9.530   4.937

  No H/Q in entry =        1006
  Start of MODEL    4
    1    H1   GLU1103           HT3      GLU1103  35.858  -9.996   3.276
    2    H2   GLU1103           HT2      GLU1103  37.448 -10.512   3.019
    3    H3   GLU1103           HT1      GLU1103  36.473 -11.310   4.145
    4    HA   GLU1103           HA       GLU1103  36.403  -9.383   5.548
    5   1HB   GLU1103           HB2      GLU1103  39.167 -10.238   4.680
    6   2HB   GLU1103           HB1      GLU1103  38.867  -9.241   6.096
    7   1HG   GLU1103           HG2      GLU1103  39.139 -11.482   6.825
    8   2HG   GLU1103           HG1      GLU1103  37.434 -11.066   6.995
    9    H    ALA1104           HN       ALA1104  38.337  -8.867   2.627
   10    HA   ALA1104           HA       ALA1104  38.597  -6.033   3.181
   11   1HB   ALA1104           HB3      ALA1104  40.464  -7.254   2.172
   12   2HB   ALA1104           HB2      ALA1104  39.463  -7.624   0.768
   13   3HB   ALA1104           HB1      ALA1104  39.900  -5.953   1.123
   14    H    GLU1105           HN       GLU1105  36.145  -7.875   2.078
   15    HA   GLU1105           HA       GLU1105  35.284  -6.226  -0.133
   16   1HB   GLU1105           HB2      GLU1105  34.787  -8.629  -0.111
   17   2HB   GLU1105           HB1      GLU1105  33.846  -8.427   1.361
   18   1HG   GLU1105           HG2      GLU1105  32.397  -8.606  -0.567
   19   2HG   GLU1105           HG1      GLU1105  32.266  -7.006   0.163
   20    H    PHE1106           HN       PHE1106  34.287  -4.347   0.104
   21    HA   PHE1106           HA       PHE1106  32.460  -3.977   2.368
   22   1HB   PHE1106           HB2      PHE1106  33.332  -1.705   2.750
   23   2HB   PHE1106           HB1      PHE1106  34.566  -2.930   3.027
   24    HD1  PHE1106           HD1      PHE1106  36.392  -3.237   1.406
   25    HD2  PHE1106           HD2      PHE1106  33.556  -0.088   1.021
   26    HE1  PHE1106           HE1      PHE1106  37.898  -2.079  -0.157
   27    HE2  PHE1106           HE2      PHE1106  35.056   1.077  -0.545
   28    HZ   PHE1106           HZ       PHE1106  37.229   0.081  -1.135
   29    H    GLY1107           HN       GLY1107  30.768  -2.502   2.009
   30   1HA   GLY1107           HA1      GLY1107  29.554  -2.482  -0.429
   31   2HA   GLY1107           HA2      GLY1107  30.555  -1.039  -0.437
   32    H    LYS1108           HN       LYS1108  30.268   0.431   1.482
   33    HA   LYS1108           HA       LYS1108  28.144   0.405   3.224
   34   1HB   LYS1108           HB2      LYS1108  29.267   2.825   1.800
   35   2HB   LYS1108           HB1      LYS1108  28.305   2.855   3.272
   36   1HG   LYS1108           HG2      LYS1108  30.870   1.323   3.159
   37   2HG   LYS1108           HG1      LYS1108  30.864   3.064   3.447
   38   1HD   LYS1108           HD2      LYS1108  29.395   2.739   5.378
   39   2HD   LYS1108           HD1      LYS1108  29.398   0.999   5.088
   40   1HE   LYS1108           HE2      LYS1108  31.808   2.687   5.749
   41   2HE   LYS1108           HE1      LYS1108  30.963   1.611   6.862
   42   1HZ   LYS1108           HZ3      LYS1108  32.359   0.770   4.379
   43   2HZ   LYS1108           HZ2      LYS1108  32.945   0.571   5.953
   44   3HZ   LYS1108           HZ1      LYS1108  31.557  -0.259   5.457
   45    H    CYS1109           HN       CYS1109  26.021   0.381   2.979
   46    HA   CYS1109           HA       CYS1109  24.796   0.511   0.436
   47   1HB   CYS1109           HB2      CYS1109  23.444   0.767   3.128
   48   2HB   CYS1109           HB1      CYS1109  22.695   0.287   1.609
   49    H    GLY1110           HN       GLY1110  24.220   2.208  -0.720
   50   1HA   GLY1110           HA1      GLY1110  24.446   4.590  -1.067
   51   2HA   GLY1110           HA2      GLY1110  24.043   4.825   0.629
   52    HA   PRO1111           HA       PRO1111  20.021   6.040  -0.886
   53   1HB   PRO1111           HB2      PRO1111  20.854   6.594  -3.697
   54   2HB   PRO1111           HB1      PRO1111  19.895   7.583  -2.589
   55   1HG   PRO1111           HG2      PRO1111  22.444   8.181  -3.074
   56   2HG   PRO1111           HG1      PRO1111  21.769   8.343  -1.442
   57   1HD   PRO1111           HD2      PRO1111  23.577   6.242  -2.550
   58   2HD   PRO1111           HD1      PRO1111  23.526   6.943  -0.920
   59    HA   PRO1112           HA       PRO1112  19.026   2.080  -2.794
   60   1HB   PRO1112           HB2      PRO1112  16.548   2.124  -1.357
   61   2HB   PRO1112           HB1      PRO1112  17.987   1.164  -1.014
   62   1HG   PRO1112           HG2      PRO1112  17.034   3.201   0.589
   63   2HG   PRO1112           HG1      PRO1112  18.699   2.600   0.600
   64   1HD   PRO1112           HD2      PRO1112  17.563   5.027  -0.718
   65   2HD   PRO1112           HD1      PRO1112  19.131   4.806   0.088
   66    HA   PRO1113           HA       PRO1113  16.590   4.134  -6.065
   67   1HB   PRO1113           HB2      PRO1113  16.764   1.328  -7.064
   68   2HB   PRO1113           HB1      PRO1113  17.042   2.847  -7.924
   69   1HG   PRO1113           HG2      PRO1113  19.090   1.329  -7.157
   70   2HG   PRO1113           HG1      PRO1113  19.181   3.098  -7.058
   71   1HD   PRO1113           HD2      PRO1113  18.792   1.094  -4.884
   72   2HD   PRO1113           HD1      PRO1113  19.661   2.641  -4.853
   73    HA   PRO1114           HA       PRO1114  12.847   2.252  -4.314
   74   1HB   PRO1114           HB2      PRO1114  11.388   4.452  -4.129
   75   2HB   PRO1114           HB1      PRO1114  12.780   4.221  -3.061
   76   1HG   PRO1114           HG2      PRO1114  12.557   5.857  -5.560
   77   2HG   PRO1114           HG1      PRO1114  13.316   6.282  -4.016
   78   1HD   PRO1114           HD2      PRO1114  14.671   5.331  -6.238
   79   2HD   PRO1114           HD1      PRO1114  15.273   5.242  -4.571
   80    H    ILE1115           HN       ILE1115  10.421   2.701  -4.943
   81    HA   ILE1115           HA       ILE1115  10.240   2.432  -7.854
   82    HB   ILE1115           HB       ILE1115   7.994   1.497  -7.400
   83   1HG1  ILE1115          2HG1      ILE1115   7.839   2.794  -5.168
   84   2HG1  ILE1115          1HG1      ILE1115   7.139   1.189  -5.249
   85   1HG2  ILE1115          1HG2      ILE1115  10.268   0.179  -5.931
   86   2HG2  ILE1115          3HG2      ILE1115   8.762  -0.616  -6.391
   87   3HG2  ILE1115          2HG2      ILE1115   9.854  -0.010  -7.636
   88   1HD1  ILE1115          2HD1      ILE1115   9.808   1.863  -4.057
   89   2HD1  ILE1115          1HD1      ILE1115   8.322   1.537  -3.164
   90   3HD1  ILE1115          3HD1      ILE1115   9.072   0.261  -4.121
   91    H    ASP1116           HN       ASP1116   7.639   3.034  -8.295
   92    HA   ASP1116           HA       ASP1116   7.641   5.868  -8.349
   93   1HB   ASP1116           HB2      ASP1116   6.477   4.537 -10.054
   94   2HB   ASP1116           HB1      ASP1116   5.363   3.930  -8.834
   95    H    ASN1117           HN       ASN1117   7.674   6.840  -6.385
   96    HA   ASN1117           HA       ASN1117   6.738   7.821  -4.541
   97   1HB   ASN1117           HB2      ASN1117   4.411   5.939  -5.006
   98   2HB   ASN1117           HB1      ASN1117   4.443   7.262  -3.838
   99   1HD2  ASN1117          1HD2      ASN1117   2.726   6.754  -6.186
  100   2HD2  ASN1117          2HD2      ASN1117   2.858   8.174  -7.161
  101    H    GLY1118           HN       GLY1118   8.556   5.608  -4.482
  102   1HA   GLY1118           HA1      GLY1118   8.998   3.648  -3.165
  103   2HA   GLY1118           HA2      GLY1118   7.689   4.119  -2.093
  104    H    ASP1119           HN       ASP1119   9.686   3.499  -0.653
  105    HA   ASP1119           HA       ASP1119  11.843   5.243  -0.332
  106   1HB   ASP1119           HB2      ASP1119   9.978   6.878   0.145
  107   2HB   ASP1119           HB1      ASP1119   9.597   5.920   1.571
  108    H    ILE1120           HN       ILE1120  12.830   5.088   1.896
  109    HA   ILE1120           HA       ILE1120  13.077   2.388   2.642
  110    HB   ILE1120           HB       ILE1120  13.859   4.265   4.729
  111   1HG1  ILE1120          2HG1      ILE1120  15.043   4.635   1.969
  112   2HG1  ILE1120          1HG1      ILE1120  13.974   5.782   2.765
  113   1HG2  ILE1120          3HG2      ILE1120  15.372   2.354   2.960
  114   2HG2  ILE1120          2HG2      ILE1120  16.032   3.165   4.381
  115   3HG2  ILE1120          1HG2      ILE1120  14.716   2.004   4.558
  116   1HD1  ILE1120          2HD1      ILE1120  15.637   6.076   4.540
  117   2HD1  ILE1120          1HD1      ILE1120  16.713   4.961   3.696
  118   3HD1  ILE1120          3HD1      ILE1120  16.270   6.496   2.949
  119    H    THR1121           HN       THR1121  10.720   4.605   3.348
  120    HA   THR1121           HA       THR1121   8.824   4.518   4.594
  121    HB   THR1121           HB       THR1121   8.063   2.554   5.603
  122    HG1  THR1121           HG1      THR1121   9.549   0.869   6.242
  123   1HG2  THR1121          3HG2      THR1121   8.385   2.251   3.199
  124   2HG2  THR1121          2HG2      THR1121  10.019   1.655   3.483
  125   3HG2  THR1121          1HG2      THR1121   8.631   0.733   4.060
  126    H    SER1122           HN       SER1122  11.530   5.490   5.505
  127    HA   SER1122           HA       SER1122  10.708   6.052   8.247
  128   1HB   SER1122           HB2      SER1122  12.232   4.124   8.440
  129   2HB   SER1122           HB1      SER1122  13.472   5.020   7.565
  130    HG   SER1122           HG       SER1122  12.803   5.127  10.184
  131    H    PHE1123           HN       PHE1123  13.905   6.596   6.925
  132    HA   PHE1123           HA       PHE1123  13.372   9.243   5.973
  133   1HB   PHE1123           HB2      PHE1123  13.343   9.546   8.453
  134   2HB   PHE1123           HB1      PHE1123  15.001   8.963   8.504
  135    HD1  PHE1123           HD1      PHE1123  16.825  10.358   7.897
  136    HD2  PHE1123           HD2      PHE1123  12.822  11.701   7.372
  137    HE1  PHE1123           HE1      PHE1123  17.647  12.643   7.501
  138    HE2  PHE1123           HE2      PHE1123  13.636  13.988   6.974
  139    HZ   PHE1123           HZ       PHE1123  16.052  14.461   7.038
  140    HA   PRO1124           HA       PRO1124  16.817   8.158   3.393
  141   1HB   PRO1124           HB2      PRO1124  17.445  11.062   3.747
  142   2HB   PRO1124           HB1      PRO1124  17.406  10.094   2.269
  143   1HG   PRO1124           HG2      PRO1124  15.391  11.728   2.874
  144   2HG   PRO1124           HG1      PRO1124  15.089  10.142   2.142
  145   1HD   PRO1124           HD2      PRO1124  14.652  11.051   4.937
  146   2HD   PRO1124           HD1      PRO1124  13.782   9.821   3.999
  147    H    LEU1125           HN       LEU1125  18.279   6.963   4.509
  148    HA   LEU1125           HA       LEU1125  19.844   8.178   6.628
  149   1HB   LEU1125           HB2      LEU1125  19.637   5.374   5.595
  150   2HB   LEU1125           HB1      LEU1125  20.835   5.836   6.788
  151    HG   LEU1125           HG       LEU1125  18.584   6.750   7.991
  152   1HD1  LEU1125          2HD1      LEU1125  17.207   5.829   6.113
  153   2HD1  LEU1125          1HD1      LEU1125  17.730   4.217   6.602
  154   3HD1  LEU1125          3HD1      LEU1125  16.783   5.209   7.711
  155   1HD2  LEU1125          2HD2      LEU1125  19.668   3.939   8.118
  156   2HD2  LEU1125          1HD2      LEU1125  20.292   5.333   9.000
  157   3HD2  LEU1125          3HD2      LEU1125  18.675   4.720   9.349
  158    H    SER1126           HN       SER1126  20.150   7.127   3.394
  159    HA   SER1126           HA       SER1126  21.788   7.270   1.823
  160   1HB   SER1126           HB2      SER1126  21.824   9.623   2.514
  161   2HB   SER1126           HB1      SER1126  22.993   9.237   3.775
  162    HG   SER1126           HG       SER1126  23.407   9.708   1.145
  163    H    VAL1127           HN       VAL1127  22.215   5.959   4.772
  164    HA   VAL1127           HA       VAL1127  24.418   4.341   3.942
  165    HB   VAL1127           HB       VAL1127  25.643   6.287   4.782
  166   1HG1  VAL1127          3HG1      VAL1127  24.006   7.148   6.354
  167   2HG1  VAL1127          2HG1      VAL1127  24.242   5.744   7.393
  168   3HG1  VAL1127          1HG1      VAL1127  25.557   6.894   7.153
  169   1HG2  VAL1127          1HG2      VAL1127  25.831   3.870   6.574
  170   2HG2  VAL1127          3HG2      VAL1127  26.647   4.091   5.026
  171   3HG2  VAL1127          2HG2      VAL1127  27.073   5.111   6.401
  172    H    TYR1128           HN       TYR1128  23.975   2.361   4.646
  173    HA   TYR1128           HA       TYR1128  22.627   2.032   7.234
  174   1HB   TYR1128           HB2      TYR1128  21.909   0.216   4.961
  175   2HB   TYR1128           HB1      TYR1128  20.978   0.614   6.399
  176    HD1  TYR1128           HD1      TYR1128  19.203   2.091   6.223
  177    HD2  TYR1128           HD2      TYR1128  22.251   2.177   3.256
  178    HE1  TYR1128           HE1      TYR1128  17.890   3.715   4.926
  179    HE2  TYR1128           HE2      TYR1128  20.947   3.804   1.954
  180    HH   TYR1128           HH       TYR1128  18.676   4.563   1.704
  181    H    ALA1129           HN       ALA1129  25.375   1.713   6.151
  182    HA   ALA1129           HA       ALA1129  27.159   0.310   6.363
  183   1HB   ALA1129           HB1      ALA1129  26.219   0.052   8.640
  184   2HB   ALA1129           HB2      ALA1129  27.083  -1.379   8.076
  185   3HB   ALA1129           HB3      ALA1129  25.319  -1.355   8.075
  186    HA   PRO1130           HA       PRO1130  26.792  -2.430   2.917
  187   1HB   PRO1130           HB2      PRO1130  28.905  -3.990   4.328
  188   2HB   PRO1130           HB1      PRO1130  28.855  -3.417   2.658
  189   1HG   PRO1130           HG2      PRO1130  30.363  -2.187   4.481
  190   2HG   PRO1130           HG1      PRO1130  29.497  -1.267   3.237
  191   1HD   PRO1130           HD2      PRO1130  28.888  -1.578   6.134
  192   2HD   PRO1130           HD1      PRO1130  28.611  -0.191   5.063
  193    H    ALA1131           HN       ALA1131  25.791  -4.320   2.381
  194    HA   ALA1131           HA       ALA1131  24.600  -6.243   2.586
  195   1HB   ALA1131           HB2      ALA1131  26.654  -7.147   3.567
  196   2HB   ALA1131           HB3      ALA1131  25.213  -7.853   4.299
  197   3HB   ALA1131           HB1      ALA1131  26.124  -6.612   5.162
  198    H    SER1132           HN       SER1132  23.477  -3.787   3.536
  199    HA   SER1132           HA       SER1132  21.894  -4.617   5.862
  200   1HB   SER1132           HB2      SER1132  23.006  -2.317   5.719
  201   2HB   SER1132           HB1      SER1132  21.783  -1.932   4.505
  202    HG   SER1132           HG       SER1132  21.486  -2.391   7.248
  203    H    SER1133           HN       SER1133  19.533  -3.843   5.762
  204    HA   SER1133           HA       SER1133  18.300  -3.848   3.163
  205   1HB   SER1133           HB2      SER1133  17.452  -6.113   4.942
  206   2HB   SER1133           HB1      SER1133  17.215  -5.908   3.208
  207    HG   SER1133           HG       SER1133  19.464  -6.245   2.943
  208    H    VAL1134           HN       VAL1134  16.160  -3.162   3.207
  209    HA   VAL1134           HA       VAL1134  15.026  -2.575   5.859
  210    HB   VAL1134           HB       VAL1134  14.080  -0.453   4.862
  211   1HG1  VAL1134          3HG1      VAL1134  15.922  -0.463   6.480
  212   2HG1  VAL1134          2HG1      VAL1134  17.075  -0.554   5.148
  213   3HG1  VAL1134          1HG1      VAL1134  16.043   0.867   5.328
  214   1HG2  VAL1134          1HG2      VAL1134  14.472  -0.983   2.527
  215   2HG2  VAL1134          3HG2      VAL1134  15.261   0.530   2.973
  216   3HG2  VAL1134          2HG2      VAL1134  16.215  -0.944   2.798
  217    H    GLU1135           HN       GLU1135  12.705  -1.971   5.713
  218    HA   GLU1135           HA       GLU1135  11.341  -3.789   3.880
  219   1HB   GLU1135           HB2      GLU1135  10.409  -2.412   6.408
  220   2HB   GLU1135           HB1      GLU1135   9.424  -3.486   5.432
  221   1HG   GLU1135           HG2      GLU1135  10.948  -5.325   5.882
  222   2HG   GLU1135           HG1      GLU1135  11.970  -4.250   6.835
  223    H    TYR1136           HN       TYR1136  11.893  -2.074   2.233
  224    HA   TYR1136           HA       TYR1136  10.922   0.480   2.135
  225   1HB   TYR1136           HB2      TYR1136  11.854  -1.469   0.240
  226   2HB   TYR1136           HB1      TYR1136  10.505  -0.569  -0.447
  227    HD1  TYR1136           HD1      TYR1136  13.642   0.078   1.480
  228    HD2  TYR1136           HD2      TYR1136  10.989   1.374  -1.577
  229    HE1  TYR1136           HE1      TYR1136  15.154   1.950   0.973
  230    HE2  TYR1136           HE2      TYR1136  12.491   3.246  -2.092
  231    HH   TYR1136           HH       TYR1136  15.660   3.453  -0.900
  232    H    GLN1137           HN       GLN1137   9.131   1.351   0.813
  233    HA   GLN1137           HA       GLN1137   6.806  -0.135   0.252
  234   1HB   GLN1137           HB2      GLN1137   6.839  -0.156   2.809
  235   2HB   GLN1137           HB1      GLN1137   6.523   1.571   2.726
  236   1HG   GLN1137           HG2      GLN1137   4.448   1.136   1.517
  237   2HG   GLN1137           HG1      GLN1137   4.766  -0.596   1.595
  238   1HE2  GLN1137          1HE2      GLN1137   2.525   0.956   2.646
  239   2HE2  GLN1137          2HE2      GLN1137   2.473   0.630   4.341
  240    H    CYS1138           HN       CYS1138   4.848   1.496   0.075
  241    HA   CYS1138           HA       CYS1138   5.941   3.903  -1.205
  242   1HB   CYS1138           HB2      CYS1138   3.262   2.620  -1.735
  243   2HB   CYS1138           HB1      CYS1138   4.074   3.852  -2.698
  244    H    GLN1139           HN       GLN1139   5.050   5.896  -0.842
  245    HA   GLN1139           HA       GLN1139   3.726   6.244   1.691
  246   1HB   GLN1139           HB2      GLN1139   4.536   8.267  -0.406
  247   2HB   GLN1139           HB1      GLN1139   3.976   8.651   1.216
  248   1HG   GLN1139           HG2      GLN1139   5.907   7.723   2.207
  249   2HG   GLN1139           HG1      GLN1139   6.402   6.962   0.695
  250   1HE2  GLN1139          1HE2      GLN1139   5.135  10.194   0.772
  251   2HE2  GLN1139          2HE2      GLN1139   6.620  11.002   0.426
  252    H    ASN1140           HN       ASN1140   2.146   8.433   1.318
  253    HA   ASN1140           HA       ASN1140  -0.053   8.924   1.015
  254   1HB   ASN1140           HB2      ASN1140   1.188   9.332  -1.243
  255   2HB   ASN1140           HB1      ASN1140   0.229   7.967  -1.806
  256   1HD2  ASN1140          1HD2      ASN1140  -2.012   8.651  -0.036
  257   2HD2  ASN1140          2HD2      ASN1140  -2.791  10.004  -0.774
  258    H    LEU1141           HN       LEU1141   0.168   6.449   2.161
  259    HA   LEU1141           HA       LEU1141  -1.145   4.672   2.711
  260   1HB   LEU1141           HB2      LEU1141  -3.012   5.597   0.534
  261   2HB   LEU1141           HB1      LEU1141  -3.393   4.514   1.859
  262    HG   LEU1141           HG       LEU1141  -2.580   7.389   2.268
  263   1HD1  LEU1141          1HD1      LEU1141  -5.350   6.214   2.088
  264   2HD1  LEU1141          3HD1      LEU1141  -4.961   7.860   2.590
  265   3HD1  LEU1141          2HD1      LEU1141  -4.614   7.335   0.942
  266   1HD2  LEU1141          1HD2      LEU1141  -3.930   5.378   4.062
  267   2HD2  LEU1141          3HD2      LEU1141  -2.263   5.937   4.195
  268   3HD2  LEU1141          2HD2      LEU1141  -3.594   7.061   4.469
  269    H    TYR1142           HN       TYR1142  -0.037   5.133  -0.506
  270    HA   TYR1142           HA       TYR1142  -0.840   2.851  -1.818
  271   1HB   TYR1142           HB2      TYR1142   1.792   4.321  -1.927
  272   2HB   TYR1142           HB1      TYR1142   1.407   2.984  -3.004
  273    HD1  TYR1142           HD1      TYR1142  -0.940   3.245  -4.242
  274    HD2  TYR1142           HD2      TYR1142   1.368   6.461  -2.681
  275    HE1  TYR1142           HE1      TYR1142  -2.074   4.796  -5.777
  276    HE2  TYR1142           HE2      TYR1142   0.240   8.021  -4.210
  277    HH   TYR1142           HH       TYR1142  -2.563   7.199  -5.938
  278    H    GLN1143           HN       GLN1143  -0.637   0.765  -1.436
  279    HA   GLN1143           HA       GLN1143   1.287  -0.127   0.576
  280   1HB   GLN1143           HB2      GLN1143  -1.014  -0.803   0.936
  281   2HB   GLN1143           HB1      GLN1143  -1.093  -1.510  -0.672
  282   1HG   GLN1143           HG2      GLN1143  -0.850  -3.230   1.009
  283   2HG   GLN1143           HG1      GLN1143   0.573  -3.173  -0.029
  284   1HE2  GLN1143          1HE2      GLN1143   2.521  -2.428   0.804
  285   2HE2  GLN1143          2HE2      GLN1143   2.802  -2.292   2.502
  286    H    LEU1144           HN       LEU1144   3.223  -0.520  -0.308
  287    HA   LEU1144           HA       LEU1144   3.760  -1.257  -2.932
  288   1HB   LEU1144           HB2      LEU1144   5.398  -0.386  -1.255
  289   2HB   LEU1144           HB1      LEU1144   5.410  -1.971  -0.509
  290    HG   LEU1144           HG       LEU1144   6.155  -1.604  -3.400
  291   1HD1  LEU1144          2HD1      LEU1144   7.979  -1.431  -1.008
  292   2HD1  LEU1144          1HD1      LEU1144   8.495  -1.505  -2.692
  293   3HD1  LEU1144          3HD1      LEU1144   7.581  -0.114  -2.110
  294   1HD2  LEU1144          2HD2      LEU1144   6.742  -3.710  -1.327
  295   2HD2  LEU1144          1HD2      LEU1144   5.720  -3.874  -2.755
  296   3HD2  LEU1144          3HD2      LEU1144   7.462  -3.664  -2.937
  297    H    GLU1145           HN       GLU1145   3.204  -3.021  -3.998
  298    HA   GLU1145           HA       GLU1145   2.701  -5.506  -2.555
  299   1HB   GLU1145           HB2      GLU1145   1.040  -4.697  -4.213
  300   2HB   GLU1145           HB1      GLU1145   2.255  -4.849  -5.475
  301   1HG   GLU1145           HG2      GLU1145   2.404  -7.285  -4.907
  302   2HG   GLU1145           HG1      GLU1145   1.012  -7.051  -3.851
  303    H    GLY1146           HN       GLY1146   4.033  -7.204  -2.596
  304   1HA   GLY1146           HA1      GLY1146   6.238  -7.198  -4.561
  305   2HA   GLY1146           HA2      GLY1146   5.529  -8.653  -3.876
  306    H    ASN1147           HN       ASN1147   8.236  -8.356  -3.792
  307    HA   ASN1147           HA       ASN1147   8.741  -8.515  -0.993
  308   1HB   ASN1147           HB2      ASN1147  11.116  -8.862  -1.684
  309   2HB   ASN1147           HB1      ASN1147   9.982  -9.955  -2.473
  310   1HD2  ASN1147          1HD2      ASN1147  12.260  -7.418  -2.883
  311   2HD2  ASN1147          2HD2      ASN1147  12.233  -7.375  -4.610
  312    H    LYS1148           HN       LYS1148   8.170  -6.463  -0.206
  313    HA   LYS1148           HA       LYS1148   9.384  -4.061  -1.126
  314   1HB   LYS1148           HB2      LYS1148   8.520  -3.194   1.131
  315   2HB   LYS1148           HB1      LYS1148   7.344  -3.752  -0.051
  316   1HG   LYS1148           HG2      LYS1148   6.635  -4.613   2.011
  317   2HG   LYS1148           HG1      LYS1148   7.380  -5.971   1.167
  318   1HD   LYS1148           HD2      LYS1148   9.445  -5.627   2.442
  319   2HD   LYS1148           HD1      LYS1148   8.691  -4.278   3.295
  320   1HE   LYS1148           HE2      LYS1148   6.996  -5.798   4.195
  321   2HE   LYS1148           HE1      LYS1148   7.755  -7.145   3.347
  322   1HZ   LYS1148           HZ3      LYS1148   9.763  -6.776   4.654
  323   2HZ   LYS1148           HZ2      LYS1148   9.011  -5.506   5.480
  324   3HZ   LYS1148           HZ1      LYS1148   8.433  -7.085   5.654
  325    H    ARG1149           HN       ARG1149  10.558  -6.623   0.733
  326    HA   ARG1149           HA       ARG1149  12.429  -5.032   2.276
  327   1HB   ARG1149           HB2      ARG1149  11.515  -7.078   3.258
  328   2HB   ARG1149           HB1      ARG1149  12.180  -8.029   1.938
  329   1HG   ARG1149           HG2      ARG1149  13.664  -8.351   3.706
  330   2HG   ARG1149           HG1      ARG1149  14.456  -7.154   2.680
  331   1HD   ARG1149           HD2      ARG1149  13.673  -5.366   4.139
  332   2HD   ARG1149           HD1      ARG1149  12.849  -6.546   5.157
  333    HE   ARG1149           HE       ARG1149  15.564  -7.236   4.972
  334   1HH1  ARG1149          1HH1      ARG1149  13.511  -4.785   6.358
  335   2HH1  ARG1149          2HH1      ARG1149  14.586  -4.446   7.673
  336   1HH2  ARG1149          1HH2      ARG1149  16.984  -6.797   6.700
  337   2HH2  ARG1149          2HH2      ARG1149  16.560  -5.588   7.868
  338    H    ILE1150           HN       ILE1150  13.930  -4.054   1.026
  339    HA   ILE1150           HA       ILE1150  15.253  -5.658  -1.049
  340    HB   ILE1150           HB       ILE1150  16.088  -3.562  -1.969
  341   1HG1  ILE1150          2HG1      ILE1150  14.462  -2.190   0.183
  342   2HG1  ILE1150          1HG1      ILE1150  16.217  -2.338   0.209
  343   1HG2  ILE1150          3HG2      ILE1150  13.119  -3.546  -1.444
  344   2HG2  ILE1150          2HG2      ILE1150  13.937  -2.634  -2.713
  345   3HG2  ILE1150          1HG2      ILE1150  13.950  -4.398  -2.747
  346   1HD1  ILE1150          3HD1      ILE1150  14.600  -0.893  -1.876
  347   2HD1  ILE1150          2HD1      ILE1150  15.529  -0.150  -0.575
  348   3HD1  ILE1150          1HD1      ILE1150  16.358  -1.042  -1.851
  349    H    THR1151           HN       THR1151  17.599  -5.244  -1.355
  350    HA   THR1151           HA       THR1151  19.035  -4.707   1.143
  351    HB   THR1151           HB       THR1151  19.438  -7.181  -0.555
  352    HG1  THR1151           HG1      THR1151  18.986  -7.896   1.882
  353   1HG2  THR1151          2HG2      THR1151  21.552  -6.291   0.330
  354   2HG2  THR1151          1HG2      THR1151  20.871  -6.306   1.957
  355   3HG2  THR1151          3HG2      THR1151  21.121  -7.822   1.090
  356    H    CYS1152           HN       CYS1152  21.166  -3.979   0.857
  357    HA   CYS1152           HA       CYS1152  21.702  -2.946  -1.808
  358   1HB   CYS1152           HB2      CYS1152  22.825  -1.256  -0.814
  359   2HB   CYS1152           HB1      CYS1152  21.941  -1.772   0.618
  360    H    ARG1153           HN       ARG1153  23.254  -3.611  -3.100
  361    HA   ARG1153           HA       ARG1153  25.192  -5.574  -2.078
  362   1HB   ARG1153           HB2      ARG1153  25.284  -6.280  -4.562
  363   2HB   ARG1153           HB1      ARG1153  23.922  -6.812  -3.589
  364   1HG   ARG1153           HG2      ARG1153  23.658  -4.288  -5.134
  365   2HG   ARG1153           HG1      ARG1153  23.573  -5.828  -5.993
  366   1HD   ARG1153           HD2      ARG1153  21.860  -4.993  -3.654
  367   2HD   ARG1153           HD1      ARG1153  21.351  -5.063  -5.341
  368    HE   ARG1153           HE       ARG1153  22.325  -7.580  -4.606
  369   1HH1  ARG1153          1HH1      ARG1153  19.648  -5.464  -3.902
  370   2HH1  ARG1153          2HH1      ARG1153  18.559  -6.756  -3.526
  371   1HH2  ARG1153          1HH2      ARG1153  20.897  -9.287  -4.112
  372   2HH2  ARG1153          2HH2      ARG1153  19.268  -8.929  -3.644
  373    H    ASN1154           HN       ASN1154  26.984  -4.452  -1.751
  374    HA   ASN1154           HA       ASN1154  28.802  -3.125  -2.099
  375   1HB   ASN1154           HB2      ASN1154  28.015  -3.337  -5.020
  376   2HB   ASN1154           HB1      ASN1154  29.577  -2.802  -4.407
  377   1HD2  ASN1154          1HD2      ASN1154  28.891  -5.031  -6.169
  378   2HD2  ASN1154          2HD2      ASN1154  29.520  -6.448  -5.405
  379    H    GLY1155           HN       GLY1155  26.046  -2.080  -1.754
  380   1HA   GLY1155           HA1      GLY1155  26.638   0.706  -2.322
  381   2HA   GLY1155           HA2      GLY1155  25.304   0.097  -1.344
  382    H    GLN1156           HN       GLN1156  25.064  -1.763  -3.939
  383    HA   GLN1156           HA       GLN1156  23.564   0.172  -5.552
  384   1HB   GLN1156           HB2      GLN1156  24.953  -2.407  -6.174
  385   2HB   GLN1156           HB1      GLN1156  23.668  -1.826  -7.216
  386   1HG   GLN1156           HG2      GLN1156  26.195  -0.342  -6.538
  387   2HG   GLN1156           HG1      GLN1156  25.860  -1.182  -8.051
  388   1HE2  GLN1156          1HE2      GLN1156  24.387  -0.301  -9.503
  389   2HE2  GLN1156          2HE2      GLN1156  23.879   1.348  -9.409
  390    H    TRP1157           HN       TRP1157  21.898  -0.063  -3.796
  391    HA   TRP1157           HA       TRP1157  20.465  -2.303  -3.162
  392   1HB   TRP1157           HB2      TRP1157  19.471   0.506  -3.626
  393   2HB   TRP1157           HB1      TRP1157  18.496  -0.765  -2.899
  394    HD1  TRP1157           HD1      TRP1157  21.632   1.342  -2.190
  395    HE1  TRP1157           HE1      TRP1157  22.001   1.392   0.352
  396    HE3  TRP1157           HE3      TRP1157  17.998  -1.958  -0.807
  397    HZ2  TRP1157           HZ2      TRP1157  20.872   0.170   2.662
  398    HZ3  TRP1157           HZ3      TRP1157  17.702  -2.471   1.577
  399    HH2  TRP1157           HH2      TRP1157  19.109  -1.435   3.271
  400    H    SER1158           HN       SER1158  18.306  -2.968  -3.821
  401    HA   SER1158           HA       SER1158  17.985  -2.892  -6.745
  402   1HB   SER1158           HB2      SER1158  17.237  -4.997  -4.711
  403   2HB   SER1158           HB1      SER1158  16.650  -5.018  -6.373
  404    HG   SER1158           HG       SER1158  18.738  -5.253  -7.096
  405    H    GLU1159           HN       GLU1159  16.297  -1.814  -7.498
  406    HA   GLU1159           HA       GLU1159  14.475  -0.410  -5.976
  407   1HB   GLU1159           HB2      GLU1159  14.927   0.080  -8.330
  408   2HB   GLU1159           HB1      GLU1159  14.137  -1.416  -8.805
  409   1HG   GLU1159           HG2      GLU1159  12.021  -0.584  -7.913
  410   2HG   GLU1159           HG1      GLU1159  12.813   0.920  -7.445
  411    HA   PRO1160           HA       PRO1160  11.700  -3.492  -4.380
  412   1HB   PRO1160           HB2      PRO1160   9.764  -1.238  -4.389
  413   2HB   PRO1160           HB1      PRO1160  10.247  -2.302  -3.063
  414   1HG   PRO1160           HG2      PRO1160  11.112   0.208  -3.169
  415   2HG   PRO1160           HG1      PRO1160  12.182  -1.099  -2.629
  416   1HD   PRO1160           HD2      PRO1160  12.102   0.325  -5.261
  417   2HD   PRO1160           HD1      PRO1160  13.500  -0.236  -4.319
  418    HA   PRO1161           HA       PRO1161   9.027  -4.884  -7.595
  419   1HB   PRO1161           HB2      PRO1161   6.717  -4.962  -5.744
  420   2HB   PRO1161           HB1      PRO1161   7.459  -6.266  -6.676
  421   1HG   PRO1161           HG2      PRO1161   7.803  -6.100  -4.035
  422   2HG   PRO1161           HG1      PRO1161   9.120  -6.625  -5.101
  423   1HD   PRO1161           HD2      PRO1161   8.679  -3.965  -3.799
  424   2HD   PRO1161           HD1      PRO1161  10.187  -4.878  -4.015
  425    H    LYS1162           HN       LYS1162   6.154  -3.657  -6.059
  426    HA   LYS1162           HA       LYS1162   6.178  -1.197  -7.583
  427   1HB   LYS1162           HB2      LYS1162   3.943  -1.884  -8.597
  428   2HB   LYS1162           HB1      LYS1162   5.398  -2.566  -9.297
  429   1HG   LYS1162           HG2      LYS1162   5.024  -4.616  -7.979
  430   2HG   LYS1162           HG1      LYS1162   3.510  -3.924  -7.389
  431   1HD   LYS1162           HD2      LYS1162   2.633  -3.829  -9.642
  432   2HD   LYS1162           HD1      LYS1162   4.170  -4.402 -10.294
  433   1HE   LYS1162           HE2      LYS1162   3.891  -6.514  -9.092
  434   2HE   LYS1162           HE1      LYS1162   2.357  -5.941  -8.439
  435   1HZ   LYS1162           HZ1      LYS1162   2.960  -6.358 -11.317
  436   2HZ   LYS1162           HZ3      LYS1162   2.025  -7.382 -10.346
  437   3HZ   LYS1162           HZ2      LYS1162   1.486  -5.815 -10.688
  438    H    CYS1163           HN       CYS1163   4.168   0.082  -7.245
  439    HA   CYS1163           HA       CYS1163   3.294  -0.158  -4.472
  440   1HB   CYS1163           HB2      CYS1163   2.934   2.058  -6.500
  441   2HB   CYS1163           HB1      CYS1163   2.387   2.127  -4.827
  442    H    LEU1164           HN       LEU1164   1.505  -1.266  -4.070
  443    HA   LEU1164           HA       LEU1164  -0.561  -1.548  -6.099
  444   1HB   LEU1164           HB2      LEU1164   0.434  -3.338  -4.396
  445   2HB   LEU1164           HB1      LEU1164  -0.836  -2.701  -3.370
  446    HG   LEU1164           HG       LEU1164  -2.486  -3.253  -5.145
  447   1HD1  LEU1164          1HD1      LEU1164  -0.964  -3.187  -7.055
  448   2HD1  LEU1164          3HD1      LEU1164  -0.132  -4.616  -6.442
  449   3HD1  LEU1164          2HD1      LEU1164  -1.813  -4.731  -6.964
  450   1HD2  LEU1164          3HD2      LEU1164  -0.796  -5.536  -4.144
  451   2HD2  LEU1164          2HD2      LEU1164  -2.129  -4.766  -3.284
  452   3HD2  LEU1164          1HD2      LEU1164  -2.441  -5.674  -4.764
  453    H    HIS1165           HN       HIS1165  -1.987   0.059  -6.235
  454    HA   HIS1165           HA       HIS1165  -2.541   2.045  -4.447
  455   1HB   HIS1165           HB2      HIS1165  -4.507   0.744  -6.343
  456   2HB   HIS1165           HB1      HIS1165  -4.709   2.326  -5.598
  457    HD1  HIS1165           HD1      HIS1165  -3.607   4.284  -6.728
  458    HD2  HIS1165           HD2      HIS1165  -2.379   0.632  -8.282
  459    HE1  HIS1165           HE1      HIS1165  -2.263   4.845  -8.778
  460    HE2  HIS1165           HE2      HIS1165  -1.459   2.623  -9.653
  461    HA   PRO1166           HA       PRO1166  -4.382  -0.204  -1.047
  462   1HB   PRO1166           HB2      PRO1166  -5.070   1.995   0.417
  463   2HB   PRO1166           HB1      PRO1166  -3.432   1.337   0.361
  464   1HG   PRO1166           HG2      PRO1166  -4.604   3.634  -1.162
  465   2HG   PRO1166           HG1      PRO1166  -3.032   3.518  -0.351
  466   1HD   PRO1166           HD2      PRO1166  -3.276   3.215  -3.010
  467   2HD   PRO1166           HD1      PRO1166  -2.096   2.281  -2.070
  468    H    CYS1167           HN       CYS1167  -6.483   0.689   0.429
  469    HA   CYS1167           HA       CYS1167  -8.688   0.031  -1.187
  470   1HB   CYS1167           HB2      CYS1167  -8.753   1.422   1.498
  471   2HB   CYS1167           HB1      CYS1167 -10.062   0.510   0.755
  472    H    VAL1168           HN       VAL1168  -8.760   1.438  -2.940
  473    HA   VAL1168           HA       VAL1168  -9.585   4.191  -2.294
  474    HB   VAL1168           HB       VAL1168  -8.315   3.226  -4.861
  475   1HG1  VAL1168          3HG1      VAL1168  -9.861   5.109  -5.146
  476   2HG1  VAL1168          2HG1      VAL1168  -8.976   6.016  -3.922
  477   3HG1  VAL1168          1HG1      VAL1168  -8.189   5.587  -5.441
  478   1HG2  VAL1168          3HG2      VAL1168  -7.141   4.841  -2.599
  479   2HG2  VAL1168          2HG2      VAL1168  -6.709   3.188  -3.037
  480   3HG2  VAL1168          1HG2      VAL1168  -6.351   4.515  -4.142
  481    H    ILE1169           HN       ILE1169 -11.759   3.542  -2.057
  482    HA   ILE1169           HA       ILE1169 -13.077   2.620  -4.516
  483    HB   ILE1169           HB       ILE1169 -13.325   1.669  -1.948
  484   1HG1  ILE1169          2HG1      ILE1169 -15.311   1.515  -4.222
  485   2HG1  ILE1169          1HG1      ILE1169 -13.923   0.460  -3.972
  486   1HG2  ILE1169          2HG2      ILE1169 -14.541   3.676  -1.261
  487   2HG2  ILE1169          1HG2      ILE1169 -15.756   3.358  -2.500
  488   3HG2  ILE1169          3HG2      ILE1169 -15.544   2.229  -1.161
  489   1HD1  ILE1169          2HD1      ILE1169 -14.968  -0.284  -1.838
  490   2HD1  ILE1169          1HD1      ILE1169 -16.400   0.643  -2.280
  491   3HD1  ILE1169          3HD1      ILE1169 -15.880  -0.709  -3.287
  492    H    SER1170           HN       SER1170 -15.276   3.553  -4.914
  493    HA   SER1170           HA       SER1170 -15.069   6.426  -4.919
  494   1HB   SER1170           HB2      SER1170 -15.947   5.258  -6.874
  495   2HB   SER1170           HB1      SER1170 -17.281   4.619  -5.915
  496    HG   SER1170           HG       SER1170 -18.151   6.620  -5.769
  497    H    ARG1171           HN       ARG1171 -16.359   7.930  -3.920
  498    HA   ARG1171           HA       ARG1171 -17.698   7.051  -1.476
  499   1HB   ARG1171           HB2      ARG1171 -17.748   9.450  -0.925
  500   2HB   ARG1171           HB1      ARG1171 -16.123   8.903  -1.315
  501   1HG   ARG1171           HG2      ARG1171 -16.309   9.871  -3.535
  502   2HG   ARG1171           HG1      ARG1171 -17.961  10.383  -3.186
  503   1HD   ARG1171           HD2      ARG1171 -17.128  11.798  -1.365
  504   2HD   ARG1171           HD1      ARG1171 -15.479  11.297  -1.738
  505    HE   ARG1171           HE       ARG1171 -16.495  12.317  -4.082
  506   1HH1  ARG1171          1HH1      ARG1171 -15.956  13.489  -0.845
  507   2HH1  ARG1171          2HH1      ARG1171 -15.699  15.128  -1.344
  508   1HH2  ARG1171          1HH2      ARG1171 -16.159  14.472  -4.746
  509   2HH2  ARG1171          2HH2      ARG1171 -15.815  15.687  -3.561
  510    H    GLU1172           HN       GLU1172 -18.428   8.521  -4.574
  511    HA   GLU1172           HA       GLU1172 -21.124   9.222  -3.917
  512   1HB   GLU1172           HB2      GLU1172 -19.791   8.894  -6.612
  513   2HB   GLU1172           HB1      GLU1172 -21.368   9.624  -6.339
  514   1HG   GLU1172           HG2      GLU1172 -20.323  11.391  -5.016
  515   2HG   GLU1172           HG1      GLU1172 -18.743  10.658  -5.291
  516    H    ILE1173           HN       ILE1173 -20.003   6.350  -3.720
  517    HA   ILE1173           HA       ILE1173 -22.314   5.070  -5.010
  518    HB   ILE1173           HB       ILE1173 -19.547   3.876  -4.821
  519   1HG1  ILE1173          2HG1      ILE1173 -19.810   5.765  -6.454
  520   2HG1  ILE1173          1HG1      ILE1173 -19.348   4.230  -7.185
  521   1HG2  ILE1173          3HG2      ILE1173 -21.330   2.214  -4.682
  522   2HG2  ILE1173          2HG2      ILE1173 -22.046   2.851  -6.163
  523   3HG2  ILE1173          1HG2      ILE1173 -20.458   2.085  -6.210
  524   1HD1  ILE1173          3HD1      ILE1173 -22.114   5.419  -7.152
  525   2HD1  ILE1173          2HD1      ILE1173 -21.007   5.382  -8.526
  526   3HD1  ILE1173          1HD1      ILE1173 -21.663   3.877  -7.881
  527    H    MET1174           HN       MET1174 -20.084   5.239  -2.329
  528    HA   MET1174           HA       MET1174 -21.618   3.177  -0.919
  529   1HB   MET1174           HB2      MET1174 -19.740   3.122   0.681
  530   2HB   MET1174           HB1      MET1174 -19.234   2.750  -0.961
  531   1HG   MET1174           HG2      MET1174 -17.779   4.411  -0.967
  532   2HG   MET1174           HG1      MET1174 -19.001   5.566  -0.442
  533   1HE   MET1174           HE3      MET1174 -19.855   4.057   2.327
  534   2HE   MET1174           HE2      MET1174 -18.866   4.945   3.487
  535   3HE   MET1174           HE1      MET1174 -19.706   5.810   2.200
  536    H    GLU1175           HN       GLU1175 -20.092   6.340  -0.239
  537    HA   GLU1175           HA       GLU1175 -21.817   6.752   2.034
  538   1HB   GLU1175           HB2      GLU1175 -20.486   8.580   2.550
  539   2HB   GLU1175           HB1      GLU1175 -19.344   7.587   1.651
  540   1HG   GLU1175           HG2      GLU1175 -19.561   8.920  -0.286
  541   2HG   GLU1175           HG1      GLU1175 -20.958   9.772   0.368
  542    H    ASN1176           HN       ASN1176 -22.633   6.628  -0.976
  543    HA   ASN1176           HA       ASN1176 -24.256   9.080  -0.993
  544   1HB   ASN1176           HB2      ASN1176 -22.532   8.696  -2.831
  545   2HB   ASN1176           HB1      ASN1176 -23.606   7.419  -3.386
  546   1HD2  ASN1176          1HD2      ASN1176 -24.013   8.453  -5.331
  547   2HD2  ASN1176          2HD2      ASN1176 -25.017   9.856  -5.434
  548    H    TYR1177           HN       TYR1177 -24.367   5.750  -2.316
  549    HA   TYR1177           HA       TYR1177 -27.049   5.638  -2.906
  550   1HB   TYR1177           HB2      TYR1177 -25.212   3.457  -1.911
  551   2HB   TYR1177           HB1      TYR1177 -26.843   3.151  -2.495
  552    HD1  TYR1177           HD1      TYR1177 -25.903   5.733  -4.508
  553    HD2  TYR1177           HD2      TYR1177 -24.903   1.656  -3.806
  554    HE1  TYR1177           HE1      TYR1177 -25.047   5.552  -6.804
  555    HE2  TYR1177           HE2      TYR1177 -24.040   1.465  -6.097
  556    HH   TYR1177           HH       TYR1177 -24.334   2.578  -8.273
  557    H    ASN1178           HN       ASN1178 -25.705   4.085  -0.024
  558    HA   ASN1178           HA       ASN1178 -27.231   5.228   1.931
  559   1HB   ASN1178           HB2      ASN1178 -28.965   3.326   2.211
  560   2HB   ASN1178           HB1      ASN1178 -29.288   4.562   0.995
  561   1HD2  ASN1178          1HD2      ASN1178 -30.673   3.036  -0.020
  562   2HD2  ASN1178          2HD2      ASN1178 -30.022   1.790  -1.022
  563    H    ILE1179           HN       ILE1179 -24.691   3.819   1.374
  564    HA   ILE1179           HA       ILE1179 -24.904   1.761   3.468
  565    HB   ILE1179           HB       ILE1179 -23.185   0.482   2.452
  566   1HG1  ILE1179          2HG1      ILE1179 -22.942   2.569   0.290
  567   2HG1  ILE1179          1HG1      ILE1179 -21.848   2.464   1.667
  568   1HG2  ILE1179          1HG2      ILE1179 -25.408   0.148   1.547
  569   2HG2  ILE1179          3HG2      ILE1179 -25.128   1.411   0.349
  570   3HG2  ILE1179          2HG2      ILE1179 -24.191  -0.082   0.292
  571   1HD1  ILE1179          2HD1      ILE1179 -21.203   0.215   0.977
  572   2HD1  ILE1179          1HD1      ILE1179 -22.287   0.333  -0.408
  573   3HD1  ILE1179          3HD1      ILE1179 -20.891   1.404  -0.287
  574    H    ALA1180           HN       ALA1180 -23.168   1.496   4.914
  575    HA   ALA1180           HA       ALA1180 -21.573   3.942   5.285
  576   1HB   ALA1180           HB1      ALA1180 -23.100   3.645   7.098
  577   2HB   ALA1180           HB3      ALA1180 -22.625   1.959   7.300
  578   3HB   ALA1180           HB2      ALA1180 -21.486   3.249   7.688
  579    H    LEU1181           HN       LEU1181 -19.841   2.831   7.263
  580    HA   LEU1181           HA       LEU1181 -18.372   0.749   5.795
  581   1HB   LEU1181           HB2      LEU1181 -17.631   3.489   6.004
  582   2HB   LEU1181           HB1      LEU1181 -16.493   2.538   6.938
  583    HG   LEU1181           HG       LEU1181 -16.995   1.338   4.354
  584   1HD1  LEU1181          1HD1      LEU1181 -17.447   3.679   3.770
  585   2HD1  LEU1181          3HD1      LEU1181 -15.853   4.120   4.378
  586   3HD1  LEU1181          2HD1      LEU1181 -15.999   3.046   2.985
  587   1HD2  LEU1181          1HD2      LEU1181 -14.533   2.414   5.722
  588   2HD2  LEU1181          3HD2      LEU1181 -15.119   0.750   5.765
  589   3HD2  LEU1181          2HD2      LEU1181 -14.538   1.443   4.250
  590    H    ARG1182           HN       ARG1182 -19.866   1.371   8.486
  591    HA   ARG1182           HA       ARG1182 -19.842   0.320  10.535
  592   1HB   ARG1182           HB2      ARG1182 -18.439  -1.461   9.360
  593   2HB   ARG1182           HB1      ARG1182 -17.024  -0.601   9.949
  594   1HG   ARG1182           HG2      ARG1182 -17.610  -1.038  12.216
  595   2HG   ARG1182           HG1      ARG1182 -19.181  -1.689  11.738
  596   1HD   ARG1182           HD2      ARG1182 -16.476  -2.861  11.099
  597   2HD   ARG1182           HD1      ARG1182 -17.650  -3.502  12.245
  598    HE   ARG1182           HE       ARG1182 -18.244  -3.307   9.368
  599   1HH1  ARG1182          1HH1      ARG1182 -18.075  -5.121  12.340
  600   2HH1  ARG1182          2HH1      ARG1182 -18.840  -6.526  11.677
  601   1HH2  ARG1182          1HH2      ARG1182 -19.256  -5.152   8.488
  602   2HH2  ARG1182          2HH2      ARG1182 -19.511  -6.544   9.487
  603    H    TRP1183           HN       TRP1183 -17.615   2.442   9.274
  604    HA   TRP1183           HA       TRP1183 -17.319   3.877  11.784
  605   1HB   TRP1183           HB2      TRP1183 -14.905   3.478  10.032
  606   2HB   TRP1183           HB1      TRP1183 -14.970   4.066  11.688
  607    HD1  TRP1183           HD1      TRP1183 -14.962   0.827   9.661
  608    HE1  TRP1183           HE1      TRP1183 -14.491  -1.144  11.249
  609    HE3  TRP1183           HE3      TRP1183 -15.203   3.301  14.131
  610    HZ2  TRP1183           HZ2      TRP1183 -14.251  -1.591  14.010
  611    HZ3  TRP1183           HZ3      TRP1183 -14.839   2.024  16.203
  612    HH2  TRP1183           HH2      TRP1183 -14.373  -0.374  16.143
  613    H    THR1184           HN       THR1184 -18.486   3.792   8.947
  614    HA   THR1184           HA       THR1184 -17.753   5.315   7.022
  615    HB   THR1184           HB       THR1184 -19.977   4.842   6.836
  616    HG1  THR1184           HG1      THR1184 -19.530   7.162   6.398
  617   1HG2  THR1184          3HG2      THR1184 -20.308   5.917   9.633
  618   2HG2  THR1184          2HG2      THR1184 -21.664   5.460   8.602
  619   3HG2  THR1184          1HG2      THR1184 -20.478   4.248   9.088
  620    H    ALA1185           HN       ALA1185 -19.205   7.038   9.752
  621    HA   ALA1185           HA       ALA1185 -18.995   9.227  10.412
  622   1HB   ALA1185           HB3      ALA1185 -16.085   8.655   9.843
  623   2HB   ALA1185           HB1      ALA1185 -16.937   8.228  11.326
  624   3HB   ALA1185           HB2      ALA1185 -16.716   9.924  10.894
  625    H    LYS1186           HN       LYS1186 -19.107   8.453   7.469
  626    HA   LYS1186           HA       LYS1186 -19.545   9.633   5.570
  627   1HB   LYS1186           HB2      LYS1186 -18.554  11.931   7.234
  628   2HB   LYS1186           HB1      LYS1186 -18.862  12.121   5.514
  629   1HG   LYS1186           HG2      LYS1186 -20.774  12.859   6.785
  630   2HG   LYS1186           HG1      LYS1186 -21.187  11.409   5.868
  631   1HD   LYS1186           HD2      LYS1186 -20.815  10.054   7.905
  632   2HD   LYS1186           HD1      LYS1186 -20.504  11.541   8.805
  633   1HE   LYS1186           HE2      LYS1186 -22.795  10.785   9.139
  634   2HE   LYS1186           HE1      LYS1186 -22.755  12.332   8.294
  635   1HZ   LYS1186           HZ2      LYS1186 -23.110  11.161   6.210
  636   2HZ   LYS1186           HZ1      LYS1186 -23.149   9.678   7.021
  637   3HZ   LYS1186           HZ3      LYS1186 -24.359  10.828   7.301
  638    H    GLN1187           HN       GLN1187 -18.253   8.579   4.213
  639    HA   GLN1187           HA       GLN1187 -16.493   8.133   2.860
  640   1HB   GLN1187           HB2      GLN1187 -16.485  10.546   2.411
  641   2HB   GLN1187           HB1      GLN1187 -15.442  10.806   3.803
  642   1HG   GLN1187           HG2      GLN1187 -13.631   9.696   2.777
  643   2HG   GLN1187           HG1      GLN1187 -14.660   9.047   1.499
  644   1HE2  GLN1187          1HE2      GLN1187 -12.225  10.651   1.320
  645   2HE2  GLN1187          2HE2      GLN1187 -12.647  12.062   0.418
  646    H    LYS1188           HN       LYS1188 -15.938   6.380   4.182
  647    HA   LYS1188           HA       LYS1188 -13.419   6.749   5.665
  648   1HB   LYS1188           HB2      LYS1188 -15.349   6.323   7.192
  649   2HB   LYS1188           HB1      LYS1188 -15.639   4.806   6.356
  650   1HG   LYS1188           HG2      LYS1188 -14.463   4.385   8.409
  651   2HG   LYS1188           HG1      LYS1188 -13.399   4.034   7.045
  652   1HD   LYS1188           HD2      LYS1188 -12.318   6.211   7.327
  653   2HD   LYS1188           HD1      LYS1188 -13.383   6.565   8.688
  654   1HE   LYS1188           HE2      LYS1188 -12.467   4.644   9.898
  655   2HE   LYS1188           HE1      LYS1188 -11.397   4.299   8.540
  656   1HZ   LYS1188           HZ1      LYS1188 -11.366   6.780  10.171
  657   2HZ   LYS1188           HZ3      LYS1188 -10.251   5.512  10.284
  658   3HZ   LYS1188           HZ2      LYS1188 -10.336   6.441   8.874
  659    H    LEU1189           HN       LEU1189 -14.491   5.869   2.935
  660    HA   LEU1189           HA       LEU1189 -13.772   3.133   2.577
  661   1HB   LEU1189           HB2      LEU1189 -13.780   4.032   0.093
  662   2HB   LEU1189           HB1      LEU1189 -15.261   3.747   0.985
  663    HG   LEU1189           HG       LEU1189 -15.550   6.086   1.418
  664   1HD1  LEU1189          3HD1      LEU1189 -13.163   6.605   1.812
  665   2HD1  LEU1189          2HD1      LEU1189 -12.907   6.582   0.067
  666   3HD1  LEU1189          1HD1      LEU1189 -13.979   7.784   0.785
  667   1HD2  LEU1189          3HD2      LEU1189 -16.264   5.304  -0.777
  668   2HD2  LEU1189          2HD2      LEU1189 -15.730   6.984  -0.833
  669   3HD2  LEU1189          1HD2      LEU1189 -14.679   5.704  -1.439
  670    H    TYR1190           HN       TYR1190 -11.647   4.994   3.676
  671    HA   TYR1190           HA       TYR1190  -9.648   4.471   1.583
  672   1HB   TYR1190           HB2      TYR1190 -10.099   6.860   3.274
  673   2HB   TYR1190           HB1      TYR1190  -8.424   6.408   2.969
  674    HD1  TYR1190           HD1      TYR1190 -11.200   5.872   0.577
  675    HD2  TYR1190           HD2      TYR1190  -7.831   8.271   1.611
  676    HE1  TYR1190           HE1      TYR1190 -11.296   6.963  -1.627
  677    HE2  TYR1190           HE2      TYR1190  -7.926   9.364  -0.588
  678    HH   TYR1190           HH       TYR1190  -8.788   8.894  -2.843
  679    H    SER1191           HN       SER1191  -8.648   2.695   2.146
  680    HA   SER1191           HA       SER1191  -7.346   2.605   4.785
  681   1HB   SER1191           HB2      SER1191  -8.826   0.381   3.378
  682   2HB   SER1191           HB1      SER1191  -7.646   0.068   4.646
  683    HG   SER1191           HG       SER1191 -10.018   1.616   4.879
  684    H    ARG1192           HN       ARG1192  -5.804   0.440   4.556
  685    HA   ARG1192           HA       ARG1192  -4.111   1.057   2.234
  686   1HB   ARG1192           HB2      ARG1192  -3.099   1.384   4.484
  687   2HB   ARG1192           HB1      ARG1192  -3.367  -0.318   4.826
  688   1HG   ARG1192           HG2      ARG1192  -1.866  -0.938   3.017
  689   2HG   ARG1192           HG1      ARG1192  -1.617   0.765   2.630
  690   1HD   ARG1192           HD2      ARG1192   0.232  -0.110   3.955
  691   2HD   ARG1192           HD1      ARG1192  -0.651   1.135   4.839
  692    HE   ARG1192           HE       ARG1192  -1.691  -1.392   5.505
  693   1HH1  ARG1192          1HH1      ARG1192   1.163   0.554   5.970
  694   2HH1  ARG1192          2HH1      ARG1192   1.570  -0.175   7.487
  695   1HH2  ARG1192          1HH2      ARG1192  -1.161  -2.358   7.502
  696   2HH2  ARG1192          2HH2      ARG1192   0.250  -1.831   8.357
  697    H    THR1193           HN       THR1193  -3.989  -0.427   0.661
  698    HA   THR1193           HA       THR1193  -5.529  -2.627   0.415
  699    HB   THR1193           HB       THR1193  -2.850  -1.979  -0.755
  700    HG1  THR1193           HG1      THR1193  -5.225  -2.714  -2.106
  701   1HG2  THR1193          3HG2      THR1193  -4.272  -4.615  -1.163
  702   2HG2  THR1193          2HG2      THR1193  -2.913  -4.028  -2.122
  703   3HG2  THR1193          1HG2      THR1193  -2.694  -4.387  -0.409
  704    H    GLY1194           HN       GLY1194  -5.707  -4.531   1.362
  705   1HA   GLY1194           HA1      GLY1194  -3.458  -5.457   3.032
  706   2HA   GLY1194           HA2      GLY1194  -4.427  -6.568   2.070
  707    H    GLU1195           HN       GLU1195  -5.948  -3.865   3.579
  708    HA   GLU1195           HA       GLU1195  -6.805  -5.445   5.878
  709   1HB   GLU1195           HB2      GLU1195  -7.317  -2.551   5.157
  710   2HB   GLU1195           HB1      GLU1195  -7.842  -3.329   6.645
  711   1HG   GLU1195           HG2      GLU1195  -4.986  -2.960   5.767
  712   2HG   GLU1195           HG1      GLU1195  -5.830  -1.993   6.976
  713    H    SER1196           HN       SER1196  -8.983  -5.868   6.346
  714    HA   SER1196           HA       SER1196 -10.641  -6.137   3.972
  715   1HB   SER1196           HB2      SER1196 -11.133  -7.114   6.795
  716   2HB   SER1196           HB1      SER1196 -12.063  -7.555   5.363
  717    HG   SER1196           HG       SER1196 -10.653  -9.163   5.455
  718    H    VAL1197           HN       VAL1197 -12.104  -4.682   3.434
  719    HA   VAL1197           HA       VAL1197 -13.038  -2.775   5.455
  720    HB   VAL1197           HB       VAL1197 -13.231  -2.665   2.442
  721   1HG1  VAL1197          2HG1      VAL1197 -14.017  -0.618   4.513
  722   2HG1  VAL1197          1HG1      VAL1197 -14.006  -0.360   2.769
  723   3HG1  VAL1197          3HG1      VAL1197 -15.116  -1.531   3.481
  724   1HG2  VAL1197          2HG2      VAL1197 -11.497  -1.128   4.373
  725   2HG2  VAL1197          1HG2      VAL1197 -10.956  -2.374   3.249
  726   3HG2  VAL1197          3HG2      VAL1197 -11.594  -0.850   2.634
  727    H    GLU1198           HN       GLU1198 -15.135  -2.600   6.044
  728    HA   GLU1198           HA       GLU1198 -17.071  -4.363   4.696
  729   1HB   GLU1198           HB2      GLU1198 -16.939  -3.738   7.650
  730   2HB   GLU1198           HB1      GLU1198 -18.143  -4.753   6.861
  731   1HG   GLU1198           HG2      GLU1198 -16.411  -6.325   6.211
  732   2HG   GLU1198           HG1      GLU1198 -15.193  -5.295   6.964
  733    H    PHE1199           HN       PHE1199 -18.303  -3.015   3.537
  734    HA   PHE1199           HA       PHE1199 -19.009  -0.401   4.598
  735   1HB   PHE1199           HB2      PHE1199 -19.880  -1.732   2.028
  736   2HB   PHE1199           HB1      PHE1199 -20.163  -0.054   2.466
  737    HD1  PHE1199           HD1      PHE1199 -18.383   1.576   2.383
  738    HD2  PHE1199           HD2      PHE1199 -17.730  -2.494   1.337
  739    HE1  PHE1199           HE1      PHE1199 -16.252   2.203   1.291
  740    HE2  PHE1199           HE2      PHE1199 -15.621  -1.892   0.257
  741    HZ   PHE1199           HZ       PHE1199 -14.869   0.459   0.229
  742    H    VAL1200           HN       VAL1200 -20.637  -0.270   6.039
  743    HA   VAL1200           HA       VAL1200 -22.674  -2.197   6.345
  744    HB   VAL1200           HB       VAL1200 -23.067   0.688   7.082
  745   1HG1  VAL1200          3HG1      VAL1200 -24.811  -0.973   7.566
  746   2HG1  VAL1200          2HG1      VAL1200 -23.657  -1.856   8.564
  747   3HG1  VAL1200          1HG1      VAL1200 -24.150  -0.225   9.018
  748   1HG2  VAL1200          1HG2      VAL1200 -20.711   0.077   7.614
  749   2HG2  VAL1200          3HG2      VAL1200 -21.687   0.486   9.023
  750   3HG2  VAL1200          2HG2      VAL1200 -21.331  -1.204   8.657
  751    H    CYS1201           HN       CYS1201 -25.109  -0.906   6.251
  752    HA   CYS1201           HA       CYS1201 -25.297   0.479   3.721
  753   1HB   CYS1201           HB2      CYS1201 -26.891  -1.029   2.707
  754   2HB   CYS1201           HB1      CYS1201 -25.391  -1.880   3.056
  755    H    LYS1202           HN       LYS1202 -25.695   1.644   6.010
  756    HA   LYS1202           HA       LYS1202 -27.141   2.883   7.247
  757   1HB   LYS1202           HB2      LYS1202 -28.269   2.684   4.589
  758   2HB   LYS1202           HB1      LYS1202 -29.526   2.874   5.802
  759   1HG   LYS1202           HG2      LYS1202 -28.792   4.958   6.437
  760   2HG   LYS1202           HG1      LYS1202 -27.152   4.677   5.846
  761   1HD   LYS1202           HD2      LYS1202 -27.705   5.150   3.675
  762   2HD   LYS1202           HD1      LYS1202 -29.388   4.660   3.881
  763   1HE   LYS1202           HE2      LYS1202 -28.113   7.170   4.974
  764   2HE   LYS1202           HE1      LYS1202 -29.185   7.080   3.577
  765   1HZ   LYS1202           HZ3      LYS1202 -30.949   6.291   5.027
  766   2HZ   LYS1202           HZ2      LYS1202 -29.921   6.376   6.367
  767   3HZ   LYS1202           HZ1      LYS1202 -30.369   7.791   5.556
  768    H    ARG1203           HN       ARG1203 -27.919   2.155   9.074
  769    HA   ARG1203           HA       ARG1203 -28.922  -0.250   9.745
  770   1HB   ARG1203           HB2      ARG1203 -29.975   2.359  10.832
  771   2HB   ARG1203           HB1      ARG1203 -29.981   0.805  11.653
  772   1HG   ARG1203           HG2      ARG1203 -27.534   0.812  11.690
  773   2HG   ARG1203           HG1      ARG1203 -27.536   2.384  10.889
  774   1HD   ARG1203           HD2      ARG1203 -27.214   2.635  13.288
  775   2HD   ARG1203           HD1      ARG1203 -28.743   3.350  12.780
  776    HE   ARG1203           HE       ARG1203 -29.287   0.746  13.569
  777   1HH1  ARG1203          1HH1      ARG1203 -28.090   3.689  15.001
  778   2HH1  ARG1203          2HH1      ARG1203 -28.714   3.328  16.575
  779   1HH2  ARG1203          1HH2      ARG1203 -30.112   0.264  15.639
  780   2HH2  ARG1203          2HH2      ARG1203 -29.862   1.381  16.938
  781    H    GLY1204           HN       GLY1204 -30.299  -1.215   8.259
  782   1HA   GLY1204           HA1      GLY1204 -32.846   0.136   7.711
  783   2HA   GLY1204           HA2      GLY1204 -32.880  -1.444   8.477
  784    H    TYR1205           HN       TYR1205 -31.273   0.099   5.667
  785    HA   TYR1205           HA       TYR1205 -32.533  -1.303   3.677
  786   1HB   TYR1205           HB2      TYR1205 -29.699  -0.294   3.812
  787   2HB   TYR1205           HB1      TYR1205 -30.363  -1.017   2.359
  788    HD1  TYR1205           HD1      TYR1205 -32.299   0.109   1.223
  789    HD2  TYR1205           HD2      TYR1205 -30.129   1.952   4.373
  790    HE1  TYR1205           HE1      TYR1205 -33.183   2.298   0.539
  791    HE2  TYR1205           HE2      TYR1205 -31.006   4.149   3.703
  792    HH   TYR1205           HH       TYR1205 -31.930   5.228   1.696
  793    H    ARG1206           HN       ARG1206 -32.533  -3.321   2.947
  794    HA   ARG1206           HA       ARG1206 -30.783  -5.261   4.280
  795   1HB   ARG1206           HB2      ARG1206 -32.409  -6.954   3.560
  796   2HB   ARG1206           HB1      ARG1206 -33.172  -5.677   4.498
  797   1HG   ARG1206           HG2      ARG1206 -34.016  -4.656   2.464
  798   2HG   ARG1206           HG1      ARG1206 -33.208  -5.890   1.495
  799   1HD   ARG1206           HD2      ARG1206 -34.565  -7.619   2.560
  800   2HD   ARG1206           HD1      ARG1206 -35.373  -6.390   3.532
  801    HE   ARG1206           HE       ARG1206 -35.672  -5.692   0.848
  802   1HH1  ARG1206          1HH1      ARG1206 -36.671  -8.214   3.036
  803   2HH1  ARG1206          2HH1      ARG1206 -38.145  -8.543   2.187
  804   1HH2  ARG1206          1HH2      ARG1206 -37.610  -6.118  -0.274
  805   2HH2  ARG1206          2HH2      ARG1206 -38.678  -7.352   0.306
  806    H    LEU1207           HN       LEU1207 -29.331  -6.458   3.220
  807    HA   LEU1207           HA       LEU1207 -28.209  -5.763   0.840
  808   1HB   LEU1207           HB2      LEU1207 -28.349  -8.460   2.166
  809   2HB   LEU1207           HB1      LEU1207 -27.406  -8.185   0.716
  810    HG   LEU1207           HG       LEU1207 -26.989  -6.783   3.359
  811   1HD1  LEU1207          1HD1      LEU1207 -26.368  -9.146   3.431
  812   2HD1  LEU1207          3HD1      LEU1207 -25.372  -8.930   1.990
  813   3HD1  LEU1207          2HD1      LEU1207 -24.945  -8.105   3.491
  814   1HD2  LEU1207          2HD2      LEU1207 -25.411  -6.679   0.791
  815   2HD2  LEU1207          1HD2      LEU1207 -26.378  -5.371   1.474
  816   3HD2  LEU1207          3HD2      LEU1207 -24.936  -5.938   2.319
  817    H    SER1208           HN       SER1208 -28.761  -5.836  -1.222
  818    HA   SER1208           HA       SER1208 -31.211  -7.157  -2.010
  819   1HB   SER1208           HB2      SER1208 -30.709  -4.892  -2.835
  820   2HB   SER1208           HB1      SER1208 -29.265  -5.505  -3.639
  821    HG   SER1208           HG       SER1208 -30.655  -5.679  -5.236
  822    H    SER1209           HN       SER1209 -28.332  -8.371  -1.468
  823    HA   SER1209           HA       SER1209 -27.376 -10.366  -2.019
  824   1HB   SER1209           HB2      SER1209 -29.600 -11.236  -2.569
  825   2HB   SER1209           HB1      SER1209 -29.488 -10.525  -4.179
  826    HG   SER1209           HG       SER1209 -27.319 -11.984  -3.814
  827    H    ARG1210           HN       ARG1210 -28.361  -8.616  -4.970
  828    HA   ARG1210           HA       ARG1210 -26.058  -9.297  -6.450
  829   1HB   ARG1210           HB2      ARG1210 -26.749  -7.527  -7.988
  830   2HB   ARG1210           HB1      ARG1210 -28.130  -8.501  -7.501
  831   1HG   ARG1210           HG2      ARG1210 -28.799  -6.776  -5.914
  832   2HG   ARG1210           HG1      ARG1210 -27.405  -5.800  -6.384
  833   1HD   ARG1210           HD2      ARG1210 -29.436  -5.037  -7.504
  834   2HD   ARG1210           HD1      ARG1210 -28.258  -5.655  -8.661
  835    HE   ARG1210           HE       ARG1210 -30.061  -7.697  -7.896
  836   1HH1  ARG1210          1HH1      ARG1210 -29.845  -4.816  -9.842
  837   2HH1  ARG1210          2HH1      ARG1210 -31.067  -5.323 -10.960
  838   1HH2  ARG1210          1HH2      ARG1210 -31.669  -8.374  -9.363
  839   2HH2  ARG1210          2HH2      ARG1210 -32.104  -7.346 -10.688
  840    H    SER1211           HN       SER1211 -26.359  -7.446  -3.748
  841    HA   SER1211           HA       SER1211 -24.544  -5.319  -4.326
  842   1HB   SER1211           HB2      SER1211 -25.695  -6.451  -1.776
  843   2HB   SER1211           HB1      SER1211 -24.540  -5.114  -1.774
  844    HG   SER1211           HG       SER1211 -26.930  -4.657  -1.836
  845    H    HIS1212           HN       HIS1212 -23.934  -8.452  -4.361
  846    HA   HIS1212           HA       HIS1212 -22.047  -9.708  -4.253
  847   1HB   HIS1212           HB2      HIS1212 -20.766  -7.024  -3.728
  848   2HB   HIS1212           HB1      HIS1212 -19.851  -8.516  -3.906
  849    HD1  HIS1212           HD1      HIS1212 -21.844  -6.025  -5.856
  850    HD2  HIS1212           HD2      HIS1212 -19.633  -9.479  -6.522
  851    HE1  HIS1212           HE1      HIS1212 -21.542  -6.159  -8.349
  852    HE2  HIS1212           HE2      HIS1212 -20.131  -8.213  -8.722
  853    H    THR1213           HN       THR1213 -20.850  -7.430  -1.855
  854    HA   THR1213           HA       THR1213 -21.826  -8.844   0.408
  855    HB   THR1213           HB       THR1213 -20.296 -10.562  -0.001
  856    HG1  THR1213           HG1      THR1213 -19.731 -10.322   2.020
  857   1HG2  THR1213          3HG2      THR1213 -18.210  -8.464  -0.604
  858   2HG2  THR1213          2HG2      THR1213 -17.940 -10.207  -0.591
  859   3HG2  THR1213          1HG2      THR1213 -19.021  -9.491  -1.788
  860    H    LEU1214           HN       LEU1214 -20.664  -8.131   2.437
  861    HA   LEU1214           HA       LEU1214 -20.177  -5.257   2.215
  862   1HB   LEU1214           HB2      LEU1214 -20.651  -6.935   4.673
  863   2HB   LEU1214           HB1      LEU1214 -20.650  -5.183   4.587
  864    HG   LEU1214           HG       LEU1214 -22.595  -6.832   2.994
  865   1HD1  LEU1214          1HD1      LEU1214 -22.847  -7.469   5.333
  866   2HD1  LEU1214          3HD1      LEU1214 -22.987  -5.771   5.787
  867   3HD1  LEU1214          2HD1      LEU1214 -24.223  -6.518   4.773
  868   1HD2  LEU1214          2HD2      LEU1214 -22.147  -4.408   2.478
  869   2HD2  LEU1214          1HD2      LEU1214 -23.828  -4.820   2.836
  870   3HD2  LEU1214          3HD2      LEU1214 -22.833  -4.033   4.060
  871    H    ARG1215           HN       ARG1215 -18.747  -8.159   3.647
  872    HA   ARG1215           HA       ARG1215 -16.329  -6.675   4.323
  873   1HB   ARG1215           HB2      ARG1215 -17.280  -8.298   5.941
  874   2HB   ARG1215           HB1      ARG1215 -16.991  -9.590   4.783
  875   1HG   ARG1215           HG2      ARG1215 -14.587  -9.132   4.882
  876   2HG   ARG1215           HG1      ARG1215 -14.889  -7.859   6.066
  877   1HD   ARG1215           HD2      ARG1215 -15.844  -9.507   7.597
  878   2HD   ARG1215           HD1      ARG1215 -15.551 -10.781   6.413
  879    HE   ARG1215           HE       ARG1215 -13.136  -9.449   6.966
  880   1HH1  ARG1215          1HH1      ARG1215 -15.420 -11.617   8.459
  881   2HH1  ARG1215          2HH1      ARG1215 -14.238 -12.360   9.486
  882   1HH2  ARG1215          1HH2      ARG1215 -11.575 -10.421   8.313
  883   2HH2  ARG1215          2HH2      ARG1215 -12.054 -11.679   9.403
  884    H    THR1216           HN       THR1216 -14.781  -6.460   2.862
  885    HA   THR1216           HA       THR1216 -14.156  -8.721   1.104
  886    HB   THR1216           HB       THR1216 -15.484  -7.330  -0.317
  887    HG1  THR1216           HG1      THR1216 -13.521  -6.403  -1.635
  888   1HG2  THR1216          2HG2      THR1216 -15.394  -5.261   0.978
  889   2HG2  THR1216          1HG2      THR1216 -13.708  -5.038   0.512
  890   3HG2  THR1216          3HG2      THR1216 -14.978  -4.965  -0.710
  891    H    THR1217           HN       THR1217 -12.098  -8.141  -0.192
  892    HA   THR1217           HA       THR1217 -10.164  -6.910   1.664
  893    HB   THR1217           HB       THR1217  -9.838  -9.280  -0.175
  894    HG1  THR1217           HG1      THR1217  -8.912 -10.036   1.963
  895   1HG2  THR1217          3HG2      THR1217  -7.925  -7.666  -0.404
  896   2HG2  THR1217          2HG2      THR1217  -7.621  -7.879   1.321
  897   3HG2  THR1217          1HG2      THR1217  -7.471  -9.252   0.225
  898    H    CYS1218           HN       CYS1218  -9.090  -5.197   0.920
  899    HA   CYS1218           HA       CYS1218  -9.543  -4.213  -1.708
  900   1HB   CYS1218           HB2      CYS1218  -7.368  -3.324   0.182
  901   2HB   CYS1218           HB1      CYS1218  -8.093  -2.401  -1.127
  902    H    TRP1219           HN       TRP1219  -8.062  -3.988  -3.413
  903    HA   TRP1219           HA       TRP1219  -5.442  -5.069  -3.262
  904   1HB   TRP1219           HB2      TRP1219  -7.308  -7.030  -3.509
  905   2HB   TRP1219           HB1      TRP1219  -6.971  -6.679  -5.204
  906    HD1  TRP1219           HD1      TRP1219  -4.180  -6.682  -5.782
  907    HE1  TRP1219           HE1      TRP1219  -2.444  -8.398  -4.984
  908    HE3  TRP1219           HE3      TRP1219  -6.714  -8.628  -1.796
  909    HZ2  TRP1219           HZ2      TRP1219  -2.174 -10.324  -2.959
  910    HZ3  TRP1219           HZ3      TRP1219  -5.646 -10.411  -0.477
  911    HH2  TRP1219           HH2      TRP1219  -3.421 -11.242  -1.047
  912    H    ASP1220           HN       ASP1220  -4.382  -3.729  -4.481
  913    HA   ASP1220           HA       ASP1220  -3.677  -2.550  -6.294
  914   1HB   ASP1220           HB2      ASP1220  -4.331  -4.559  -7.606
  915   2HB   ASP1220           HB1      ASP1220  -5.943  -3.877  -7.798
  916    H    GLY1221           HN       GLY1221  -6.457  -2.127  -4.689
  917   1HA   GLY1221           HA1      GLY1221  -6.864   0.523  -5.873
  918   2HA   GLY1221           HA2      GLY1221  -7.354   0.028  -4.263
  919    H    LYS1222           HN       LYS1222  -8.715  -2.373  -5.003
  920    HA   LYS1222           HA       LYS1222 -11.204  -1.183  -5.864
  921   1HB   LYS1222           HB2      LYS1222  -9.619  -2.366  -7.806
  922   2HB   LYS1222           HB1      LYS1222 -10.759  -3.630  -7.365
  923   1HG   LYS1222           HG2      LYS1222 -11.524  -0.844  -8.213
  924   2HG   LYS1222           HG1      LYS1222 -11.527  -2.264  -9.261
  925   1HD   LYS1222           HD2      LYS1222 -13.180  -3.335  -7.811
  926   2HD   LYS1222           HD1      LYS1222 -13.174  -1.919  -6.756
  927   1HE   LYS1222           HE2      LYS1222 -15.087  -1.879  -8.265
  928   2HE   LYS1222           HE1      LYS1222 -13.991  -0.538  -8.594
  929   1HZ   LYS1222           HZ3      LYS1222 -13.077  -1.786 -10.449
  930   2HZ   LYS1222           HZ2      LYS1222 -14.128  -3.073 -10.134
  931   3HZ   LYS1222           HZ1      LYS1222 -14.747  -1.580 -10.634
  932    H    LEU1223           HN       LEU1223 -12.948  -2.208  -5.011
  933    HA   LEU1223           HA       LEU1223 -12.668  -4.935  -4.023
  934   1HB   LEU1223           HB2      LEU1223 -13.880  -3.881  -1.860
  935   2HB   LEU1223           HB1      LEU1223 -12.159  -4.190  -1.971
  936    HG   LEU1223           HG       LEU1223 -13.081  -1.543  -2.924
  937   1HD1  LEU1223          1HD1      LEU1223 -13.111  -2.344  -0.024
  938   2HD1  LEU1223          3HD1      LEU1223 -13.076  -0.675  -0.595
  939   3HD1  LEU1223          2HD1      LEU1223 -14.453  -1.708  -0.979
  940   1HD2  LEU1223          1HD2      LEU1223 -10.773  -2.507  -1.247
  941   2HD2  LEU1223          3HD2      LEU1223 -10.736  -2.137  -2.971
  942   3HD2  LEU1223          2HD2      LEU1223 -11.011  -0.848  -1.798
  943    H    GLU1224           HN       GLU1224 -14.857  -5.416  -2.733
  944    HA   GLU1224           HA       GLU1224 -16.892  -5.522  -4.643
  945   1HB   GLU1224           HB2      GLU1224 -17.117  -5.805  -1.641
  946   2HB   GLU1224           HB1      GLU1224 -18.327  -6.324  -2.807
  947   1HG   GLU1224           HG2      GLU1224 -15.521  -7.395  -2.617
  948   2HG   GLU1224           HG1      GLU1224 -16.966  -8.177  -1.974
  949    H    TYR1225           HN       TYR1225 -19.268  -4.850  -3.486
  950    HA   TYR1225           HA       TYR1225 -19.298  -2.161  -2.517
  951   1HB   TYR1225           HB2      TYR1225 -19.221  -2.579  -5.368
  952   2HB   TYR1225           HB1      TYR1225 -20.751  -1.840  -4.910
  953    HD1  TYR1225           HD1      TYR1225 -20.175   0.004  -2.838
  954    HD2  TYR1225           HD2      TYR1225 -17.776  -1.012  -6.198
  955    HE1  TYR1225           HE1      TYR1225 -19.088   2.206  -2.721
  956    HE2  TYR1225           HE2      TYR1225 -16.683   1.185  -6.092
  957    HH   TYR1225           HH       TYR1225 -16.929   3.224  -3.438
  958    HA   PRO1226           HA       PRO1226 -23.291  -4.103  -1.619
  959   1HB   PRO1226           HB2      PRO1226 -23.393  -2.626   0.815
  960   2HB   PRO1226           HB1      PRO1226 -22.993  -4.331   0.611
  961   1HG   PRO1226           HG2      PRO1226 -21.229  -2.366   1.468
  962   2HG   PRO1226           HG1      PRO1226 -20.765  -3.942   0.806
  963   1HD   PRO1226           HD2      PRO1226 -20.855  -1.274  -0.535
  964   2HD   PRO1226           HD1      PRO1226 -19.693  -2.604  -0.737
  965    H    THR1227           HN       THR1227 -25.436  -3.097  -0.882
  966    HA   THR1227           HA       THR1227 -25.734  -0.250  -1.242
  967    HB   THR1227           HB       THR1227 -27.037  -2.059  -3.284
  968    HG1  THR1227           HG1      THR1227 -25.179  -1.869  -4.278
  969   1HG2  THR1227          2HG2      THR1227 -28.337  -0.061  -2.733
  970   2HG2  THR1227          1HG2      THR1227 -26.925   0.949  -3.045
  971   3HG2  THR1227          3HG2      THR1227 -27.673   0.049  -4.364
  972    H    CYS1228           HN       CYS1228 -27.098  -3.412  -0.732
  973    HA   CYS1228           HA       CYS1228 -28.993  -4.161   0.295
  974   1HB   CYS1228           HB2      CYS1228 -28.240  -1.709   1.829
  975   2HB   CYS1228           HB1      CYS1228 -29.777  -2.488   2.187
  976    H    ALA1229           HN       ALA1229 -31.270  -2.955   1.291
  977    HA   ALA1229           HA       ALA1229 -32.310  -1.083  -0.633
  978   1HB   ALA1229           HB3      ALA1229 -33.371  -3.900  -0.625
  979   2HB   ALA1229           HB1      ALA1229 -32.435  -3.146  -1.916
  980   3HB   ALA1229           HB2      ALA1229 -34.047  -2.542  -1.526
  981    H    LYS1230           HN       LYS1230 -34.062  -0.037   0.025
  982    HA   LYS1230           HA       LYS1230 -35.392   0.945   1.570
  983   1HB   LYS1230           HB2      LYS1230 -37.351  -0.395   2.149
  984   2HB   LYS1230           HB1      LYS1230 -36.897  -0.603   0.465
  985   1HG   LYS1230           HG2      LYS1230 -35.610  -2.688   1.375
  986   2HG   LYS1230           HG1      LYS1230 -36.739  -2.536   2.724
  987   1HD   LYS1230           HD2      LYS1230 -37.717  -4.039   1.164
  988   2HD   LYS1230           HD1      LYS1230 -38.596  -2.513   1.030
  989   1HE   LYS1230           HE2      LYS1230 -37.286  -1.919  -0.937
  990   2HE   LYS1230           HE1      LYS1230 -36.372  -3.420  -0.794
  991   1HZ   LYS1230           HZ1      LYS1230 -38.416  -4.655  -1.165
  992   2HZ   LYS1230           HZ3      LYS1230 -39.292  -3.213  -1.303
  993   3HZ   LYS1230           HZ2      LYS1230 -38.114  -3.602  -2.453
  994    H    ARG1231           HN       ARG1231 -34.229   1.624   3.259
  995    HA   ARG1231           HA       ARG1231 -33.241   0.113   5.359
  996   1HB   ARG1231           HB2      ARG1231 -33.298   2.341   6.603
  997   2HB   ARG1231           HB1      ARG1231 -32.377   2.289   5.124
  998   1HG   ARG1231           HG2      ARG1231 -34.200   3.363   3.927
  999   2HG   ARG1231           HG1      ARG1231 -35.177   3.364   5.396
 1000   1HD   ARG1231           HD2      ARG1231 -32.550   4.798   5.019
 1001   2HD   ARG1231           HD1      ARG1231 -34.146   5.547   4.998
 1002    HE   ARG1231           HE       ARG1231 -33.789   4.140   7.413
 1003   1HH1  ARG1231          1HH1      ARG1231 -32.703   7.010   5.764
 1004   2HH1  ARG1231          2HH1      ARG1231 -32.379   7.882   7.224
 1005   1HH2  ARG1231          1HH2      ARG1231 -33.365   5.282   9.341
 1006   2HH2  ARG1231          2HH2      ARG1231 -32.756   6.900   9.258

  No H/Q in entry =        1006
  Start of MODEL    5
    1    H1   GLU1103           HT1      GLU1103  34.202  -9.024  -4.203
    2    H2   GLU1103           HT3      GLU1103  33.289  -9.421  -2.836
    3    H3   GLU1103           HT2      GLU1103  33.647  -7.802  -3.174
    4    HA   GLU1103           HA       GLU1103  35.031  -8.603  -1.392
    5   1HB   GLU1103           HB2      GLU1103  36.682 -10.377  -1.848
    6   2HB   GLU1103           HB1      GLU1103  35.031 -10.966  -1.980
    7   1HG   GLU1103           HG2      GLU1103  35.165 -10.806  -4.412
    8   2HG   GLU1103           HG1      GLU1103  36.821 -10.216  -4.280
    9    H    ALA1104           HN       ALA1104  37.517  -8.369  -1.392
   10    HA   ALA1104           HA       ALA1104  39.334  -7.095  -1.869
   11   1HB   ALA1104           HB2      ALA1104  39.415  -8.461  -3.900
   12   2HB   ALA1104           HB1      ALA1104  38.368  -7.302  -4.719
   13   3HB   ALA1104           HB3      ALA1104  39.982  -6.818  -4.197
   14    H    GLU1105           HN       GLU1105  37.414  -5.751  -4.512
   15    HA   GLU1105           HA       GLU1105  37.854  -3.085  -3.545
   16   1HB   GLU1105           HB2      GLU1105  36.295  -4.180  -5.885
   17   2HB   GLU1105           HB1      GLU1105  36.402  -2.462  -5.525
   18   1HG   GLU1105           HG2      GLU1105  37.992  -3.036  -7.232
   19   2HG   GLU1105           HG1      GLU1105  38.844  -2.584  -5.756
   20    H    PHE1106           HN       PHE1106  36.318  -1.603  -2.829
   21    HA   PHE1106           HA       PHE1106  33.938  -2.828  -1.634
   22   1HB   PHE1106           HB2      PHE1106  33.866  -0.800  -0.215
   23   2HB   PHE1106           HB1      PHE1106  35.393  -1.664  -0.073
   24    HD1  PHE1106           HD1      PHE1106  33.765   1.402  -1.137
   25    HD2  PHE1106           HD2      PHE1106  37.438  -0.746  -1.054
   26    HE1  PHE1106           HE1      PHE1106  34.984   3.471  -1.674
   27    HE2  PHE1106           HE2      PHE1106  38.663   1.319  -1.589
   28    HZ   PHE1106           HZ       PHE1106  37.436   3.431  -1.900
   29    H    GLY1107           HN       GLY1107  32.191  -0.873  -1.310
   30   1HA   GLY1107           HA1      GLY1107  30.919  -0.608  -3.764
   31   2HA   GLY1107           HA2      GLY1107  31.818   0.874  -3.493
   32    H    LYS1108           HN       LYS1108  31.411   1.975  -1.366
   33    HA   LYS1108           HA       LYS1108  29.183   1.423   0.222
   34   1HB   LYS1108           HB2      LYS1108  30.453   4.097  -0.403
   35   2HB   LYS1108           HB1      LYS1108  29.297   3.813   0.891
   36   1HG   LYS1108           HG2      LYS1108  30.918   2.126   1.818
   37   2HG   LYS1108           HG1      LYS1108  32.087   2.727   0.639
   38   1HD   LYS1108           HD2      LYS1108  30.669   4.575   2.532
   39   2HD   LYS1108           HD1      LYS1108  32.140   3.721   3.004
   40   1HE   LYS1108           HE2      LYS1108  32.756   5.896   2.217
   41   2HE   LYS1108           HE1      LYS1108  33.275   4.708   1.024
   42   1HZ   LYS1108           HZ2      LYS1108  30.777   6.298   0.824
   43   2HZ   LYS1108           HZ1      LYS1108  32.225   6.685   0.039
   44   3HZ   LYS1108           HZ3      LYS1108  31.408   5.255  -0.349
   45    H    CYS1109           HN       CYS1109  27.103   1.569  -0.100
   46    HA   CYS1109           HA       CYS1109  26.062   2.378  -2.629
   47   1HB   CYS1109           HB2      CYS1109  24.374   1.860  -0.202
   48   2HB   CYS1109           HB1      CYS1109  24.023   1.506  -1.892
   49    H    GLY1110           HN       GLY1110  23.993   3.765  -2.607
   50   1HA   GLY1110           HA1      GLY1110  23.987   6.238  -2.717
   51   2HA   GLY1110           HA2      GLY1110  24.554   6.215  -1.054
   52    HA   PRO1111           HA       PRO1111  20.314   7.002   0.061
   53   1HB   PRO1111           HB2      PRO1111  19.458   8.083  -2.584
   54   2HB   PRO1111           HB1      PRO1111  19.220   8.749  -0.964
   55   1HG   PRO1111           HG2      PRO1111  21.062   9.768  -2.601
   56   2HG   PRO1111           HG1      PRO1111  21.372   9.612  -0.862
   57   1HD   PRO1111           HD2      PRO1111  22.403   7.973  -3.128
   58   2HD   PRO1111           HD1      PRO1111  23.193   8.415  -1.601
   59    HA   PRO1112           HA       PRO1112  18.335   3.336  -1.524
   60   1HB   PRO1112           HB2      PRO1112  16.233   3.265   0.143
   61   2HB   PRO1112           HB1      PRO1112  17.875   2.932   0.705
   62   1HG   PRO1112           HG2      PRO1112  16.279   5.461   0.918
   63   2HG   PRO1112           HG1      PRO1112  17.261   4.657   2.155
   64   1HD   PRO1112           HD2      PRO1112  18.150   6.779   0.702
   65   2HD   PRO1112           HD1      PRO1112  19.228   5.514   1.326
   66    HA   PRO1113           HA       PRO1113  15.134   5.408  -4.006
   67   1HB   PRO1113           HB2      PRO1113  15.858   4.421  -6.380
   68   2HB   PRO1113           HB1      PRO1113  16.797   5.699  -5.601
   69   1HG   PRO1113           HG2      PRO1113  17.426   2.823  -5.927
   70   2HG   PRO1113           HG1      PRO1113  18.523   4.201  -5.754
   71   1HD   PRO1113           HD2      PRO1113  17.669   2.365  -3.726
   72   2HD   PRO1113           HD1      PRO1113  18.740   3.768  -3.545
   73    HA   PRO1114           HA       PRO1114  12.932   1.374  -3.948
   74   1HB   PRO1114           HB2      PRO1114  11.080   1.916  -2.147
   75   2HB   PRO1114           HB1      PRO1114  12.758   1.698  -1.636
   76   1HG   PRO1114           HG2      PRO1114  11.184   4.210  -1.960
   77   2HG   PRO1114           HG1      PRO1114  12.408   3.801  -0.745
   78   1HD   PRO1114           HD2      PRO1114  12.807   5.285  -3.124
   79   2HD   PRO1114           HD1      PRO1114  14.061   4.661  -2.037
   80    H    ILE1115           HN       ILE1115  10.209   1.442  -3.510
   81    HA   ILE1115           HA       ILE1115   9.161   2.081  -6.031
   82    HB   ILE1115           HB       ILE1115   6.917   1.787  -4.813
   83   1HG1  ILE1115          2HG1      ILE1115   8.860   1.085  -2.600
   84   2HG1  ILE1115          1HG1      ILE1115   7.658   2.369  -2.574
   85   1HG2  ILE1115          2HG2      ILE1115   9.040  -0.348  -4.841
   86   2HG2  ILE1115          1HG2      ILE1115   7.329  -0.671  -4.553
   87   3HG2  ILE1115          3HG2      ILE1115   7.850   0.012  -6.095
   88   1HD1  ILE1115          3HD1      ILE1115   7.060  -0.576  -2.680
   89   2HD1  ILE1115          2HD1      ILE1115   6.977   0.446  -1.244
   90   3HD1  ILE1115          1HD1      ILE1115   5.875   0.728  -2.594
   91    H    ASP1116           HN       ASP1116   7.457   3.612  -6.533
   92    HA   ASP1116           HA       ASP1116   8.071   6.226  -5.510
   93   1HB   ASP1116           HB2      ASP1116   7.517   5.711  -7.925
   94   2HB   ASP1116           HB1      ASP1116   5.846   5.491  -7.416
   95    H    ASN1117           HN       ASN1117   6.831   4.231  -3.739
   96    HA   ASN1117           HA       ASN1117   4.888   5.956  -2.526
   97   1HB   ASN1117           HB2      ASN1117   4.018   3.163  -3.290
   98   2HB   ASN1117           HB1      ASN1117   3.048   4.392  -2.487
   99   1HD2  ASN1117          1HD2      ASN1117   2.297   6.162  -3.684
  100   2HD2  ASN1117          2HD2      ASN1117   2.204   6.110  -5.407
  101    H    GLY1118           HN       GLY1118   7.489   4.185  -2.200
  102   1HA   GLY1118           HA1      GLY1118   7.775   2.291  -0.551
  103   2HA   GLY1118           HA2      GLY1118   6.735   3.239   0.498
  104    H    ASP1119           HN       ASP1119   9.312   2.315   1.170
  105    HA   ASP1119           HA       ASP1119  11.358   4.203   0.867
  106   1HB   ASP1119           HB2      ASP1119   9.694   5.651   2.080
  107   2HB   ASP1119           HB1      ASP1119   9.833   4.561   3.457
  108    H    ILE1120           HN       ILE1120  12.949   4.026   2.889
  109    HA   ILE1120           HA       ILE1120  13.674   1.320   3.107
  110    HB   ILE1120           HB       ILE1120  15.102   2.289   5.085
  111   1HG1  ILE1120          2HG1      ILE1120  14.292   4.793   3.595
  112   2HG1  ILE1120          1HG1      ILE1120  13.798   4.387   5.236
  113   1HG2  ILE1120          3HG2      ILE1120  15.983   1.539   2.951
  114   2HG2  ILE1120          2HG2      ILE1120  15.510   3.064   2.202
  115   3HG2  ILE1120          1HG2      ILE1120  16.763   3.041   3.443
  116   1HD1  ILE1120          3HD1      ILE1120  16.129   4.470   5.953
  117   2HD1  ILE1120          2HD1      ILE1120  16.616   4.889   4.311
  118   3HD1  ILE1120          1HD1      ILE1120  15.606   5.995   5.241
  119    H    THR1121           HN       THR1121  11.781   3.392   5.124
  120    HA   THR1121           HA       THR1121  10.404   2.999   6.896
  121    HB   THR1121           HB       THR1121   9.365   0.967   7.134
  122    HG1  THR1121           HG1      THR1121  10.445  -0.847   7.451
  123   1HG2  THR1121          2HG2      THR1121  10.729   0.707   4.449
  124   2HG2  THR1121          1HG2      THR1121   9.352  -0.264   4.969
  125   3HG2  THR1121          3HG2      THR1121   9.179   1.481   4.778
  126    H    SER1122           HN       SER1122  13.549   2.758   6.930
  127    HA   SER1122           HA       SER1122  13.772   1.665   9.650
  128   1HB   SER1122           HB2      SER1122  15.259   0.649   7.962
  129   2HB   SER1122           HB1      SER1122  15.965   2.232   7.642
  130    HG   SER1122           HG       SER1122  17.214   1.002   9.120
  131    H    PHE1123           HN       PHE1123  15.971   3.935   8.107
  132    HA   PHE1123           HA       PHE1123  15.066   6.131   9.780
  133   1HB   PHE1123           HB2      PHE1123  16.621   4.865  11.227
  134   2HB   PHE1123           HB1      PHE1123  17.879   5.042  10.008
  135    HD1  PHE1123           HD1      PHE1123  19.156   7.019   9.841
  136    HD2  PHE1123           HD2      PHE1123  15.767   6.879  12.411
  137    HE1  PHE1123           HE1      PHE1123  19.839   9.157  10.851
  138    HE2  PHE1123           HE2      PHE1123  16.443   9.016  13.425
  139    HZ   PHE1123           HZ       PHE1123  18.481  10.158  12.645
  140    HA   PRO1124           HA       PRO1124  16.088   8.342   6.066
  141   1HB   PRO1124           HB2      PRO1124  16.422  10.621   7.947
  142   2HB   PRO1124           HB1      PRO1124  15.424  10.496   6.495
  143   1HG   PRO1124           HG2      PRO1124  14.321  10.397   8.917
  144   2HG   PRO1124           HG1      PRO1124  13.726   9.366   7.601
  145   1HD   PRO1124           HD2      PRO1124  15.456   8.658   9.934
  146   2HD   PRO1124           HD1      PRO1124  14.165   7.717   9.159
  147    H    LEU1125           HN       LEU1125  18.000   8.262   5.098
  148    HA   LEU1125           HA       LEU1125  20.334   9.425   6.404
  149   1HB   LEU1125           HB2      LEU1125  21.749   7.539   6.008
  150   2HB   LEU1125           HB1      LEU1125  20.326   6.962   6.854
  151    HG   LEU1125           HG       LEU1125  21.016   6.596   3.947
  152   1HD1  LEU1125          3HD1      LEU1125  22.088   5.127   5.623
  153   2HD1  LEU1125          2HD1      LEU1125  20.486   4.607   6.144
  154   3HD1  LEU1125          1HD1      LEU1125  21.036   4.262   4.505
  155   1HD2  LEU1125          1HD2      LEU1125  18.554   7.123   4.405
  156   2HD2  LEU1125          3HD2      LEU1125  18.929   5.650   3.515
  157   3HD2  LEU1125          2HD2      LEU1125  18.499   5.559   5.223
  158    H    SER1126           HN       SER1126  22.230   8.819   4.541
  159    HA   SER1126           HA       SER1126  21.168   9.634   1.940
  160   1HB   SER1126           HB2      SER1126  23.363  11.121   3.408
  161   2HB   SER1126           HB1      SER1126  22.885  11.410   1.734
  162    HG   SER1126           HG       SER1126  20.671  11.578   3.018
  163    H    VAL1127           HN       VAL1127  23.954   8.727   3.882
  164    HA   VAL1127           HA       VAL1127  25.178   7.438   1.549
  165    HB   VAL1127           HB       VAL1127  26.721   8.869   2.713
  166   1HG1  VAL1127          2HG1      VAL1127  25.442   8.836   4.873
  167   2HG1  VAL1127          1HG1      VAL1127  26.217   7.292   5.227
  168   3HG1  VAL1127          3HG1      VAL1127  27.196   8.747   5.042
  169   1HG2  VAL1127          2HG2      VAL1127  27.573   6.711   1.871
  170   2HG2  VAL1127          1HG2      VAL1127  28.485   7.301   3.262
  171   3HG2  VAL1127          3HG2      VAL1127  27.305   6.006   3.464
  172    H    TYR1128           HN       TYR1128  24.815   5.340   1.302
  173    HA   TYR1128           HA       TYR1128  23.972   3.801   3.654
  174   1HB   TYR1128           HB2      TYR1128  22.967   3.961   0.988
  175   2HB   TYR1128           HB1      TYR1128  23.529   2.317   1.281
  176    HD1  TYR1128           HD1      TYR1128  22.843   1.497   3.802
  177    HD2  TYR1128           HD2      TYR1128  20.735   4.301   1.397
  178    HE1  TYR1128           HE1      TYR1128  20.780   1.004   5.045
  179    HE2  TYR1128           HE2      TYR1128  18.670   3.826   2.638
  180    HH   TYR1128           HH       TYR1128  17.775   1.783   4.005
  181    H    ALA1129           HN       ALA1129  25.466   2.603   4.544
  182    HA   ALA1129           HA       ALA1129  27.946   1.949   3.498
  183   1HB   ALA1129           HB3      ALA1129  27.377   1.709   5.868
  184   2HB   ALA1129           HB2      ALA1129  26.344   0.333   5.482
  185   3HB   ALA1129           HB1      ALA1129  28.087   0.228   5.226
  186    HA   PRO1130           HA       PRO1130  27.180  -1.080   0.369
  187   1HB   PRO1130           HB2      PRO1130  29.454  -2.600   0.606
  188   2HB   PRO1130           HB1      PRO1130  29.376  -1.052  -0.241
  189   1HG   PRO1130           HG2      PRO1130  30.336  -1.661   2.526
  190   2HG   PRO1130           HG1      PRO1130  31.015  -0.549   1.325
  191   1HD   PRO1130           HD2      PRO1130  29.532   0.317   3.404
  192   2HD   PRO1130           HD1      PRO1130  29.487   1.114   1.818
  193    H    ALA1131           HN       ALA1131  26.420  -3.156   0.103
  194    HA   ALA1131           HA       ALA1131  25.540  -5.175   0.653
  195   1HB   ALA1131           HB1      ALA1131  27.848  -5.754   1.237
  196   2HB   ALA1131           HB2      ALA1131  26.686  -6.559   2.292
  197   3HB   ALA1131           HB3      ALA1131  27.580  -5.155   2.874
  198    H    SER1132           HN       SER1132  24.615  -2.602   1.921
  199    HA   SER1132           HA       SER1132  23.524  -3.547   4.460
  200   1HB   SER1132           HB2      SER1132  23.421  -0.878   3.056
  201   2HB   SER1132           HB1      SER1132  22.500  -1.223   4.521
  202    HG   SER1132           HG       SER1132  24.327  -0.479   5.355
  203    H    SER1133           HN       SER1133  21.387  -3.953   4.860
  204    HA   SER1133           HA       SER1133  19.539  -3.766   2.580
  205   1HB   SER1133           HB2      SER1133  19.279  -6.092   4.428
  206   2HB   SER1133           HB1      SER1133  18.883  -5.958   2.715
  207    HG   SER1133           HG       SER1133  21.520  -6.023   3.752
  208    H    VAL1134           HN       VAL1134  17.302  -3.648   3.133
  209    HA   VAL1134           HA       VAL1134  16.653  -3.179   5.941
  210    HB   VAL1134           HB       VAL1134  15.397  -1.100   5.350
  211   1HG1  VAL1134          2HG1      VAL1134  18.385  -1.042   4.966
  212   2HG1  VAL1134          1HG1      VAL1134  17.378   0.356   5.346
  213   3HG1  VAL1134          3HG1      VAL1134  17.516  -0.971   6.500
  214   1HG2  VAL1134          1HG2      VAL1134  16.952  -1.343   2.781
  215   2HG2  VAL1134          3HG2      VAL1134  15.199  -1.376   2.968
  216   3HG2  VAL1134          2HG2      VAL1134  16.094   0.106   3.304
  217    H    GLU1135           HN       GLU1135  14.222  -2.674   6.122
  218    HA   GLU1135           HA       GLU1135  12.806  -4.613   4.447
  219   1HB   GLU1135           HB2      GLU1135  11.967  -3.414   7.091
  220   2HB   GLU1135           HB1      GLU1135  11.193  -4.744   6.248
  221   1HG   GLU1135           HG2      GLU1135  13.202  -6.106   6.554
  222   2HG   GLU1135           HG1      GLU1135  13.959  -4.769   7.419
  223    H    TYR1136           HN       TYR1136  12.571  -3.092   2.698
  224    HA   TYR1136           HA       TYR1136  11.470  -0.568   2.801
  225   1HB   TYR1136           HB2      TYR1136  11.454  -2.737   0.746
  226   2HB   TYR1136           HB1      TYR1136  10.440  -1.326   0.487
  227    HD1  TYR1136           HD1      TYR1136  12.136  -1.573  -1.582
  228    HD2  TYR1136           HD2      TYR1136  13.163  -0.139   2.285
  229    HE1  TYR1136           HE1      TYR1136  14.036  -0.363  -2.550
  230    HE2  TYR1136           HE2      TYR1136  15.077   1.078   1.330
  231    HH   TYR1136           HH       TYR1136  16.522   0.971  -0.659
  232    H    GLN1137           HN       GLN1137   9.287   0.126   2.096
  233    HA   GLN1137           HA       GLN1137   7.031  -1.525   2.191
  234   1HB   GLN1137           HB2      GLN1137   7.665  -1.777   4.579
  235   2HB   GLN1137           HB1      GLN1137   7.505  -0.038   4.782
  236   1HG   GLN1137           HG2      GLN1137   5.135  -0.188   4.209
  237   2HG   GLN1137           HG1      GLN1137   5.297  -1.934   4.014
  238   1HE2  GLN1137          1HE2      GLN1137   6.960  -0.124   6.490
  239   2HE2  GLN1137          2HE2      GLN1137   6.072  -0.762   7.827
  240    H    CYS1138           HN       CYS1138   5.064  -0.384   1.981
  241    HA   CYS1138           HA       CYS1138   5.407   2.205   0.773
  242   1HB   CYS1138           HB2      CYS1138   2.883   0.608   1.241
  243   2HB   CYS1138           HB1      CYS1138   3.045   2.010   0.188
  244    H    GLN1139           HN       GLN1139   4.437   4.126   1.401
  245    HA   GLN1139           HA       GLN1139   4.366   4.672   4.151
  246   1HB   GLN1139           HB2      GLN1139   3.454   6.870   3.496
  247   2HB   GLN1139           HB1      GLN1139   4.840   6.408   2.519
  248   1HG   GLN1139           HG2      GLN1139   3.345   5.728   0.714
  249   2HG   GLN1139           HG1      GLN1139   1.953   6.187   1.694
  250   1HE2  GLN1139          1HE2      GLN1139   4.663   7.328  -0.155
  251   2HE2  GLN1139          2HE2      GLN1139   4.158   8.976  -0.260
  252    H    ASN1140           HN       ASN1140   2.292   6.025   4.947
  253    HA   ASN1140           HA       ASN1140   0.391   4.228   5.754
  254   1HB   ASN1140           HB2      ASN1140   0.739   6.512   6.693
  255   2HB   ASN1140           HB1      ASN1140  -0.102   7.174   5.296
  256   1HD2  ASN1140          1HD2      ASN1140  -2.279   7.007   5.129
  257   2HD2  ASN1140          2HD2      ASN1140  -3.282   6.473   6.428
  258    H    LEU1141           HN       LEU1141  -1.725   3.737   5.166
  259    HA   LEU1141           HA       LEU1141  -3.529   3.386   3.831
  260   1HB   LEU1141           HB2      LEU1141  -2.311   5.594   2.185
  261   2HB   LEU1141           HB1      LEU1141  -3.801   4.785   1.746
  262    HG   LEU1141           HG       LEU1141  -3.345   6.377   4.271
  263   1HD1  LEU1141          2HD1      LEU1141  -3.462   7.780   2.287
  264   2HD1  LEU1141          1HD1      LEU1141  -4.966   6.994   1.806
  265   3HD1  LEU1141          3HD1      LEU1141  -4.909   7.967   3.277
  266   1HD2  LEU1141          1HD2      LEU1141  -5.834   5.040   3.220
  267   2HD2  LEU1141          3HD2      LEU1141  -4.902   4.540   4.632
  268   3HD2  LEU1141          2HD2      LEU1141  -5.745   6.089   4.635
  269    H    TYR1142           HN       TYR1142  -0.373   3.522   2.257
  270    HA   TYR1142           HA       TYR1142  -1.232   1.664   0.199
  271   1HB   TYR1142           HB2      TYR1142   1.396   3.031   0.763
  272   2HB   TYR1142           HB1      TYR1142   1.204   1.828  -0.508
  273    HD1  TYR1142           HD1      TYR1142   0.691   2.554  -2.639
  274    HD2  TYR1142           HD2      TYR1142  -0.364   5.004   0.679
  275    HE1  TYR1142           HE1      TYR1142  -0.089   4.306  -4.183
  276    HE2  TYR1142           HE2      TYR1142  -1.146   6.759  -0.854
  277    HH   TYR1142           HH       TYR1142  -1.628   6.222  -4.170
  278    H    GLN1143           HN       GLN1143  -0.453  -0.417  -0.085
  279    HA   GLN1143           HA       GLN1143   0.891  -1.618   2.247
  280   1HB   GLN1143           HB2      GLN1143  -1.445  -2.251   2.302
  281   2HB   GLN1143           HB1      GLN1143  -1.392  -2.739   0.614
  282   1HG   GLN1143           HG2      GLN1143  -1.368  -4.677   2.044
  283   2HG   GLN1143           HG1      GLN1143   0.169  -4.536   1.190
  284   1HE2  GLN1143          1HE2      GLN1143   2.021  -3.998   2.331
  285   2HE2  GLN1143          2HE2      GLN1143   2.104  -4.100   4.053
  286    H    LEU1144           HN       LEU1144   2.846  -2.300   1.656
  287    HA   LEU1144           HA       LEU1144   3.538  -2.777  -1.078
  288   1HB   LEU1144           HB2      LEU1144   5.100  -1.845   0.627
  289   2HB   LEU1144           HB1      LEU1144   5.129  -3.414   1.406
  290    HG   LEU1144           HG       LEU1144   5.913  -3.189  -1.477
  291   1HD1  LEU1144          2HD1      LEU1144   7.707  -2.597   0.871
  292   2HD1  LEU1144          1HD1      LEU1144   8.229  -2.796  -0.802
  293   3HD1  LEU1144          3HD1      LEU1144   7.187  -1.444  -0.358
  294   1HD2  LEU1144          1HD2      LEU1144   5.649  -5.404  -0.488
  295   2HD2  LEU1144          3HD2      LEU1144   7.337  -5.085  -0.887
  296   3HD2  LEU1144          2HD2      LEU1144   6.792  -4.978   0.787
  297    H    GLU1145           HN       GLU1145   3.906  -4.664  -2.130
  298    HA   GLU1145           HA       GLU1145   3.235  -7.149  -0.698
  299   1HB   GLU1145           HB2      GLU1145   1.429  -6.509  -2.226
  300   2HB   GLU1145           HB1      GLU1145   2.573  -6.423  -3.558
  301   1HG   GLU1145           HG2      GLU1145   1.315  -8.476  -3.665
  302   2HG   GLU1145           HG1      GLU1145   3.011  -8.821  -3.329
  303    H    GLY1146           HN       GLY1146   4.542  -8.886  -1.007
  304   1HA   GLY1146           HA1      GLY1146   6.696  -8.648  -3.003
  305   2HA   GLY1146           HA2      GLY1146   6.117 -10.157  -2.315
  306    H    ASN1147           HN       ASN1147   8.827  -9.514  -2.405
  307    HA   ASN1147           HA       ASN1147   9.448  -9.629   0.419
  308   1HB   ASN1147           HB2      ASN1147  11.771 -10.095  -0.371
  309   2HB   ASN1147           HB1      ASN1147  10.572 -11.218  -1.001
  310   1HD2  ASN1147          1HD2      ASN1147  12.873  -8.781  -1.749
  311   2HD2  ASN1147          2HD2      ASN1147  12.748  -8.884  -3.469
  312    H    LYS1148           HN       LYS1148   8.993  -7.522   1.093
  313    HA   LYS1148           HA       LYS1148   9.957  -5.165  -0.049
  314   1HB   LYS1148           HB2      LYS1148   9.656  -4.220   2.271
  315   2HB   LYS1148           HB1      LYS1148   8.246  -4.993   1.561
  316   1HG   LYS1148           HG2      LYS1148   8.289  -5.708   3.788
  317   2HG   LYS1148           HG1      LYS1148   8.918  -7.069   2.858
  318   1HD   LYS1148           HD2      LYS1148  11.205  -6.393   3.419
  319   2HD   LYS1148           HD1      LYS1148  10.573  -5.035   4.355
  320   1HE   LYS1148           HE2      LYS1148  11.166  -6.899   5.810
  321   2HE   LYS1148           HE1      LYS1148   9.430  -6.591   5.851
  322   1HZ   LYS1148           HZ3      LYS1148  10.766  -8.724   4.273
  323   2HZ   LYS1148           HZ2      LYS1148   9.910  -8.954   5.712
  324   3HZ   LYS1148           HZ1      LYS1148   9.101  -8.431   4.322
  325    H    ARG1149           HN       ARG1149  11.603  -7.582   1.776
  326    HA   ARG1149           HA       ARG1149  13.753  -5.930   2.669
  327   1HB   ARG1149           HB2      ARG1149  13.356  -7.944   3.879
  328   2HB   ARG1149           HB1      ARG1149  13.440  -8.918   2.419
  329   1HG   ARG1149           HG2      ARG1149  15.776  -8.642   2.249
  330   2HG   ARG1149           HG1      ARG1149  15.784  -7.348   3.449
  331   1HD   ARG1149           HD2      ARG1149  16.624  -9.433   4.394
  332   2HD   ARG1149           HD1      ARG1149  15.125  -8.936   5.177
  333    HE   ARG1149           HE       ARG1149  14.551 -10.704   3.059
  334   1HH1  ARG1149          1HH1      ARG1149  15.929 -10.665   6.259
  335   2HH1  ARG1149          2HH1      ARG1149  15.495 -12.306   6.605
  336   1HH2  ARG1149          1HH2      ARG1149  13.976 -12.864   3.506
  337   2HH2  ARG1149          2HH2      ARG1149  14.384 -13.555   5.041
  338    H    ILE1150           HN       ILE1150  15.399  -5.180   1.544
  339    HA   ILE1150           HA       ILE1150  16.399  -6.669  -0.754
  340    HB   ILE1150           HB       ILE1150  16.505  -4.421  -2.026
  341   1HG1  ILE1150          2HG1      ILE1150  14.492  -2.984  -1.532
  342   2HG1  ILE1150          1HG1      ILE1150  14.302  -3.875  -0.025
  343   1HG2  ILE1150          2HG2      ILE1150  15.202  -6.346  -2.738
  344   2HG2  ILE1150          1HG2      ILE1150  13.890  -5.875  -1.655
  345   3HG2  ILE1150          3HG2      ILE1150  14.312  -4.852  -3.030
  346   1HD1  ILE1150          1HD1      ILE1150  16.533  -3.113   0.670
  347   2HD1  ILE1150          3HD1      ILE1150  16.644  -2.161  -0.811
  348   3HD1  ILE1150          2HD1      ILE1150  15.406  -1.786   0.388
  349    H    THR1151           HN       THR1151  18.409  -5.520  -1.661
  350    HA   THR1151           HA       THR1151  19.857  -3.989   0.343
  351    HB   THR1151           HB       THR1151  20.221  -6.533   0.709
  352    HG1  THR1151           HG1      THR1151  22.693  -5.301   0.346
  353   1HG2  THR1151          3HG2      THR1151  20.607  -7.051  -1.687
  354   2HG2  THR1151          2HG2      THR1151  22.081  -6.083  -1.625
  355   3HG2  THR1151          1HG2      THR1151  21.947  -7.547  -0.651
  356    H    CYS1152           HN       CYS1152  21.528  -2.783  -0.471
  357    HA   CYS1152           HA       CYS1152  21.453  -2.208  -3.264
  358   1HB   CYS1152           HB2      CYS1152  23.270  -0.593  -2.697
  359   2HB   CYS1152           HB1      CYS1152  21.835  -0.415  -1.695
  360    H    ARG1153           HN       ARG1153  23.282  -2.259  -4.700
  361    HA   ARG1153           HA       ARG1153  25.453  -4.063  -3.958
  362   1HB   ARG1153           HB2      ARG1153  25.198  -5.402  -5.991
  363   2HB   ARG1153           HB1      ARG1153  23.783  -5.529  -4.956
  364   1HG   ARG1153           HG2      ARG1153  23.887  -3.626  -7.269
  365   2HG   ARG1153           HG1      ARG1153  23.394  -5.309  -7.455
  366   1HD   ARG1153           HD2      ARG1153  21.636  -4.946  -5.756
  367   2HD   ARG1153           HD1      ARG1153  22.098  -3.243  -5.676
  368    HE   ARG1153           HE       ARG1153  20.873  -2.898  -7.561
  369   1HH1  ARG1153          1HH1      ARG1153  21.739  -6.272  -7.436
  370   2HH1  ARG1153          2HH1      ARG1153  20.832  -6.689  -8.850
  371   1HH2  ARG1153          1HH2      ARG1153  19.676  -3.441  -9.423
  372   2HH2  ARG1153          2HH2      ARG1153  19.660  -5.081  -9.980
  373    H    ASN1154           HN       ASN1154  27.268  -3.048  -4.406
  374    HA   ASN1154           HA       ASN1154  28.804  -1.672  -5.365
  375   1HB   ASN1154           HB2      ASN1154  27.304  -2.420  -7.885
  376   2HB   ASN1154           HB1      ASN1154  28.904  -1.687  -7.833
  377   1HD2  ASN1154          1HD2      ASN1154  28.035  -4.242  -8.945
  378   2HD2  ASN1154          2HD2      ASN1154  28.992  -5.450  -8.164
  379    H    GLY1155           HN       GLY1155  26.937  -0.224  -4.151
  380   1HA   GLY1155           HA1      GLY1155  27.078   2.277  -5.357
  381   2HA   GLY1155           HA2      GLY1155  25.991   1.858  -4.044
  382    H    GLN1156           HN       GLN1156  24.243   0.122  -5.131
  383    HA   GLN1156           HA       GLN1156  22.543   1.810  -6.645
  384   1HB   GLN1156           HB2      GLN1156  24.066   1.153  -8.467
  385   2HB   GLN1156           HB1      GLN1156  23.733  -0.540  -8.133
  386   1HG   GLN1156           HG2      GLN1156  22.474   0.215 -10.051
  387   2HG   GLN1156           HG1      GLN1156  21.388  -0.198  -8.725
  388   1HE2  GLN1156          1HE2      GLN1156  20.267   1.432  -7.662
  389   2HE2  GLN1156          2HE2      GLN1156  20.101   3.018  -8.327
  390    H    TRP1157           HN       TRP1157  21.109   1.268  -5.003
  391    HA   TRP1157           HA       TRP1157  20.476  -1.247  -4.045
  392   1HB   TRP1157           HB2      TRP1157  18.852   1.268  -4.292
  393   2HB   TRP1157           HB1      TRP1157  18.194  -0.189  -3.555
  394    HD1  TRP1157           HD1      TRP1157  20.826   2.517  -2.981
  395    HE1  TRP1157           HE1      TRP1157  21.482   2.496  -0.492
  396    HE3  TRP1157           HE3      TRP1157  18.328  -1.689  -1.547
  397    HZ2  TRP1157           HZ2      TRP1157  21.009   0.868   1.779
  398    HZ3  TRP1157           HZ3      TRP1157  18.485  -2.421   0.795
  399    HH2  TRP1157           HH2      TRP1157  19.797  -1.172   2.421
  400    H    SER1158           HN       SER1158  18.204  -2.163  -4.206
  401    HA   SER1158           HA       SER1158  17.428  -2.473  -7.031
  402   1HB   SER1158           HB2      SER1158  17.405  -4.557  -4.833
  403   2HB   SER1158           HB1      SER1158  16.779  -4.796  -6.463
  404    HG   SER1158           HG       SER1158  19.218  -5.204  -5.662
  405    H    GLU1159           HN       GLU1159  15.416  -1.840  -7.452
  406    HA   GLU1159           HA       GLU1159  13.658  -0.784  -5.580
  407   1HB   GLU1159           HB2      GLU1159  13.547  -0.286  -7.981
  408   2HB   GLU1159           HB1      GLU1159  13.021  -1.932  -8.306
  409   1HG   GLU1159           HG2      GLU1159  10.981  -1.536  -7.026
  410   2HG   GLU1159           HG1      GLU1159  11.508   0.115  -6.699
  411    HA   PRO1160           HA       PRO1160  11.894  -4.361  -3.638
  412   1HB   PRO1160           HB2      PRO1160   9.521  -3.267  -2.824
  413   2HB   PRO1160           HB1      PRO1160  11.057  -3.003  -1.994
  414   1HG   PRO1160           HG2      PRO1160   9.644  -1.255  -3.966
  415   2HG   PRO1160           HG1      PRO1160  10.461  -0.806  -2.458
  416   1HD   PRO1160           HD2      PRO1160  11.627  -0.458  -4.855
  417   2HD   PRO1160           HD1      PRO1160  12.562  -0.919  -3.418
  418    HA   PRO1161           HA       PRO1161   9.130  -6.592  -6.236
  419   1HB   PRO1161           HB2      PRO1161   6.915  -6.984  -4.550
  420   2HB   PRO1161           HB1      PRO1161   8.305  -8.058  -4.726
  421   1HG   PRO1161           HG2      PRO1161   7.759  -5.983  -2.658
  422   2HG   PRO1161           HG1      PRO1161   8.575  -7.549  -2.495
  423   1HD   PRO1161           HD2      PRO1161   9.964  -5.271  -2.525
  424   2HD   PRO1161           HD1      PRO1161  10.583  -6.727  -3.336
  425    H    LYS1162           HN       LYS1162   6.557  -5.078  -4.312
  426    HA   LYS1162           HA       LYS1162   6.012  -3.081  -6.312
  427   1HB   LYS1162           HB2      LYS1162   5.122  -5.325  -7.221
  428   2HB   LYS1162           HB1      LYS1162   3.875  -5.171  -5.991
  429   1HG   LYS1162           HG2      LYS1162   3.052  -3.162  -6.961
  430   2HG   LYS1162           HG1      LYS1162   4.429  -3.060  -8.059
  431   1HD   LYS1162           HD2      LYS1162   2.599  -3.876  -9.332
  432   2HD   LYS1162           HD1      LYS1162   3.670  -5.249  -9.043
  433   1HE   LYS1162           HE2      LYS1162   1.395  -5.947  -8.706
  434   2HE   LYS1162           HE1      LYS1162   2.227  -5.923  -7.151
  435   1HZ   LYS1162           HZ2      LYS1162   0.449  -3.769  -8.158
  436   2HZ   LYS1162           HZ1      LYS1162   0.000  -4.952  -7.036
  437   3HZ   LYS1162           HZ3      LYS1162   1.196  -3.821  -6.642
  438    H    CYS1163           HN       CYS1163   3.856  -1.959  -5.831
  439    HA   CYS1163           HA       CYS1163   3.366  -1.977  -2.928
  440   1HB   CYS1163           HB2      CYS1163   4.712  -0.011  -3.750
  441   2HB   CYS1163           HB1      CYS1163   3.308   0.472  -4.695
  442    H    LEU1164           HN       LEU1164   1.439  -2.988  -2.801
  443    HA   LEU1164           HA       LEU1164  -0.648  -2.694  -4.714
  444   1HB   LEU1164           HB2      LEU1164  -0.188  -4.167  -2.241
  445   2HB   LEU1164           HB1      LEU1164  -1.840  -3.600  -2.384
  446    HG   LEU1164           HG       LEU1164  -2.037  -4.740  -4.559
  447   1HD1  LEU1164          2HD1      LEU1164   0.743  -5.734  -3.953
  448   2HD1  LEU1164          1HD1      LEU1164  -0.291  -6.317  -5.256
  449   3HD1  LEU1164          3HD1      LEU1164   0.283  -4.649  -5.264
  450   1HD2  LEU1164          2HD2      LEU1164  -2.719  -5.890  -2.523
  451   2HD2  LEU1164          1HD2      LEU1164  -2.056  -7.024  -3.701
  452   3HD2  LEU1164          3HD2      LEU1164  -1.082  -6.517  -2.320
  453    H    HIS1165           HN       HIS1165  -1.493  -0.714  -5.002
  454    HA   HIS1165           HA       HIS1165  -1.744   1.308  -3.116
  455   1HB   HIS1165           HB2      HIS1165  -3.523   0.784  -5.508
  456   2HB   HIS1165           HB1      HIS1165  -3.395   2.311  -4.642
  457    HD1  HIS1165           HD1      HIS1165  -1.523   3.862  -5.299
  458    HD2  HIS1165           HD2      HIS1165  -1.165   0.091  -7.006
  459    HE1  HIS1165           HE1      HIS1165   0.341   4.058  -6.975
  460    HE2  HIS1165           HE2      HIS1165   0.487   1.784  -8.052
  461    HA   PRO1166           HA       PRO1166  -4.891   0.099  -0.275
  462   1HB   PRO1166           HB2      PRO1166  -6.263   2.526  -0.128
  463   2HB   PRO1166           HB1      PRO1166  -4.869   2.070   0.852
  464   1HG   PRO1166           HG2      PRO1166  -4.988   3.737  -1.618
  465   2HG   PRO1166           HG1      PRO1166  -3.967   3.928  -0.180
  466   1HD   PRO1166           HD2      PRO1166  -2.977   2.932  -2.457
  467   2HD   PRO1166           HD1      PRO1166  -2.465   2.296  -0.878
  468    H    CYS1167           HN       CYS1167  -7.341   0.264   0.011
  469    HA   CYS1167           HA       CYS1167  -8.552  -0.619  -2.440
  470   1HB   CYS1167           HB2      CYS1167 -10.596  -0.715  -0.816
  471   2HB   CYS1167           HB1      CYS1167  -9.286  -1.874  -0.643
  472    H    VAL1168           HN       VAL1168  -7.875   1.937  -2.902
  473    HA   VAL1168           HA       VAL1168  -9.555   3.995  -2.217
  474    HB   VAL1168           HB       VAL1168  -8.381   3.567  -4.969
  475   1HG1  VAL1168          1HG1      VAL1168 -10.043   5.349  -4.892
  476   2HG1  VAL1168          3HG1      VAL1168  -9.199   6.090  -3.533
  477   3HG1  VAL1168          2HG1      VAL1168  -8.423   6.010  -5.114
  478   1HG2  VAL1168          2HG2      VAL1168  -7.170   4.860  -2.529
  479   2HG2  VAL1168          1HG2      VAL1168  -6.660   3.345  -3.273
  480   3HG2  VAL1168          3HG2      VAL1168  -6.465   4.865  -4.145
  481    H    ILE1169           HN       ILE1169 -11.680   3.474  -2.035
  482    HA   ILE1169           HA       ILE1169 -13.127   2.370  -4.303
  483    HB   ILE1169           HB       ILE1169 -13.517   1.705  -1.869
  484   1HG1  ILE1169          2HG1      ILE1169 -15.831   2.611  -3.593
  485   2HG1  ILE1169          1HG1      ILE1169 -15.073   1.022  -3.586
  486   1HG2  ILE1169          2HG2      ILE1169 -13.510   3.937  -0.921
  487   2HG2  ILE1169          1HG2      ILE1169 -14.956   4.351  -1.845
  488   3HG2  ILE1169          3HG2      ILE1169 -15.036   3.120  -0.584
  489   1HD1  ILE1169          2HD1      ILE1169 -16.616   2.237  -1.308
  490   2HD1  ILE1169          1HD1      ILE1169 -17.215   1.008  -2.426
  491   3HD1  ILE1169          3HD1      ILE1169 -15.884   0.633  -1.330
  492    H    SER1170           HN       SER1170 -15.458   3.507  -4.488
  493    HA   SER1170           HA       SER1170 -14.874   6.328  -5.064
  494   1HB   SER1170           HB2      SER1170 -15.498   5.001  -7.018
  495   2HB   SER1170           HB1      SER1170 -16.995   4.509  -6.227
  496    HG   SER1170           HG       SER1170 -17.687   6.646  -6.289
  497    H    ARG1171           HN       ARG1171 -15.485   7.546  -3.376
  498    HA   ARG1171           HA       ARG1171 -17.566   6.984  -1.570
  499   1HB   ARG1171           HB2      ARG1171 -17.357   9.349  -0.901
  500   2HB   ARG1171           HB1      ARG1171 -15.788   8.569  -1.046
  501   1HG   ARG1171           HG2      ARG1171 -15.466   9.609  -3.230
  502   2HG   ARG1171           HG1      ARG1171 -17.045  10.385  -3.094
  503   1HD   ARG1171           HD2      ARG1171 -16.279  11.578  -1.096
  504   2HD   ARG1171           HD1      ARG1171 -14.699  10.812  -1.247
  505    HE   ARG1171           HE       ARG1171 -15.286  12.121  -3.650
  506   1HH1  ARG1171          1HH1      ARG1171 -14.574  12.866  -0.322
  507   2HH1  ARG1171          2HH1      ARG1171 -13.858  14.401  -0.683
  508   1HH2  ARG1171          1HH2      ARG1171 -14.344  14.140  -4.136
  509   2HH2  ARG1171          2HH2      ARG1171 -13.728  15.125  -2.852
  510    H    GLU1172           HN       GLU1172 -17.504   8.650  -4.650
  511    HA   GLU1172           HA       GLU1172 -20.085   9.812  -4.483
  512   1HB   GLU1172           HB2      GLU1172 -18.205  10.426  -6.090
  513   2HB   GLU1172           HB1      GLU1172 -18.667   9.010  -7.023
  514   1HG   GLU1172           HG2      GLU1172 -19.678  10.933  -8.004
  515   2HG   GLU1172           HG1      GLU1172 -20.941   9.959  -7.252
  516    H    ILE1173           HN       ILE1173 -19.331   6.679  -4.330
  517    HA   ILE1173           HA       ILE1173 -21.737   5.825  -5.796
  518    HB   ILE1173           HB       ILE1173 -19.146   4.380  -5.292
  519   1HG1  ILE1173          2HG1      ILE1173 -19.439   5.926  -7.262
  520   2HG1  ILE1173          1HG1      ILE1173 -18.991   4.272  -7.670
  521   1HG2  ILE1173          2HG2      ILE1173 -21.028   2.876  -4.775
  522   2HG2  ILE1173          1HG2      ILE1173 -21.682   3.176  -6.384
  523   3HG2  ILE1173          3HG2      ILE1173 -20.125   2.369  -6.203
  524   1HD1  ILE1173          1HD1      ILE1173 -21.321   3.797  -8.239
  525   2HD1  ILE1173          3HD1      ILE1173 -21.751   5.460  -7.840
  526   3HD1  ILE1173          2HD1      ILE1173 -20.670   5.130  -9.193
  527    H    MET1174           HN       MET1174 -19.665   4.743  -3.084
  528    HA   MET1174           HA       MET1174 -21.709   3.259  -1.840
  529   1HB   MET1174           HB2      MET1174 -20.171   3.343   0.167
  530   2HB   MET1174           HB1      MET1174 -19.474   2.687  -1.308
  531   1HG   MET1174           HG2      MET1174 -18.271   4.698  -1.724
  532   2HG   MET1174           HG1      MET1174 -19.114   5.534  -0.422
  533   1HE   MET1174           HE2      MET1174 -17.061   6.393   0.831
  534   2HE   MET1174           HE1      MET1174 -15.618   5.434   1.156
  535   3HE   MET1174           HE3      MET1174 -16.072   5.808  -0.506
  536    H    GLU1175           HN       GLU1175 -20.208   6.294  -0.674
  537    HA   GLU1175           HA       GLU1175 -22.293   6.768   1.196
  538   1HB   GLU1175           HB2      GLU1175 -21.039   8.536   1.923
  539   2HB   GLU1175           HB1      GLU1175 -19.781   7.648   1.067
  540   1HG   GLU1175           HG2      GLU1175 -19.944   9.097  -0.817
  541   2HG   GLU1175           HG1      GLU1175 -21.378   9.884  -0.162
  542    H    ASN1176           HN       ASN1176 -22.534   6.806  -2.013
  543    HA   ASN1176           HA       ASN1176 -24.136   9.249  -2.196
  544   1HB   ASN1176           HB2      ASN1176 -22.366   8.760  -3.905
  545   2HB   ASN1176           HB1      ASN1176 -23.347   7.392  -4.412
  546   1HD2  ASN1176          1HD2      ASN1176 -22.541   9.780  -5.888
  547   2HD2  ASN1176          2HD2      ASN1176 -24.006  10.520  -6.426
  548    H    TYR1177           HN       TYR1177 -24.410   5.978  -3.582
  549    HA   TYR1177           HA       TYR1177 -27.125   6.039  -4.077
  550   1HB   TYR1177           HB2      TYR1177 -25.418   3.657  -3.341
  551   2HB   TYR1177           HB1      TYR1177 -27.037   3.556  -4.025
  552    HD1  TYR1177           HD1      TYR1177 -27.023   5.538  -6.144
  553    HD2  TYR1177           HD2      TYR1177 -23.945   2.870  -4.925
  554    HE1  TYR1177           HE1      TYR1177 -26.071   5.610  -8.411
  555    HE2  TYR1177           HE2      TYR1177 -22.982   2.936  -7.179
  556    HH   TYR1177           HH       TYR1177 -23.709   3.423  -9.482
  557    H    ASN1178           HN       ASN1178 -25.821   4.007  -1.476
  558    HA   ASN1178           HA       ASN1178 -27.266   5.102   0.622
  559   1HB   ASN1178           HB2      ASN1178 -28.916   2.948   0.653
  560   2HB   ASN1178           HB1      ASN1178 -29.373   4.522   0.008
  561   1HD2  ASN1178          1HD2      ASN1178 -30.871   3.567  -1.369
  562   2HD2  ASN1178          2HD2      ASN1178 -30.390   2.721  -2.797
  563    H    ILE1179           HN       ILE1179 -24.714   3.891   0.186
  564    HA   ILE1179           HA       ILE1179 -24.865   1.833   2.270
  565    HB   ILE1179           HB       ILE1179 -23.026   0.571   1.111
  566   1HG1  ILE1179          2HG1      ILE1179 -23.957   2.038  -1.358
  567   2HG1  ILE1179          1HG1      ILE1179 -22.513   2.504  -0.466
  568   1HG2  ILE1179          3HG2      ILE1179 -25.309  -0.248   1.168
  569   2HG2  ILE1179          2HG2      ILE1179 -25.707   0.710  -0.259
  570   3HG2  ILE1179          1HG2      ILE1179 -24.561  -0.624  -0.385
  571   1HD1  ILE1179          2HD1      ILE1179 -22.981  -0.192  -1.711
  572   2HD1  ILE1179          1HD1      ILE1179 -22.008   1.103  -2.411
  573   3HD1  ILE1179          3HD1      ILE1179 -21.515   0.349  -0.894
  574    H    ALA1180           HN       ALA1180 -23.595   2.306   3.906
  575    HA   ALA1180           HA       ALA1180 -21.174   3.919   3.416
  576   1HB   ALA1180           HB3      ALA1180 -21.513   5.001   5.572
  577   2HB   ALA1180           HB2      ALA1180 -22.913   5.248   4.529
  578   3HB   ALA1180           HB1      ALA1180 -22.982   4.058   5.830
  579    H    LEU1181           HN       LEU1181 -19.420   3.554   4.961
  580    HA   LEU1181           HA       LEU1181 -18.765   0.899   5.312
  581   1HB   LEU1181           HB2      LEU1181 -17.799   3.431   6.558
  582   2HB   LEU1181           HB1      LEU1181 -17.243   1.906   7.220
  583    HG   LEU1181           HG       LEU1181 -15.652   2.839   5.598
  584   1HD1  LEU1181          2HD1      LEU1181 -17.009   0.322   4.646
  585   2HD1  LEU1181          1HD1      LEU1181 -15.379   0.841   4.217
  586   3HD1  LEU1181          3HD1      LEU1181 -15.763   0.427   5.889
  587   1HD2  LEU1181          3HD2      LEU1181 -17.894   2.509   3.611
  588   2HD2  LEU1181          2HD2      LEU1181 -17.202   4.035   4.161
  589   3HD2  LEU1181          1HD2      LEU1181 -16.223   2.911   3.217
  590    H    ARG1182           HN       ARG1182 -18.304  -0.205   7.455
  591    HA   ARG1182           HA       ARG1182 -20.742  -0.607   8.824
  592   1HB   ARG1182           HB2      ARG1182 -19.437  -2.084  10.303
  593   2HB   ARG1182           HB1      ARG1182 -19.118  -2.396   8.604
  594   1HG   ARG1182           HG2      ARG1182 -17.038  -1.131   8.752
  595   2HG   ARG1182           HG1      ARG1182 -17.358  -0.805  10.457
  596   1HD   ARG1182           HD2      ARG1182 -17.302  -3.203  10.928
  597   2HD   ARG1182           HD1      ARG1182 -16.989  -3.532   9.225
  598    HE   ARG1182           HE       ARG1182 -15.016  -1.785  10.120
  599   1HH1  ARG1182          1HH1      ARG1182 -16.084  -5.047  10.716
  600   2HH1  ARG1182          2HH1      ARG1182 -14.509  -5.620  11.154
  601   1HH2  ARG1182          1HH2      ARG1182 -12.939  -2.530  10.695
  602   2HH2  ARG1182          2HH2      ARG1182 -12.722  -4.189  11.143
  603    H    TRP1183           HN       TRP1183 -18.657   1.908   9.059
  604    HA   TRP1183           HA       TRP1183 -19.027   2.309  11.936
  605   1HB   TRP1183           HB2      TRP1183 -17.428   4.076  10.089
  606   2HB   TRP1183           HB1      TRP1183 -17.266   3.886  11.833
  607    HD1  TRP1183           HD1      TRP1183 -16.715   1.775   8.625
  608    HE1  TRP1183           HE1      TRP1183 -14.760   0.162   9.059
  609    HE3  TRP1183           HE3      TRP1183 -15.782   2.920  13.523
  610    HZ2  TRP1183           HZ2      TRP1183 -13.044  -0.521  11.174
  611    HZ3  TRP1183           HZ3      TRP1183 -13.957   1.738  14.678
  612    HH2  TRP1183           HH2      TRP1183 -12.616   0.052  13.527
  613    H    THR1184           HN       THR1184 -20.435   3.081   9.009
  614    HA   THR1184           HA       THR1184 -21.921   4.652   8.277
  615    HB   THR1184           HB       THR1184 -23.743   5.140   9.769
  616    HG1  THR1184           HG1      THR1184 -22.947   4.062  12.070
  617   1HG2  THR1184          2HG2      THR1184 -23.594   2.830   8.986
  618   2HG2  THR1184          1HG2      THR1184 -22.609   2.410  10.387
  619   3HG2  THR1184          3HG2      THR1184 -24.288   2.900  10.605
  620    H    ALA1185           HN       ALA1185 -19.320   5.664   9.151
  621    HA   ALA1185           HA       ALA1185 -19.839   8.202  10.432
  622   1HB   ALA1185           HB3      ALA1185 -17.296   7.137   9.212
  623   2HB   ALA1185           HB1      ALA1185 -17.775   6.973  10.901
  624   3HB   ALA1185           HB2      ALA1185 -17.442   8.570  10.230
  625    H    LYS1186           HN       LYS1186 -20.584   7.226   7.471
  626    HA   LYS1186           HA       LYS1186 -21.125   8.309   5.561
  627   1HB   LYS1186           HB2      LYS1186 -20.235  10.732   7.120
  628   2HB   LYS1186           HB1      LYS1186 -20.923  10.813   5.505
  629   1HG   LYS1186           HG2      LYS1186 -22.987   9.796   6.339
  630   2HG   LYS1186           HG1      LYS1186 -22.292   9.731   7.960
  631   1HD   LYS1186           HD2      LYS1186 -23.724  11.656   7.811
  632   2HD   LYS1186           HD1      LYS1186 -22.048  12.202   7.899
  633   1HE   LYS1186           HE2      LYS1186 -23.291  13.473   6.233
  634   2HE   LYS1186           HE1      LYS1186 -22.018  12.516   5.476
  635   1HZ   LYS1186           HZ2      LYS1186 -24.895  11.785   5.583
  636   2HZ   LYS1186           HZ1      LYS1186 -24.078  12.387   4.228
  637   3HZ   LYS1186           HZ3      LYS1186 -23.673  10.869   4.855
  638    H    GLN1187           HN       GLN1187 -19.900   7.709   3.960
  639    HA   GLN1187           HA       GLN1187 -18.283   7.821   2.352
  640   1HB   GLN1187           HB2      GLN1187 -18.076  10.227   2.742
  641   2HB   GLN1187           HB1      GLN1187 -17.010   9.928   4.107
  642   1HG   GLN1187           HG2      GLN1187 -15.410   8.850   2.540
  643   2HG   GLN1187           HG1      GLN1187 -16.453   9.353   1.210
  644   1HE2  GLN1187          1HE2      GLN1187 -16.603  11.533   0.683
  645   2HE2  GLN1187          2HE2      GLN1187 -15.451  12.693   1.239
  646    H    LYS1188           HN       LYS1188 -15.999   8.622   4.905
  647    HA   LYS1188           HA       LYS1188 -14.361   7.434   5.941
  648   1HB   LYS1188           HB2      LYS1188 -16.257   5.936   6.613
  649   2HB   LYS1188           HB1      LYS1188 -15.940   4.967   5.181
  650   1HG   LYS1188           HG2      LYS1188 -14.948   3.922   7.106
  651   2HG   LYS1188           HG1      LYS1188 -13.675   4.499   6.027
  652   1HD   LYS1188           HD2      LYS1188 -13.387   6.483   7.438
  653   2HD   LYS1188           HD1      LYS1188 -14.652   5.895   8.519
  654   1HE   LYS1188           HE2      LYS1188 -12.037   4.510   7.932
  655   2HE   LYS1188           HE1      LYS1188 -12.426   5.405   9.401
  656   1HZ   LYS1188           HZ3      LYS1188 -13.811   2.953   8.455
  657   2HZ   LYS1188           HZ2      LYS1188 -12.690   3.028   9.720
  658   3HZ   LYS1188           HZ1      LYS1188 -14.182   3.812   9.864
  659    H    LEU1189           HN       LEU1189 -15.102   7.345   2.776
  660    HA   LEU1189           HA       LEU1189 -14.115   6.699   0.850
  661   1HB   LEU1189           HB2      LEU1189 -11.715   7.329   2.559
  662   2HB   LEU1189           HB1      LEU1189 -11.645   7.094   0.822
  663    HG   LEU1189           HG       LEU1189 -13.128   9.281   2.283
  664   1HD1  LEU1189          1HD1      LEU1189 -10.742   9.354   0.443
  665   2HD1  LEU1189          3HD1      LEU1189 -11.551  10.757   1.139
  666   3HD1  LEU1189          2HD1      LEU1189 -10.719   9.610   2.187
  667   1HD2  LEU1189          3HD2      LEU1189 -12.995   8.655  -0.663
  668   2HD2  LEU1189          2HD2      LEU1189 -14.428   8.613   0.366
  669   3HD2  LEU1189          1HD2      LEU1189 -13.631  10.150   0.024
  670    H    TYR1190           HN       TYR1190 -11.265   5.484   2.415
  671    HA   TYR1190           HA       TYR1190 -12.170   2.737   2.074
  672   1HB   TYR1190           HB2      TYR1190  -9.847   2.446   0.785
  673   2HB   TYR1190           HB1      TYR1190 -11.368   2.768  -0.041
  674    HD1  TYR1190           HD1      TYR1190 -11.900   5.096  -0.762
  675    HD2  TYR1190           HD2      TYR1190  -8.065   4.003   0.717
  676    HE1  TYR1190           HE1      TYR1190 -10.944   7.134  -1.757
  677    HE2  TYR1190           HE2      TYR1190  -7.097   6.039  -0.270
  678    HH   TYR1190           HH       TYR1190  -7.603   7.630  -2.079
  679    H    SER1191           HN       SER1191  -9.610   1.589   2.042
  680    HA   SER1191           HA       SER1191  -8.401   2.353   4.595
  681   1HB   SER1191           HB2      SER1191  -9.722  -0.217   3.912
  682   2HB   SER1191           HB1      SER1191  -8.269  -0.282   4.900
  683    HG   SER1191           HG       SER1191  -9.984   1.643   5.759
  684    H    ARG1192           HN       ARG1192  -6.565   0.499   4.938
  685    HA   ARG1192           HA       ARG1192  -4.787   0.834   2.662
  686   1HB   ARG1192           HB2      ARG1192  -3.935   1.317   4.920
  687   2HB   ARG1192           HB1      ARG1192  -4.309  -0.327   5.419
  688   1HG   ARG1192           HG2      ARG1192  -2.680  -1.177   3.791
  689   2HG   ARG1192           HG1      ARG1192  -2.285   0.484   3.343
  690   1HD   ARG1192           HD2      ARG1192  -1.540   0.938   5.613
  691   2HD   ARG1192           HD1      ARG1192  -1.981  -0.698   6.100
  692    HE   ARG1192           HE       ARG1192  -0.213  -0.973   4.000
  693   1HH1  ARG1192          1HH1      ARG1192  -0.181   0.426   7.190
  694   2HH1  ARG1192          2HH1      ARG1192   1.512   0.153   7.434
  695   1HH2  ARG1192          1HH2      ARG1192   2.017  -1.336   4.311
  696   2HH2  ARG1192          2HH2      ARG1192   2.761  -0.847   5.796
  697    H    THR1193           HN       THR1193  -4.637  -0.707   1.155
  698    HA   THR1193           HA       THR1193  -6.070  -2.932   0.872
  699    HB   THR1193           HB       THR1193  -3.242  -2.410   0.019
  700    HG1  THR1193           HG1      THR1193  -5.611  -2.871  -1.488
  701   1HG2  THR1193          2HG2      THR1193  -4.805  -4.933  -0.540
  702   2HG2  THR1193          1HG2      THR1193  -3.332  -4.451  -1.380
  703   3HG2  THR1193          3HG2      THR1193  -3.284  -4.812   0.346
  704    H    GLY1194           HN       GLY1194  -6.427  -4.721   1.944
  705   1HA   GLY1194           HA1      GLY1194  -4.366  -5.670   3.834
  706   2HA   GLY1194           HA2      GLY1194  -5.309  -6.779   2.844
  707    H    GLU1195           HN       GLU1195  -6.778  -3.930   4.140
  708    HA   GLU1195           HA       GLU1195  -7.931  -5.372   6.400
  709   1HB   GLU1195           HB2      GLU1195  -8.171  -2.473   5.563
  710   2HB   GLU1195           HB1      GLU1195  -8.855  -3.161   7.030
  711   1HG   GLU1195           HG2      GLU1195  -5.924  -3.044   6.355
  712   2HG   GLU1195           HG1      GLU1195  -6.772  -1.954   7.452
  713    H    SER1196           HN       SER1196 -10.190  -5.552   6.724
  714    HA   SER1196           HA       SER1196 -11.662  -5.971   4.279
  715   1HB   SER1196           HB2      SER1196 -13.432  -6.840   5.768
  716   2HB   SER1196           HB1      SER1196 -11.869  -7.580   6.110
  717    HG   SER1196           HG       SER1196 -12.365  -5.301   7.554
  718    H    VAL1197           HN       VAL1197 -13.278  -4.759   3.455
  719    HA   VAL1197           HA       VAL1197 -13.983  -2.303   4.921
  720    HB   VAL1197           HB       VAL1197 -14.668  -2.014   2.184
  721   1HG1  VAL1197          1HG1      VAL1197 -12.493  -0.756   3.851
  722   2HG1  VAL1197          3HG1      VAL1197 -13.074  -0.142   2.303
  723   3HG1  VAL1197          2HG1      VAL1197 -14.157  -0.192   3.694
  724   1HG2  VAL1197          2HG2      VAL1197 -11.834  -2.953   2.595
  725   2HG2  VAL1197          1HG2      VAL1197 -13.077  -3.744   1.627
  726   3HG2  VAL1197          3HG2      VAL1197 -12.441  -2.174   1.134
  727    H    GLU1198           HN       GLU1198 -15.845  -2.851   5.915
  728    HA   GLU1198           HA       GLU1198 -17.955  -4.164   4.374
  729   1HB   GLU1198           HB2      GLU1198 -17.812  -5.233   6.421
  730   2HB   GLU1198           HB1      GLU1198 -17.412  -3.756   7.285
  731   1HG   GLU1198           HG2      GLU1198 -19.646  -3.033   7.300
  732   2HG   GLU1198           HG1      GLU1198 -20.128  -4.239   6.104
  733    H    PHE1199           HN       PHE1199 -19.714  -3.109   3.649
  734    HA   PHE1199           HA       PHE1199 -20.084  -0.322   4.537
  735   1HB   PHE1199           HB2      PHE1199 -20.902  -1.383   1.835
  736   2HB   PHE1199           HB1      PHE1199 -20.797   0.295   2.352
  737    HD1  PHE1199           HD1      PHE1199 -18.821   1.521   2.089
  738    HD2  PHE1199           HD2      PHE1199 -18.790  -2.700   1.566
  739    HE1  PHE1199           HE1      PHE1199 -16.546   1.659   1.157
  740    HE2  PHE1199           HE2      PHE1199 -16.521  -2.576   0.645
  741    HZ   PHE1199           HZ       PHE1199 -15.390  -0.396   0.438
  742    H    VAL1200           HN       VAL1200 -21.660  -0.693   6.088
  743    HA   VAL1200           HA       VAL1200 -23.841  -2.394   5.915
  744    HB   VAL1200           HB       VAL1200 -24.990  -0.882   7.500
  745   1HG1  VAL1200          2HG1      VAL1200 -23.350  -2.471   8.343
  746   2HG1  VAL1200          1HG1      VAL1200 -22.061  -1.293   8.094
  747   3HG1  VAL1200          3HG1      VAL1200 -23.319  -0.983   9.291
  748   1HG2  VAL1200          3HG2      VAL1200 -24.325   1.253   6.534
  749   2HG2  VAL1200          2HG2      VAL1200 -23.892   1.178   8.242
  750   3HG2  VAL1200          1HG2      VAL1200 -22.651   0.960   7.009
  751    H    CYS1201           HN       CYS1201 -26.130  -1.856   5.482
  752    HA   CYS1201           HA       CYS1201 -26.363  -0.496   2.956
  753   1HB   CYS1201           HB2      CYS1201 -28.465  -1.803   4.693
  754   2HB   CYS1201           HB1      CYS1201 -28.735  -1.188   3.068
  755    H    LYS1202           HN       LYS1202 -25.541   1.325   4.830
  756    HA   LYS1202           HA       LYS1202 -26.049   3.274   5.920
  757   1HB   LYS1202           HB2      LYS1202 -26.241   3.845   3.519
  758   2HB   LYS1202           HB1      LYS1202 -27.962   3.490   3.592
  759   1HG   LYS1202           HG2      LYS1202 -28.281   5.297   5.189
  760   2HG   LYS1202           HG1      LYS1202 -26.550   5.642   5.153
  761   1HD   LYS1202           HD2      LYS1202 -26.646   6.297   2.868
  762   2HD   LYS1202           HD1      LYS1202 -28.299   5.697   2.708
  763   1HE   LYS1202           HE2      LYS1202 -27.407   8.010   4.431
  764   2HE   LYS1202           HE1      LYS1202 -28.242   8.138   2.884
  765   1HZ   LYS1202           HZ3      LYS1202 -30.136   6.992   3.855
  766   2HZ   LYS1202           HZ2      LYS1202 -29.334   6.877   5.340
  767   3HZ   LYS1202           HZ1      LYS1202 -29.770   8.393   4.730
  768    H    ARG1203           HN       ARG1203 -26.950   2.523   7.797
  769    HA   ARG1203           HA       ARG1203 -28.841   1.456   8.934
  770   1HB   ARG1203           HB2      ARG1203 -28.567   4.437   9.141
  771   2HB   ARG1203           HB1      ARG1203 -29.599   3.511  10.219
  772   1HG   ARG1203           HG2      ARG1203 -27.659   2.215  10.956
  773   2HG   ARG1203           HG1      ARG1203 -26.629   3.161   9.880
  774   1HD   ARG1203           HD2      ARG1203 -28.251   4.249  12.178
  775   2HD   ARG1203           HD1      ARG1203 -26.510   3.966  12.190
  776    HE   ARG1203           HE       ARG1203 -27.233   5.670  10.045
  777   1HH1  ARG1203          1HH1      ARG1203 -26.808   5.628  13.504
  778   2HH1  ARG1203          2HH1      ARG1203 -26.427   7.314  13.606
  779   1HH2  ARG1203          1HH2      ARG1203 -26.732   7.891  10.172
  780   2HH2  ARG1203          2HH2      ARG1203 -26.384   8.600  11.713
  781    H    GLY1204           HN       GLY1204 -30.460   0.603   7.634
  782   1HA   GLY1204           HA1      GLY1204 -32.508   2.500   6.696
  783   2HA   GLY1204           HA2      GLY1204 -32.967   1.160   7.732
  784    H    TYR1205           HN       TYR1205 -31.116   1.699   4.726
  785    HA   TYR1205           HA       TYR1205 -32.816   0.209   3.090
  786   1HB   TYR1205           HB2      TYR1205 -29.868   0.601   2.646
  787   2HB   TYR1205           HB1      TYR1205 -31.087   0.285   1.425
  788    HD1  TYR1205           HD1      TYR1205 -29.520   2.811   3.519
  789    HD2  TYR1205           HD2      TYR1205 -32.679   2.050   0.775
  790    HE1  TYR1205           HE1      TYR1205 -29.810   5.231   3.190
  791    HE2  TYR1205           HE2      TYR1205 -32.977   4.468   0.437
  792    HH   TYR1205           HH       TYR1205 -32.510   6.565   1.630
  793    H    ARG1206           HN       ARG1206 -32.414  -1.757   1.956
  794    HA   ARG1206           HA       ARG1206 -30.877  -3.748   3.485
  795   1HB   ARG1206           HB2      ARG1206 -32.637  -5.363   3.260
  796   2HB   ARG1206           HB1      ARG1206 -33.328  -3.907   3.962
  797   1HG   ARG1206           HG2      ARG1206 -34.322  -3.289   1.877
  798   2HG   ARG1206           HG1      ARG1206 -33.483  -4.596   1.039
  799   1HD   ARG1206           HD2      ARG1206 -34.719  -6.243   2.355
  800   2HD   ARG1206           HD1      ARG1206 -35.554  -4.942   3.203
  801    HE   ARG1206           HE       ARG1206 -35.962  -4.610   0.455
  802   1HH1  ARG1206          1HH1      ARG1206 -36.812  -6.812   3.018
  803   2HH1  ARG1206          2HH1      ARG1206 -38.307  -7.290   2.286
  804   1HH2  ARG1206          1HH2      ARG1206 -37.927  -5.234  -0.517
  805   2HH2  ARG1206          2HH2      ARG1206 -38.941  -6.394   0.277
  806    H    LEU1207           HN       LEU1207 -29.772  -5.224   2.301
  807    HA   LEU1207           HA       LEU1207 -28.712  -4.829  -0.105
  808   1HB   LEU1207           HB2      LEU1207 -29.301  -7.238   1.429
  809   2HB   LEU1207           HB1      LEU1207 -29.203  -7.548  -0.289
  810    HG   LEU1207           HG       LEU1207 -27.058  -7.964   0.700
  811   1HD1  LEU1207          3HD1      LEU1207 -27.049  -5.374  -0.839
  812   2HD1  LEU1207          2HD1      LEU1207 -25.641  -6.403  -0.557
  813   3HD1  LEU1207          1HD1      LEU1207 -26.996  -7.003  -1.517
  814   1HD2  LEU1207          1HD2      LEU1207 -27.329  -6.585   2.690
  815   2HD2  LEU1207          3HD2      LEU1207 -25.805  -6.254   1.866
  816   3HD2  LEU1207          2HD2      LEU1207 -27.158  -5.133   1.704
  817    H    SER1208           HN       SER1208 -29.514  -4.297  -2.018
  818    HA   SER1208           HA       SER1208 -32.221  -4.759  -2.752
  819   1HB   SER1208           HB2      SER1208 -30.988  -2.793  -3.543
  820   2HB   SER1208           HB1      SER1208 -29.886  -3.835  -4.442
  821    HG   SER1208           HG       SER1208 -31.306  -3.436  -5.969
  822    H    SER1209           HN       SER1209 -29.830  -6.919  -2.548
  823    HA   SER1209           HA       SER1209 -29.659  -9.081  -3.244
  824   1HB   SER1209           HB2      SER1209 -32.097  -9.180  -3.449
  825   2HB   SER1209           HB1      SER1209 -32.005  -8.444  -5.049
  826    HG   SER1209           HG       SER1209 -30.393 -10.499  -5.121
  827    H    ARG1210           HN       ARG1210 -30.294  -6.811  -5.907
  828    HA   ARG1210           HA       ARG1210 -28.673  -8.175  -7.789
  829   1HB   ARG1210           HB2      ARG1210 -29.487  -5.262  -7.743
  830   2HB   ARG1210           HB1      ARG1210 -28.861  -6.135  -9.134
  831   1HG   ARG1210           HG2      ARG1210 -31.444  -6.750  -7.713
  832   2HG   ARG1210           HG1      ARG1210 -31.292  -5.851  -9.224
  833   1HD   ARG1210           HD2      ARG1210 -30.302  -7.808 -10.296
  834   2HD   ARG1210           HD1      ARG1210 -30.429  -8.708  -8.785
  835    HE   ARG1210           HE       ARG1210 -32.966  -7.730  -9.515
  836   1HH1  ARG1210          1HH1      ARG1210 -30.608 -10.110 -10.472
  837   2HH1  ARG1210          2HH1      ARG1210 -31.781 -11.189 -11.151
  838   1HH2  ARG1210          1HH2      ARG1210 -34.518  -9.145 -10.406
  839   2HH2  ARG1210          2HH2      ARG1210 -34.004 -10.639 -11.113
  840    H    SER1211           HN       SER1211 -27.919  -6.376  -5.062
  841    HA   SER1211           HA       SER1211 -25.534  -5.090  -5.918
  842   1HB   SER1211           HB2      SER1211 -26.475  -5.915  -3.162
  843   2HB   SER1211           HB1      SER1211 -25.066  -4.904  -3.469
  844    HG   SER1211           HG       SER1211 -26.709  -3.581  -4.716
  845    H    HIS1212           HN       HIS1212 -23.462  -5.707  -4.474
  846    HA   HIS1212           HA       HIS1212 -22.847  -8.466  -5.243
  847   1HB   HIS1212           HB2      HIS1212 -20.986  -6.204  -4.477
  848   2HB   HIS1212           HB1      HIS1212 -20.486  -7.802  -5.023
  849    HD1  HIS1212           HD1      HIS1212 -20.750  -8.333  -7.543
  850    HD2  HIS1212           HD2      HIS1212 -21.850  -4.469  -6.486
  851    HE1  HIS1212           HE1      HIS1212 -20.946  -7.074  -9.711
  852    HE2  HIS1212           HE2      HIS1212 -21.533  -4.718  -9.042
  853    H    THR1213           HN       THR1213 -20.987  -6.801  -2.816
  854    HA   THR1213           HA       THR1213 -22.243  -8.330  -0.668
  855    HB   THR1213           HB       THR1213 -20.229  -9.307   0.126
  856    HG1  THR1213           HG1      THR1213 -19.053  -7.469  -1.605
  857   1HG2  THR1213          3HG2      THR1213 -20.423  -9.645  -2.867
  858   2HG2  THR1213          2HG2      THR1213 -19.504 -10.706  -1.799
  859   3HG2  THR1213          1HG2      THR1213 -21.257 -10.596  -1.638
  860    H    LEU1214           HN       LEU1214 -22.116  -7.389   1.324
  861    HA   LEU1214           HA       LEU1214 -21.511  -4.618   1.451
  862   1HB   LEU1214           HB2      LEU1214 -22.030  -6.594   3.673
  863   2HB   LEU1214           HB1      LEU1214 -22.029  -4.849   3.846
  864    HG   LEU1214           HG       LEU1214 -23.914  -6.285   1.992
  865   1HD1  LEU1214          3HD1      LEU1214 -24.210  -7.098   4.300
  866   2HD1  LEU1214          2HD1      LEU1214 -24.447  -5.433   4.832
  867   3HD1  LEU1214          1HD1      LEU1214 -25.594  -6.175   3.714
  868   1HD2  LEU1214          2HD2      LEU1214 -23.469  -3.858   1.658
  869   2HD2  LEU1214          1HD2      LEU1214 -25.149  -4.239   2.041
  870   3HD2  LEU1214          3HD2      LEU1214 -24.089  -3.572   3.283
  871    H    ARG1215           HN       ARG1215 -20.028  -7.461   2.968
  872    HA   ARG1215           HA       ARG1215 -17.725  -5.850   3.757
  873   1HB   ARG1215           HB2      ARG1215 -18.779  -7.441   5.365
  874   2HB   ARG1215           HB1      ARG1215 -18.276  -8.766   4.326
  875   1HG   ARG1215           HG2      ARG1215 -15.931  -8.108   4.653
  876   2HG   ARG1215           HG1      ARG1215 -16.464  -6.821   5.739
  877   1HD   ARG1215           HD2      ARG1215 -16.919  -9.776   6.139
  878   2HD   ARG1215           HD1      ARG1215 -15.721  -8.793   6.981
  879    HE   ARG1215           HE       ARG1215 -18.246  -7.645   7.365
  880   1HH1  ARG1215          1HH1      ARG1215 -16.461 -10.504   8.247
  881   2HH1  ARG1215          2HH1      ARG1215 -17.311 -10.730   9.740
  882   1HH2  ARG1215          1HH2      ARG1215 -19.370  -7.936   9.328
  883   2HH2  ARG1215          2HH2      ARG1215 -18.964  -9.270  10.353
  884    H    THR1216           HN       THR1216 -16.232  -5.563   2.252
  885    HA   THR1216           HA       THR1216 -15.519  -7.832   0.514
  886    HB   THR1216           HB       THR1216 -16.388  -5.868  -0.706
  887    HG1  THR1216           HG1      THR1216 -14.422  -7.278  -1.362
  888   1HG2  THR1216          2HG2      THR1216 -15.659  -4.111   0.822
  889   2HG2  THR1216          1HG2      THR1216 -13.975  -4.452   0.424
  890   3HG2  THR1216          3HG2      THR1216 -15.061  -3.810  -0.809
  891    H    THR1217           HN       THR1217 -13.110  -6.941  -0.433
  892    HA   THR1217           HA       THR1217 -11.444  -6.686   1.982
  893    HB   THR1217           HB       THR1217 -11.113  -8.616  -0.305
  894    HG1  THR1217           HG1      THR1217 -10.564  -9.582   2.134
  895   1HG2  THR1217          3HG2      THR1217  -8.968  -7.448   0.037
  896   2HG2  THR1217          2HG2      THR1217  -9.020  -7.879   1.746
  897   3HG2  THR1217          1HG2      THR1217  -8.884  -9.142   0.522
  898    H    CYS1218           HN       CYS1218  -9.851  -5.232   1.894
  899    HA   CYS1218           HA       CYS1218  -9.633  -3.451  -0.313
  900   1HB   CYS1218           HB2      CYS1218  -8.008  -3.821   2.203
  901   2HB   CYS1218           HB1      CYS1218  -7.616  -2.597   1.001
  902    H    TRP1219           HN       TRP1219  -8.814  -4.213  -2.200
  903    HA   TRP1219           HA       TRP1219  -6.066  -5.064  -2.222
  904   1HB   TRP1219           HB2      TRP1219  -7.764  -7.097  -1.780
  905   2HB   TRP1219           HB1      TRP1219  -7.822  -7.061  -3.540
  906    HD1  TRP1219           HD1      TRP1219  -5.608  -7.756  -4.858
  907    HE1  TRP1219           HE1      TRP1219  -3.502  -9.039  -4.121
  908    HE3  TRP1219           HE3      TRP1219  -6.188  -7.457   0.214
  909    HZ2  TRP1219           HZ2      TRP1219  -2.254  -9.818  -1.732
  910    HZ3  TRP1219           HZ3      TRP1219  -4.488  -8.500   1.656
  911    HH2  TRP1219           HH2      TRP1219  -2.560  -9.658   0.703
  912    H    ASP1220           HN       ASP1220  -5.127  -4.315  -3.968
  913    HA   ASP1220           HA       ASP1220  -4.760  -3.480  -6.051
  914   1HB   ASP1220           HB2      ASP1220  -5.658  -5.734  -6.704
  915   2HB   ASP1220           HB1      ASP1220  -7.245  -4.992  -6.876
  916    H    GLY1221           HN       GLY1221  -6.671  -2.201  -4.104
  917   1HA   GLY1221           HA1      GLY1221  -7.315   0.065  -5.643
  918   2HA   GLY1221           HA2      GLY1221  -7.896  -0.264  -4.019
  919    H    LYS1222           HN       LYS1222  -9.077  -2.865  -5.130
  920    HA   LYS1222           HA       LYS1222 -11.436  -1.609  -6.371
  921   1HB   LYS1222           HB2      LYS1222 -10.319  -3.080  -7.953
  922   2HB   LYS1222           HB1      LYS1222 -10.372  -4.399  -6.795
  923   1HG   LYS1222           HG2      LYS1222 -12.082  -4.642  -8.511
  924   2HG   LYS1222           HG1      LYS1222 -12.795  -4.436  -6.910
  925   1HD   LYS1222           HD2      LYS1222 -14.026  -3.108  -8.501
  926   2HD   LYS1222           HD1      LYS1222 -13.138  -2.036  -7.416
  927   1HE   LYS1222           HE2      LYS1222 -12.981  -1.269  -9.724
  928   2HE   LYS1222           HE1      LYS1222 -11.401  -1.751  -9.107
  929   1HZ   LYS1222           HZ1      LYS1222 -13.151  -3.403 -10.847
  930   2HZ   LYS1222           HZ3      LYS1222 -11.765  -2.572 -11.348
  931   3HZ   LYS1222           HZ2      LYS1222 -11.632  -3.861 -10.260
  932    H    LEU1223           HN       LEU1223 -13.401  -2.078  -5.600
  933    HA   LEU1223           HA       LEU1223 -13.739  -4.120  -3.548
  934   1HB   LEU1223           HB2      LEU1223 -14.638  -1.290  -3.043
  935   2HB   LEU1223           HB1      LEU1223 -14.691  -2.644  -1.934
  936    HG   LEU1223           HG       LEU1223 -12.102  -1.503  -2.952
  937   1HD1  LEU1223          1HD1      LEU1223 -13.400   0.248  -1.818
  938   2HD1  LEU1223          3HD1      LEU1223 -13.554  -0.802  -0.408
  939   3HD1  LEU1223          2HD1      LEU1223 -11.964  -0.223  -0.905
  940   1HD2  LEU1223          2HD2      LEU1223 -12.009  -3.758  -2.026
  941   2HD2  LEU1223          1HD2      LEU1223 -11.188  -2.601  -0.978
  942   3HD2  LEU1223          3HD2      LEU1223 -12.796  -3.188  -0.554
  943    H    GLU1224           HN       GLU1224 -15.830  -4.877  -3.366
  944    HA   GLU1224           HA       GLU1224 -17.614  -4.128  -5.543
  945   1HB   GLU1224           HB2      GLU1224 -17.788  -6.385  -3.535
  946   2HB   GLU1224           HB1      GLU1224 -18.896  -6.139  -4.878
  947   1HG   GLU1224           HG2      GLU1224 -17.056  -6.447  -6.454
  948   2HG   GLU1224           HG1      GLU1224 -15.946  -6.694  -5.107
  949    H    TYR1225           HN       TYR1225 -18.156  -2.031  -4.587
  950    HA   TYR1225           HA       TYR1225 -19.449  -1.826  -2.084
  951   1HB   TYR1225           HB2      TYR1225 -20.422   0.341  -3.282
  952   2HB   TYR1225           HB1      TYR1225 -18.755   0.253  -2.722
  953    HD1  TYR1225           HD1      TYR1225 -20.814  -0.406  -5.762
  954    HD2  TYR1225           HD2      TYR1225 -17.061   0.792  -4.174
  955    HE1  TYR1225           HE1      TYR1225 -20.025   0.123  -8.036
  956    HE2  TYR1225           HE2      TYR1225 -16.258   1.330  -6.429
  957    HH   TYR1225           HH       TYR1225 -16.760   0.707  -8.759
  958    HA   PRO1226           HA       PRO1226 -23.324  -3.734  -3.229
  959   1HB   PRO1226           HB2      PRO1226 -24.628  -3.098  -0.912
  960   2HB   PRO1226           HB1      PRO1226 -23.500  -4.451  -1.057
  961   1HG   PRO1226           HG2      PRO1226 -23.019  -1.688   0.008
  962   2HG   PRO1226           HG1      PRO1226 -22.506  -3.249   0.679
  963   1HD   PRO1226           HD2      PRO1226 -20.818  -1.698  -0.708
  964   2HD   PRO1226           HD1      PRO1226 -20.770  -3.469  -0.845
  965    H    THR1227           HN       THR1227 -25.680  -2.582  -1.997
  966    HA   THR1227           HA       THR1227 -25.862   0.151  -2.924
  967    HB   THR1227           HB       THR1227 -27.600  -1.956  -4.219
  968    HG1  THR1227           HG1      THR1227 -25.670  -0.358  -5.544
  969   1HG2  THR1227          1HG2      THR1227 -28.705   0.209  -3.934
  970   2HG2  THR1227          3HG2      THR1227 -27.346   1.012  -4.721
  971   3HG2  THR1227          2HG2      THR1227 -28.360  -0.104  -5.635
  972    H    CYS1228           HN       CYS1228 -27.994  -2.599  -2.296
  973    HA   CYS1228           HA       CYS1228 -29.666  -2.944  -0.798
  974   1HB   CYS1228           HB2      CYS1228 -28.359  -0.721   0.776
  975   2HB   CYS1228           HB1      CYS1228 -29.467  -1.936   1.406
  976    H    ALA1229           HN       ALA1229 -31.474  -1.725   0.457
  977    HA   ALA1229           HA       ALA1229 -32.303   0.841  -0.199
  978   1HB   ALA1229           HB2      ALA1229 -33.389  -1.271  -2.043
  979   2HB   ALA1229           HB1      ALA1229 -33.992   0.382  -1.919
  980   3HB   ALA1229           HB3      ALA1229 -32.352   0.082  -2.500
  981    H    LYS1230           HN       LYS1230 -33.630   1.202   1.476
  982    HA   LYS1230           HA       LYS1230 -36.034  -0.122   1.846
  983   1HB   LYS1230           HB2      LYS1230 -34.210  -1.827   2.660
  984   2HB   LYS1230           HB1      LYS1230 -34.258  -0.836   4.112
  985   1HG   LYS1230           HG2      LYS1230 -36.724  -1.208   4.185
  986   2HG   LYS1230           HG1      LYS1230 -36.523  -2.343   2.849
  987   1HD   LYS1230           HD2      LYS1230 -34.974  -3.665   4.248
  988   2HD   LYS1230           HD1      LYS1230 -35.264  -2.550   5.585
  989   1HE   LYS1230           HE2      LYS1230 -37.347  -4.253   4.222
  990   2HE   LYS1230           HE1      LYS1230 -36.615  -4.579   5.793
  991   1HZ   LYS1230           HZ3      LYS1230 -38.260  -2.200   5.114
  992   2HZ   LYS1230           HZ2      LYS1230 -38.775  -3.529   6.026
  993   3HZ   LYS1230           HZ1      LYS1230 -37.559  -2.516   6.622
  994    H    ARG1231           HN       ARG1231 -33.504   1.741   3.203
  995    HA   ARG1231           HA       ARG1231 -34.674   2.787   5.463
  996   1HB   ARG1231           HB2      ARG1231 -32.299   3.167   4.561
  997   2HB   ARG1231           HB1      ARG1231 -32.998   4.478   3.623
  998   1HG   ARG1231           HG2      ARG1231 -33.322   4.322   6.600
  999   2HG   ARG1231           HG1      ARG1231 -31.908   5.061   5.847
 1000   1HD   ARG1231           HD2      ARG1231 -34.778   5.879   5.407
 1001   2HD   ARG1231           HD1      ARG1231 -33.599   6.733   6.403
 1002    HE   ARG1231           HE       ARG1231 -32.562   6.464   3.813
 1003   1HH1  ARG1231          1HH1      ARG1231 -35.105   8.137   5.509
 1004   2HH1  ARG1231          2HH1      ARG1231 -35.129   9.479   4.414
 1005   1HH2  ARG1231          1HH2      ARG1231 -32.585   8.227   2.367
 1006   2HH2  ARG1231          2HH2      ARG1231 -33.696   9.530   2.628

  No H/Q in entry =        1006
  Start of MODEL    6
    1    H1   GLU1103           HT3      GLU1103  33.289  -9.516   5.903
    2    H2   GLU1103           HT2      GLU1103  32.237 -10.776   6.312
    3    H3   GLU1103           HT1      GLU1103  33.842 -11.115   5.899
    4    HA   GLU1103           HA       GLU1103  32.384 -11.668   4.082
    5   1HB   GLU1103           HB2      GLU1103  31.143  -9.871   2.936
    6   2HB   GLU1103           HB1      GLU1103  30.584 -10.109   4.586
    7   1HG   GLU1103           HG2      GLU1103  31.881  -8.170   5.308
    8   2HG   GLU1103           HG1      GLU1103  32.442  -7.932   3.652
    9    H    ALA1104           HN       ALA1104  33.179 -11.558   1.975
   10    HA   ALA1104           HA       ALA1104  35.721 -10.125   1.739
   11   1HB   ALA1104           HB3      ALA1104  35.753 -12.543   1.359
   12   2HB   ALA1104           HB2      ALA1104  34.598 -12.350   0.040
   13   3HB   ALA1104           HB1      ALA1104  36.214 -11.654  -0.093
   14    H    GLU1105           HN       GLU1105  36.274  -9.038  -0.238
   15    HA   GLU1105           HA       GLU1105  35.921  -7.510  -1.882
   16   1HB   GLU1105           HB2      GLU1105  35.011  -9.445  -3.088
   17   2HB   GLU1105           HB1      GLU1105  33.428  -9.145  -2.385
   18   1HG   GLU1105           HG2      GLU1105  33.323  -6.993  -3.534
   19   2HG   GLU1105           HG1      GLU1105  34.910  -7.295  -4.241
   20    H    PHE1106           HN       PHE1106  35.622  -5.597  -0.889
   21    HA   PHE1106           HA       PHE1106  33.291  -4.918   0.588
   22   1HB   PHE1106           HB2      PHE1106  35.449  -3.131  -0.556
   23   2HB   PHE1106           HB1      PHE1106  34.246  -2.642   0.632
   24    HD1  PHE1106           HD1      PHE1106  34.382  -3.398   2.928
   25    HD2  PHE1106           HD2      PHE1106  37.308  -4.539   0.057
   26    HE1  PHE1106           HE1      PHE1106  35.871  -4.131   4.744
   27    HE2  PHE1106           HE2      PHE1106  38.803  -5.275   1.867
   28    HZ   PHE1106           HZ       PHE1106  38.085  -5.073   4.214
   29    H    GLY1107           HN       GLY1107  32.010  -2.886   0.032
   30   1HA   GLY1107           HA1      GLY1107  30.565  -3.324  -2.326
   31   2HA   GLY1107           HA2      GLY1107  31.689  -2.006  -2.603
   32    H    LYS1108           HN       LYS1108  31.661  -0.389  -0.604
   33    HA   LYS1108           HA       LYS1108  29.385   0.014   0.913
   34   1HB   LYS1108           HB2      LYS1108  31.226   2.076  -0.313
   35   2HB   LYS1108           HB1      LYS1108  30.025   2.431   0.922
   36   1HG   LYS1108           HG2      LYS1108  31.181   0.804   2.413
   37   2HG   LYS1108           HG1      LYS1108  32.447   0.667   1.190
   38   1HD   LYS1108           HD2      LYS1108  32.890   3.061   1.370
   39   2HD   LYS1108           HD1      LYS1108  31.613   3.211   2.579
   40   1HE   LYS1108           HE2      LYS1108  32.837   1.708   4.066
   41   2HE   LYS1108           HE1      LYS1108  34.110   1.543   2.857
   42   1HZ   LYS1108           HZ2      LYS1108  33.334   4.069   4.213
   43   2HZ   LYS1108           HZ1      LYS1108  34.708   3.147   4.558
   44   3HZ   LYS1108           HZ3      LYS1108  34.556   3.909   3.054
   45    H    CYS1109           HN       CYS1109  27.380   0.590   0.508
   46    HA   CYS1109           HA       CYS1109  26.613   1.085  -2.244
   47   1HB   CYS1109           HB2      CYS1109  24.634   1.014  -0.012
   48   2HB   CYS1109           HB1      CYS1109  24.499   0.390  -1.655
   49    H    GLY1110           HN       GLY1110  24.657   2.646  -2.441
   50   1HA   GLY1110           HA1      GLY1110  24.950   5.093  -2.784
   51   2HA   GLY1110           HA2      GLY1110  25.373   5.169  -1.079
   52    HA   PRO1111           HA       PRO1111  21.169   6.402  -0.348
   53   1HB   PRO1111           HB2      PRO1111  20.697   7.602  -3.031
   54   2HB   PRO1111           HB1      PRO1111  20.434   8.288  -1.424
   55   1HG   PRO1111           HG2      PRO1111  22.517   9.045  -2.914
   56   2HG   PRO1111           HG1      PRO1111  22.665   8.858  -1.158
   57   1HD   PRO1111           HD2      PRO1111  23.630   7.073  -3.345
   58   2HD   PRO1111           HD1      PRO1111  24.365   7.427  -1.767
   59    HA   PRO1112           HA       PRO1112  19.285   2.774  -2.228
   60   1HB   PRO1112           HB2      PRO1112  17.216   2.626  -0.463
   61   2HB   PRO1112           HB1      PRO1112  18.838   2.021  -0.119
   62   1HG   PRO1112           HG2      PRO1112  17.568   4.613   0.678
   63   2HG   PRO1112           HG1      PRO1112  18.557   3.505   1.652
   64   1HD   PRO1112           HD2      PRO1112  19.579   5.750   0.567
   65   2HD   PRO1112           HD1      PRO1112  20.537   4.262   0.717
   66    HA   PRO1113           HA       PRO1113  16.110   5.162  -4.429
   67   1HB   PRO1113           HB2      PRO1113  16.404   3.987  -6.806
   68   2HB   PRO1113           HB1      PRO1113  17.609   5.132  -6.203
   69   1HG   PRO1113           HG2      PRO1113  17.701   2.151  -6.304
   70   2HG   PRO1113           HG1      PRO1113  19.003   3.324  -6.564
   71   1HD   PRO1113           HD2      PRO1113  18.517   1.912  -4.199
   72   2HD   PRO1113           HD1      PRO1113  19.537   3.355  -4.356
   73    HA   PRO1114           HA       PRO1114  13.296   1.633  -3.702
   74   1HB   PRO1114           HB2      PRO1114  11.383   3.515  -2.680
   75   2HB   PRO1114           HB1      PRO1114  12.334   2.332  -1.783
   76   1HG   PRO1114           HG2      PRO1114  12.655   5.047  -1.558
   77   2HG   PRO1114           HG1      PRO1114  13.927   3.862  -1.213
   78   1HD   PRO1114           HD2      PRO1114  13.485   5.493  -3.692
   79   2HD   PRO1114           HD1      PRO1114  15.001   5.142  -2.830
   80    H    ILE1115           HN       ILE1115  10.661   1.891  -3.813
   81    HA   ILE1115           HA       ILE1115  10.095   2.095  -6.611
   82    HB   ILE1115           HB       ILE1115   7.693   1.675  -5.737
   83   1HG1  ILE1115          2HG1      ILE1115   9.331   1.253  -3.227
   84   2HG1  ILE1115          1HG1      ILE1115   8.016   2.401  -3.450
   85   1HG2  ILE1115          1HG2      ILE1115   9.894  -0.329  -5.265
   86   2HG2  ILE1115          3HG2      ILE1115   8.178  -0.714  -5.389
   87   3HG2  ILE1115          2HG2      ILE1115   9.035  -0.046  -6.779
   88   1HD1  ILE1115          3HD1      ILE1115   7.728  -0.592  -3.483
   89   2HD1  ILE1115          2HD1      ILE1115   7.350   0.466  -2.121
   90   3HD1  ILE1115          1HD1      ILE1115   6.425   0.588  -3.619
   91    H    ASP1116           HN       ASP1116   7.785   3.157  -7.073
   92    HA   ASP1116           HA       ASP1116   8.157   5.966  -6.811
   93   1HB   ASP1116           HB2      ASP1116   7.053   4.960  -8.774
   94   2HB   ASP1116           HB1      ASP1116   5.726   4.419  -7.750
   95    H    ASN1117           HN       ASN1117   7.520   7.271  -5.214
   96    HA   ASN1117           HA       ASN1117   6.469   8.076  -3.362
   97   1HB   ASN1117           HB2      ASN1117   4.383   5.973  -4.002
   98   2HB   ASN1117           HB1      ASN1117   4.188   7.279  -2.834
   99   1HD2  ASN1117          1HD2      ASN1117   2.643   6.675  -5.222
  100   2HD2  ASN1117          2HD2      ASN1117   2.719   8.086  -6.215
  101    H    GLY1118           HN       GLY1118   8.040   5.334  -3.567
  102   1HA   GLY1118           HA1      GLY1118   8.367   3.485  -2.109
  103   2HA   GLY1118           HA2      GLY1118   7.360   4.287  -0.912
  104    H    ASP1119           HN       ASP1119   9.539   3.298   0.115
  105    HA   ASP1119           HA       ASP1119  11.944   4.677  -0.019
  106   1HB   ASP1119           HB2      ASP1119  10.520   6.637   0.654
  107   2HB   ASP1119           HB1      ASP1119  10.178   5.801   2.166
  108    H    ILE1120           HN       ILE1120  13.206   4.486   2.134
  109    HA   ILE1120           HA       ILE1120  13.178   1.794   2.913
  110    HB   ILE1120           HB       ILE1120  14.396   3.675   4.810
  111   1HG1  ILE1120          2HG1      ILE1120  15.407   3.511   1.963
  112   2HG1  ILE1120          1HG1      ILE1120  14.607   4.916   2.659
  113   1HG2  ILE1120          3HG2      ILE1120  15.369   1.339   3.189
  114   2HG2  ILE1120          2HG2      ILE1120  16.312   2.166   4.430
  115   3HG2  ILE1120          1HG2      ILE1120  14.836   1.304   4.867
  116   1HD1  ILE1120          2HD1      ILE1120  16.414   5.142   4.280
  117   2HD1  ILE1120          1HD1      ILE1120  17.217   3.738   3.577
  118   3HD1  ILE1120          3HD1      ILE1120  17.012   5.206   2.622
  119    H    THR1121           HN       THR1121  11.109   4.218   3.763
  120    HA   THR1121           HA       THR1121   9.385   4.351   5.235
  121    HB   THR1121           HB       THR1121   8.532   2.469   6.292
  122    HG1  THR1121           HG1      THR1121  10.501   0.688   6.400
  123   1HG2  THR1121          1HG2      THR1121  10.290   1.341   4.105
  124   2HG2  THR1121          3HG2      THR1121   8.869   0.553   4.791
  125   3HG2  THR1121          2HG2      THR1121   8.693   2.055   3.884
  126    H    SER1122           HN       SER1122  12.411   4.792   5.875
  127    HA   SER1122           HA       SER1122  11.920   5.467   8.693
  128   1HB   SER1122           HB2      SER1122  14.468   4.240   7.608
  129   2HB   SER1122           HB1      SER1122  14.241   4.831   9.254
  130    HG   SER1122           HG       SER1122  12.672   2.793   8.059
  131    H    PHE1123           HN       PHE1123  14.899   5.843   6.849
  132    HA   PHE1123           HA       PHE1123  14.418   8.581   6.161
  133   1HB   PHE1123           HB2      PHE1123  14.894   8.726   8.605
  134   2HB   PHE1123           HB1      PHE1123  16.472   8.008   8.304
  135    HD1  PHE1123           HD1      PHE1123  18.271   9.289   7.440
  136    HD2  PHE1123           HD2      PHE1123  14.376  10.979   7.733
  137    HE1  PHE1123           HE1      PHE1123  19.211  11.521   7.004
  138    HE2  PHE1123           HE2      PHE1123  15.308  13.214   7.296
  139    HZ   PHE1123           HZ       PHE1123  17.728  13.487   6.931
  140    HA   PRO1124           HA       PRO1124  17.109   6.891   2.964
  141   1HB   PRO1124           HB2      PRO1124  17.292   9.830   2.452
  142   2HB   PRO1124           HB1      PRO1124  17.044   8.505   1.311
  143   1HG   PRO1124           HG2      PRO1124  15.001  10.028   2.078
  144   2HG   PRO1124           HG1      PRO1124  14.798   8.280   1.858
  145   1HD   PRO1124           HD2      PRO1124  14.965   9.868   4.369
  146   2HD   PRO1124           HD1      PRO1124  14.077   8.367   4.036
  147    H    LEU1125           HN       LEU1125  19.246   6.497   2.957
  148    HA   LEU1125           HA       LEU1125  20.977   8.287   4.527
  149   1HB   LEU1125           HB2      LEU1125  21.409   5.330   4.046
  150   2HB   LEU1125           HB1      LEU1125  22.369   6.388   5.065
  151    HG   LEU1125           HG       LEU1125  20.178   6.737   6.404
  152   1HD1  LEU1125          1HD1      LEU1125  19.541   4.165   4.966
  153   2HD1  LEU1125          3HD1      LEU1125  18.658   4.818   6.343
  154   3HD1  LEU1125          2HD1      LEU1125  18.660   5.685   4.806
  155   1HD2  LEU1125          1HD2      LEU1125  22.142   5.574   7.254
  156   2HD2  LEU1125          3HD2      LEU1125  20.660   4.762   7.760
  157   3HD2  LEU1125          2HD2      LEU1125  21.628   4.094   6.445
  158    H    SER1126           HN       SER1126  23.023   8.779   3.726
  159    HA   SER1126           HA       SER1126  23.209   8.713   0.842
  160   1HB   SER1126           HB2      SER1126  25.191  10.152   1.165
  161   2HB   SER1126           HB1      SER1126  23.786  10.772   2.030
  162    HG   SER1126           HG       SER1126  25.851  10.694   3.215
  163    H    VAL1127           HN       VAL1127  25.178   7.588   3.575
  164    HA   VAL1127           HA       VAL1127  26.623   5.819   1.718
  165    HB   VAL1127           HB       VAL1127  27.441   6.654   4.508
  166   1HG1  VAL1127          1HG1      VAL1127  28.289   4.458   3.883
  167   2HG1  VAL1127          3HG1      VAL1127  28.928   5.116   2.377
  168   3HG1  VAL1127          2HG1      VAL1127  29.598   5.639   3.924
  169   1HG2  VAL1127          1HG2      VAL1127  27.520   8.537   2.963
  170   2HG2  VAL1127          3HG2      VAL1127  29.148   8.015   3.397
  171   3HG2  VAL1127          2HG2      VAL1127  28.472   7.580   1.828
  172    H    TYR1128           HN       TYR1128  26.135   3.735   1.772
  173    HA   TYR1128           HA       TYR1128  24.817   2.676   4.183
  174   1HB   TYR1128           HB2      TYR1128  24.096   2.553   1.396
  175   2HB   TYR1128           HB1      TYR1128  24.317   0.929   2.041
  176    HD1  TYR1128           HD1      TYR1128  22.127   3.726   1.801
  177    HD2  TYR1128           HD2      TYR1128  23.050   0.329   4.190
  178    HE1  TYR1128           HE1      TYR1128  19.887   3.834   2.802
  179    HE2  TYR1128           HE2      TYR1128  20.811   0.425   5.202
  180    HH   TYR1128           HH       TYR1128  19.029   2.074   5.578
  181    H    ALA1129           HN       ALA1129  25.002   0.234   4.307
  182    HA   ALA1129           HA       ALA1129  27.837  -0.444   4.160
  183   1HB   ALA1129           HB3      ALA1129  26.682  -0.749   6.297
  184   2HB   ALA1129           HB1      ALA1129  27.280  -2.282   5.665
  185   3HB   ALA1129           HB2      ALA1129  25.567  -1.882   5.535
  186    HA   PRO1130           HA       PRO1130  27.488  -2.905   0.500
  187   1HB   PRO1130           HB2      PRO1130  29.368  -4.721   1.920
  188   2HB   PRO1130           HB1      PRO1130  29.497  -3.997   0.314
  189   1HG   PRO1130           HG2      PRO1130  30.935  -3.078   2.379
  190   2HG   PRO1130           HG1      PRO1130  30.288  -1.988   1.140
  191   1HD   PRO1130           HD2      PRO1130  29.366  -2.439   3.934
  192   2HD   PRO1130           HD1      PRO1130  29.318  -0.964   2.949
  193    H    ALA1131           HN       ALA1131  25.927  -4.286  -0.007
  194    HA   ALA1131           HA       ALA1131  24.432  -5.992   0.057
  195   1HB   ALA1131           HB3      ALA1131  26.453  -7.369   0.163
  196   2HB   ALA1131           HB1      ALA1131  25.121  -8.093   1.063
  197   3HB   ALA1131           HB2      ALA1131  26.423  -7.272   1.923
  198    H    SER1132           HN       SER1132  24.326  -3.801   2.106
  199    HA   SER1132           HA       SER1132  23.256  -5.045   4.474
  200   1HB   SER1132           HB2      SER1132  22.663  -2.757   5.165
  201   2HB   SER1132           HB1      SER1132  24.348  -2.863   4.650
  202    HG   SER1132           HG       SER1132  23.659  -1.143   3.559
  203    H    SER1133           HN       SER1133  21.184  -5.442   4.993
  204    HA   SER1133           HA       SER1133  19.195  -5.065   2.878
  205   1HB   SER1133           HB2      SER1133  17.888  -6.626   4.591
  206   2HB   SER1133           HB1      SER1133  19.039  -7.290   3.435
  207    HG   SER1133           HG       SER1133  19.969  -6.444   5.939
  208    H    VAL1134           HN       VAL1134  16.942  -4.583   3.587
  209    HA   VAL1134           HA       VAL1134  16.498  -3.294   6.088
  210    HB   VAL1134           HB       VAL1134  17.849  -1.603   4.721
  211   1HG1  VAL1134          1HG1      VAL1134  15.204  -1.370   3.316
  212   2HG1  VAL1134          3HG1      VAL1134  16.516  -0.198   3.194
  213   3HG1  VAL1134          2HG1      VAL1134  16.743  -1.843   2.598
  214   1HG2  VAL1134          3HG2      VAL1134  16.682  -1.024   6.767
  215   2HG2  VAL1134          2HG2      VAL1134  16.585   0.283   5.585
  216   3HG2  VAL1134          1HG2      VAL1134  15.196  -0.771   5.850
  217    H    GLU1135           HN       GLU1135  14.402  -1.877   5.840
  218    HA   GLU1135           HA       GLU1135  12.447  -3.590   4.462
  219   1HB   GLU1135           HB2      GLU1135  12.187  -3.481   6.891
  220   2HB   GLU1135           HB1      GLU1135  12.084  -1.728   6.816
  221   1HG   GLU1135           HG2      GLU1135  10.019  -1.906   5.521
  222   2HG   GLU1135           HG1      GLU1135  10.121  -3.664   5.607
  223    H    TYR1136           HN       TYR1136  10.942  -2.767   3.099
  224    HA   TYR1136           HA       TYR1136  11.105   0.116   2.519
  225   1HB   TYR1136           HB2      TYR1136  11.272  -2.234   0.708
  226   2HB   TYR1136           HB1      TYR1136  10.388  -0.829   0.124
  227    HD1  TYR1136           HD1      TYR1136  13.377  -0.730   2.319
  228    HD2  TYR1136           HD2      TYR1136  11.833  -0.149  -1.598
  229    HE1  TYR1136           HE1      TYR1136  15.492   0.325   1.643
  230    HE2  TYR1136           HE2      TYR1136  13.940   0.903  -2.281
  231    HH   TYR1136           HH       TYR1136  16.757   0.739  -0.418
  232    H    GLN1137           HN       GLN1137   9.220   1.058   1.572
  233    HA   GLN1137           HA       GLN1137   6.762  -0.199   1.189
  234   1HB   GLN1137           HB2      GLN1137   6.942  -0.626   3.646
  235   2HB   GLN1137           HB1      GLN1137   6.949   1.112   3.908
  236   1HG   GLN1137           HG2      GLN1137   4.724   1.275   2.920
  237   2HG   GLN1137           HG1      GLN1137   4.716  -0.468   2.653
  238   1HE2  GLN1137          1HE2      GLN1137   4.514   2.076   5.006
  239   2HE2  GLN1137          2HE2      GLN1137   3.947   1.101   6.314
  240    H    CYS1138           HN       CYS1138   4.969   1.355   0.963
  241    HA   CYS1138           HA       CYS1138   6.012   3.954   0.119
  242   1HB   CYS1138           HB2      CYS1138   3.463   2.472  -0.527
  243   2HB   CYS1138           HB1      CYS1138   3.738   4.145  -1.002
  244    H    GLN1139           HN       GLN1139   5.205   5.881   0.838
  245    HA   GLN1139           HA       GLN1139   3.937   5.840   3.437
  246   1HB   GLN1139           HB2      GLN1139   4.794   8.201   1.760
  247   2HB   GLN1139           HB1      GLN1139   4.385   8.227   3.471
  248   1HG   GLN1139           HG2      GLN1139   6.313   6.922   4.017
  249   2HG   GLN1139           HG1      GLN1139   6.676   6.663   2.311
  250   1HE2  GLN1139          1HE2      GLN1139   5.997   9.404   1.585
  251   2HE2  GLN1139          2HE2      GLN1139   7.309  10.384   2.133
  252    H    ASN1140           HN       ASN1140   2.574   8.270   3.343
  253    HA   ASN1140           HA       ASN1140   0.441   9.014   3.125
  254   1HB   ASN1140           HB2      ASN1140   1.631   9.553   0.926
  255   2HB   ASN1140           HB1      ASN1140   0.686   8.238   0.237
  256   1HD2  ASN1140          1HD2      ASN1140  -0.568  10.216   2.776
  257   2HD2  ASN1140          2HD2      ASN1140  -1.737  11.060   1.825
  258    H    LEU1141           HN       LEU1141   0.254   6.579   4.189
  259    HA   LEU1141           HA       LEU1141  -1.303   4.984   4.646
  260   1HB   LEU1141           HB2      LEU1141  -2.861   6.088   2.314
  261   2HB   LEU1141           HB1      LEU1141  -3.474   5.047   3.584
  262    HG   LEU1141           HG       LEU1141  -2.406   7.824   4.088
  263   1HD1  LEU1141          3HD1      LEU1141  -5.256   6.925   3.695
  264   2HD1  LEU1141          2HD1      LEU1141  -4.747   8.526   4.233
  265   3HD1  LEU1141          1HD1      LEU1141  -4.330   7.966   2.613
  266   1HD2  LEU1141          1HD2      LEU1141  -4.080   5.958   5.764
  267   2HD2  LEU1141          3HD2      LEU1141  -2.379   6.343   6.021
  268   3HD2  LEU1141          2HD2      LEU1141  -3.605   7.597   6.206
  269    H    TYR1142           HN       TYR1142  -0.120   5.309   1.380
  270    HA   TYR1142           HA       TYR1142  -1.005   2.977   0.199
  271   1HB   TYR1142           HB2      TYR1142   1.706   4.300  -0.039
  272   2HB   TYR1142           HB1      TYR1142   1.131   3.026  -1.108
  273    HD1  TYR1142           HD1      TYR1142   1.343   6.516  -0.624
  274    HD2  TYR1142           HD2      TYR1142  -1.140   3.505  -2.315
  275    HE1  TYR1142           HE1      TYR1142   0.283   8.205  -2.064
  276    HE2  TYR1142           HE2      TYR1142  -2.206   5.185  -3.759
  277    HH   TYR1142           HH       TYR1142  -0.945   8.302  -4.194
  278    H    GLN1143           HN       GLN1143  -0.609   0.840   0.443
  279    HA   GLN1143           HA       GLN1143   1.395   0.099   2.472
  280   1HB   GLN1143           HB2      GLN1143  -0.839  -0.512   3.167
  281   2HB   GLN1143           HB1      GLN1143  -1.138  -1.328   1.639
  282   1HG   GLN1143           HG2      GLN1143  -0.712  -3.001   3.245
  283   2HG   GLN1143           HG1      GLN1143   0.718  -2.903   2.221
  284   1HE2  GLN1143          1HE2      GLN1143   0.459  -3.949   4.908
  285   2HE2  GLN1143          2HE2      GLN1143   1.552  -3.046   5.893
  286    H    LEU1144           HN       LEU1144   3.173  -0.775   1.711
  287    HA   LEU1144           HA       LEU1144   3.637  -1.456  -0.935
  288   1HB   LEU1144           HB2      LEU1144   5.425  -0.973   0.649
  289   2HB   LEU1144           HB1      LEU1144   5.062  -2.440   1.535
  290    HG   LEU1144           HG       LEU1144   5.779  -2.697  -1.346
  291   1HD1  LEU1144          1HD1      LEU1144   7.442  -1.126  -0.509
  292   2HD1  LEU1144          3HD1      LEU1144   7.792  -2.204   0.841
  293   3HD1  LEU1144          2HD1      LEU1144   8.159  -2.709  -0.809
  294   1HD2  LEU1144          3HD2      LEU1144   5.121  -4.655  -0.038
  295   2HD2  LEU1144          2HD2      LEU1144   6.806  -4.761  -0.548
  296   3HD2  LEU1144          1HD2      LEU1144   6.413  -4.322   1.114
  297    H    GLU1145           HN       GLU1145   4.106  -3.478  -1.905
  298    HA   GLU1145           HA       GLU1145   2.785  -5.820  -0.746
  299   1HB   GLU1145           HB2      GLU1145   1.143  -4.822  -2.245
  300   2HB   GLU1145           HB1      GLU1145   2.330  -4.750  -3.539
  301   1HG   GLU1145           HG2      GLU1145   0.794  -6.587  -3.879
  302   2HG   GLU1145           HG1      GLU1145   2.428  -7.184  -3.595
  303    H    GLY1146           HN       GLY1146   3.985  -7.612  -0.942
  304   1HA   GLY1146           HA1      GLY1146   6.084  -7.685  -3.011
  305   2HA   GLY1146           HA2      GLY1146   5.377  -9.095  -2.235
  306    H    ASN1147           HN       ASN1147   8.083  -8.966  -2.337
  307    HA   ASN1147           HA       ASN1147   8.764  -8.979   0.439
  308   1HB   ASN1147           HB2      ASN1147  11.006  -9.656  -0.308
  309   2HB   ASN1147           HB1      ASN1147   9.753 -10.615  -1.088
  310   1HD2  ASN1147          1HD2      ASN1147  12.561  -9.882  -1.820
  311   2HD2  ASN1147          2HD2      ASN1147  12.443  -9.261  -3.428
  312    H    LYS1148           HN       LYS1148   8.680  -6.979   1.325
  313    HA   LYS1148           HA       LYS1148   9.843  -4.681   0.070
  314   1HB   LYS1148           HB2      LYS1148   9.388  -3.642   2.361
  315   2HB   LYS1148           HB1      LYS1148   8.006  -4.194   1.421
  316   1HG   LYS1148           HG2      LYS1148   7.610  -4.875   3.640
  317   2HG   LYS1148           HG1      LYS1148   8.103  -6.328   2.770
  318   1HD   LYS1148           HD2      LYS1148  10.369  -6.095   3.657
  319   2HD   LYS1148           HD1      LYS1148   9.886  -4.631   4.517
  320   1HE   LYS1148           HE2      LYS1148   9.911  -6.555   6.012
  321   2HE   LYS1148           HE1      LYS1148   8.275  -5.922   5.820
  322   1HZ   LYS1148           HZ2      LYS1148   9.387  -8.290   4.415
  323   2HZ   LYS1148           HZ1      LYS1148   8.307  -8.332   5.716
  324   3HZ   LYS1148           HZ3      LYS1148   7.818  -7.684   4.232
  325    H    ARG1149           HN       ARG1149  11.142  -7.267   1.735
  326    HA   ARG1149           HA       ARG1149  13.319  -5.785   2.965
  327   1HB   ARG1149           HB2      ARG1149  12.352  -7.834   4.034
  328   2HB   ARG1149           HB1      ARG1149  12.977  -8.777   2.688
  329   1HG   ARG1149           HG2      ARG1149  14.499  -9.021   4.480
  330   2HG   ARG1149           HG1      ARG1149  15.263  -7.973   3.283
  331   1HD   ARG1149           HD2      ARG1149  15.616  -7.129   5.544
  332   2HD   ARG1149           HD1      ARG1149  14.640  -6.012   4.590
  333    HE   ARG1149           HE       ARG1149  12.969  -7.763   6.045
  334   1HH1  ARG1149          1HH1      ARG1149  15.082  -5.025   6.475
  335   2HH1  ARG1149          2HH1      ARG1149  14.246  -4.438   7.873
  336   1HH2  ARG1149          1HH2      ARG1149  11.864  -6.995   7.884
  337   2HH2  ARG1149          2HH2      ARG1149  12.417  -5.557   8.675
  338    H    ILE1150           HN       ILE1150  14.848  -5.021   1.649
  339    HA   ILE1150           HA       ILE1150  15.816  -6.793  -0.502
  340    HB   ILE1150           HB       ILE1150  16.260  -4.867  -1.899
  341   1HG1  ILE1150          2HG1      ILE1150  14.901  -3.178   0.205
  342   2HG1  ILE1150          1HG1      ILE1150  16.651  -3.302   0.045
  343   1HG2  ILE1150          3HG2      ILE1150  14.079  -5.923  -2.099
  344   2HG2  ILE1150          2HG2      ILE1150  13.435  -4.865  -0.844
  345   3HG2  ILE1150          1HG2      ILE1150  13.955  -4.188  -2.387
  346   1HD1  ILE1150          3HD1      ILE1150  16.454  -2.439  -2.258
  347   2HD1  ILE1150          2HD1      ILE1150  14.726  -2.213  -1.987
  348   3HD1  ILE1150          1HD1      ILE1150  15.896  -1.306  -1.028
  349    H    THR1151           HN       THR1151  17.943  -5.275  -1.358
  350    HA   THR1151           HA       THR1151  19.614  -4.411   0.782
  351    HB   THR1151           HB       THR1151  19.628  -6.941   1.060
  352    HG1  THR1151           HG1      THR1151  21.690  -6.796   1.718
  353   1HG2  THR1151          2HG2      THR1151  19.663  -7.507  -1.337
  354   2HG2  THR1151          1HG2      THR1151  21.269  -6.785  -1.470
  355   3HG2  THR1151          3HG2      THR1151  21.027  -8.220  -0.473
  356    H    CYS1152           HN       CYS1152  21.602  -3.567   0.047
  357    HA   CYS1152           HA       CYS1152  21.590  -2.863  -2.760
  358   1HB   CYS1152           HB2      CYS1152  23.516  -1.404  -2.110
  359   2HB   CYS1152           HB1      CYS1152  22.035  -1.080  -1.218
  360    H    ARG1153           HN       ARG1153  22.531  -4.132  -4.190
  361    HA   ARG1153           HA       ARG1153  24.698  -5.897  -3.362
  362   1HB   ARG1153           HB2      ARG1153  24.384  -6.875  -5.669
  363   2HB   ARG1153           HB1      ARG1153  23.009  -7.029  -4.587
  364   1HG   ARG1153           HG2      ARG1153  23.154  -4.742  -6.498
  365   2HG   ARG1153           HG1      ARG1153  22.632  -6.336  -7.048
  366   1HD   ARG1153           HD2      ARG1153  21.386  -4.641  -4.887
  367   2HD   ARG1153           HD1      ARG1153  20.689  -5.065  -6.451
  368    HE   ARG1153           HE       ARG1153  20.859  -6.758  -4.099
  369   1HH1  ARG1153          1HH1      ARG1153  20.194  -6.524  -7.512
  370   2HH1  ARG1153          2HH1      ARG1153  19.266  -7.986  -7.561
  371   1HH2  ARG1153          1HH2      ARG1153  19.641  -8.684  -4.156
  372   2HH2  ARG1153          2HH2      ARG1153  18.952  -9.213  -5.654
  373    H    ASN1154           HN       ASN1154  26.736  -5.384  -3.681
  374    HA   ASN1154           HA       ASN1154  28.570  -4.177  -4.274
  375   1HB   ASN1154           HB2      ASN1154  28.990  -4.123  -6.738
  376   2HB   ASN1154           HB1      ASN1154  28.555  -5.709  -6.119
  377   1HD2  ASN1154          1HD2      ASN1154  26.649  -6.633  -6.720
  378   2HD2  ASN1154          2HD2      ASN1154  25.660  -6.019  -7.995
  379    H    GLY1155           HN       GLY1155  27.187  -2.368  -3.208
  380   1HA   GLY1155           HA1      GLY1155  27.827   0.037  -4.458
  381   2HA   GLY1155           HA2      GLY1155  26.699  -0.133  -3.123
  382    H    GLN1156           HN       GLN1156  24.922  -1.897  -4.701
  383    HA   GLN1156           HA       GLN1156  23.497   0.221  -6.103
  384   1HB   GLN1156           HB2      GLN1156  24.362  -2.358  -7.411
  385   2HB   GLN1156           HB1      GLN1156  23.095  -1.323  -8.057
  386   1HG   GLN1156           HG2      GLN1156  24.699   0.504  -8.282
  387   2HG   GLN1156           HG1      GLN1156  25.968  -0.531  -7.628
  388   1HE2  GLN1156          1HE2      GLN1156  23.478  -1.693  -9.777
  389   2HE2  GLN1156          2HE2      GLN1156  24.506  -1.970 -11.137
  390    H    TRP1157           HN       TRP1157  21.735   0.166  -4.804
  391    HA   TRP1157           HA       TRP1157  20.598  -2.107  -3.630
  392   1HB   TRP1157           HB2      TRP1157  19.476   0.608  -4.280
  393   2HB   TRP1157           HB1      TRP1157  18.528  -0.625  -3.458
  394    HD1  TRP1157           HD1      TRP1157  21.584   1.618  -2.940
  395    HE1  TRP1157           HE1      TRP1157  22.023   1.809  -0.410
  396    HE3  TRP1157           HE3      TRP1157  18.183  -1.806  -1.285
  397    HZ2  TRP1157           HZ2      TRP1157  21.055   0.631   1.975
  398    HZ3  TRP1157           HZ3      TRP1157  18.002  -2.225   1.131
  399    HH2  TRP1157           HH2      TRP1157  19.410  -1.033   2.727
  400    H    SER1158           HN       SER1158  18.047  -2.333  -4.034
  401    HA   SER1158           HA       SER1158  17.481  -2.678  -6.878
  402   1HB   SER1158           HB2      SER1158  17.497  -4.875  -4.820
  403   2HB   SER1158           HB1      SER1158  16.500  -4.972  -6.270
  404    HG   SER1158           HG       SER1158  18.727  -4.348  -7.262
  405    H    GLU1159           HN       GLU1159  15.600  -1.763  -7.263
  406    HA   GLU1159           HA       GLU1159  13.851  -0.751  -5.362
  407   1HB   GLU1159           HB2      GLU1159  13.955  -0.006  -7.713
  408   2HB   GLU1159           HB1      GLU1159  13.235  -1.527  -8.219
  409   1HG   GLU1159           HG2      GLU1159  11.205  -0.984  -6.978
  410   2HG   GLU1159           HG1      GLU1159  11.928   0.542  -6.467
  411    HA   PRO1160           HA       PRO1160  11.614  -4.388  -4.106
  412   1HB   PRO1160           HB2      PRO1160   9.592  -3.220  -2.773
  413   2HB   PRO1160           HB1      PRO1160  11.247  -3.206  -2.149
  414   1HG   PRO1160           HG2      PRO1160   9.765  -1.065  -3.632
  415   2HG   PRO1160           HG1      PRO1160  10.774  -0.922  -2.182
  416   1HD   PRO1160           HD2      PRO1160  11.674  -0.323  -4.674
  417   2HD   PRO1160           HD1      PRO1160  12.733  -0.942  -3.391
  418    HA   PRO1161           HA       PRO1161   8.269  -5.423  -6.797
  419   1HB   PRO1161           HB2      PRO1161   6.408  -5.498  -4.467
  420   2HB   PRO1161           HB1      PRO1161   6.677  -6.703  -5.731
  421   1HG   PRO1161           HG2      PRO1161   7.697  -7.038  -3.293
  422   2HG   PRO1161           HG1      PRO1161   8.616  -7.502  -4.737
  423   1HD   PRO1161           HD2      PRO1161   8.967  -5.153  -2.938
  424   2HD   PRO1161           HD1      PRO1161  10.184  -6.085  -3.832
  425    H    LYS1162           HN       LYS1162   6.048  -3.994  -4.462
  426    HA   LYS1162           HA       LYS1162   5.930  -1.376  -5.378
  427   1HB   LYS1162           HB2      LYS1162   5.345  -2.671  -7.533
  428   2HB   LYS1162           HB1      LYS1162   3.797  -2.972  -6.756
  429   1HG   LYS1162           HG2      LYS1162   3.386  -0.588  -6.581
  430   2HG   LYS1162           HG1      LYS1162   4.956  -0.253  -7.313
  431   1HD   LYS1162           HD2      LYS1162   3.249  -0.036  -8.995
  432   2HD   LYS1162           HD1      LYS1162   4.216  -1.470  -9.344
  433   1HE   LYS1162           HE2      LYS1162   2.498  -2.879  -8.321
  434   2HE   LYS1162           HE1      LYS1162   1.530  -1.446  -7.971
  435   1HZ   LYS1162           HZ2      LYS1162   2.292  -2.397 -10.679
  436   2HZ   LYS1162           HZ1      LYS1162   0.766  -2.562  -9.969
  437   3HZ   LYS1162           HZ3      LYS1162   1.364  -1.024 -10.344
  438    H    CYS1163           HN       CYS1163   3.999  -0.230  -4.693
  439    HA   CYS1163           HA       CYS1163   2.704  -1.602  -2.449
  440   1HB   CYS1163           HB2      CYS1163   1.950   0.869  -1.991
  441   2HB   CYS1163           HB1      CYS1163   3.585   0.348  -1.584
  442    H    LEU1164           HN       LEU1164   0.427  -0.723  -1.976
  443    HA   LEU1164           HA       LEU1164  -1.111  -0.481  -4.467
  444   1HB   LEU1164           HB2      LEU1164  -2.189  -2.078  -2.172
  445   2HB   LEU1164           HB1      LEU1164  -2.636  -2.129  -3.863
  446    HG   LEU1164           HG       LEU1164  -0.002  -3.144  -2.798
  447   1HD1  LEU1164          2HD1      LEU1164  -1.867  -4.432  -1.873
  448   2HD1  LEU1164          1HD1      LEU1164  -2.490  -4.694  -3.502
  449   3HD1  LEU1164          3HD1      LEU1164  -0.933  -5.377  -3.033
  450   1HD2  LEU1164          1HD2      LEU1164   0.033  -2.503  -5.151
  451   2HD2  LEU1164          3HD2      LEU1164   0.145  -4.254  -4.969
  452   3HD2  LEU1164          2HD2      LEU1164  -1.380  -3.514  -5.455
  453    H    HIS1165           HN       HIS1165  -2.554   1.102  -4.455
  454    HA   HIS1165           HA       HIS1165  -2.694   3.103  -2.598
  455   1HB   HIS1165           HB2      HIS1165  -4.923   2.207  -4.436
  456   2HB   HIS1165           HB1      HIS1165  -4.819   3.779  -3.651
  457    HD1  HIS1165           HD1      HIS1165  -3.752   5.562  -4.992
  458    HD2  HIS1165           HD2      HIS1165  -2.618   1.774  -6.270
  459    HE1  HIS1165           HE1      HIS1165  -2.342   5.939  -7.040
  460    HE2  HIS1165           HE2      HIS1165  -1.733   3.628  -7.841
  461    HA   PRO1166           HA       PRO1166  -4.834   1.688   0.975
  462   1HB   PRO1166           HB2      PRO1166  -6.278   3.974   1.563
  463   2HB   PRO1166           HB1      PRO1166  -4.595   3.690   2.017
  464   1HG   PRO1166           HG2      PRO1166  -5.707   5.233  -0.287
  465   2HG   PRO1166           HG1      PRO1166  -4.323   5.615   0.755
  466   1HD   PRO1166           HD2      PRO1166  -3.978   4.624  -1.710
  467   2HD   PRO1166           HD1      PRO1166  -2.915   4.150  -0.368
  468    H    CYS1167           HN       CYS1167  -7.156   1.905   1.974
  469    HA   CYS1167           HA       CYS1167  -8.946   0.736   0.054
  470   1HB   CYS1167           HB2      CYS1167  -8.721  -0.104   2.381
  471   2HB   CYS1167           HB1      CYS1167  -9.391   1.409   2.974
  472    H    VAL1168           HN       VAL1168  -8.418   3.347  -0.666
  473    HA   VAL1168           HA       VAL1168 -10.561   5.050   0.237
  474    HB   VAL1168           HB       VAL1168  -8.620   5.448  -2.046
  475   1HG1  VAL1168          2HG1      VAL1168 -10.671   6.764  -2.290
  476   2HG1  VAL1168          1HG1      VAL1168 -10.444   7.417  -0.668
  477   3HG1  VAL1168          3HG1      VAL1168  -9.281   7.794  -1.940
  478   1HG2  VAL1168          1HG2      VAL1168  -8.562   6.485   0.786
  479   2HG2  VAL1168          3HG2      VAL1168  -7.474   5.283   0.091
  480   3HG2  VAL1168          2HG2      VAL1168  -7.443   6.946  -0.498
  481    H    ILE1169           HN       ILE1169 -12.380   3.748  -0.309
  482    HA   ILE1169           HA       ILE1169 -12.855   3.001  -3.047
  483    HB   ILE1169           HB       ILE1169 -13.803   1.974  -0.796
  484   1HG1  ILE1169          2HG1      ILE1169 -15.467   2.188  -3.315
  485   2HG1  ILE1169          1HG1      ILE1169 -14.150   1.047  -3.051
  486   1HG2  ILE1169          2HG2      ILE1169 -14.962   4.008  -0.118
  487   2HG2  ILE1169          1HG2      ILE1169 -15.960   3.925  -1.571
  488   3HG2  ILE1169          3HG2      ILE1169 -16.083   2.664  -0.344
  489   1HD1  ILE1169          1HD1      ILE1169 -16.711   1.160  -1.474
  490   2HD1  ILE1169          3HD1      ILE1169 -16.326  -0.003  -2.743
  491   3HD1  ILE1169          2HD1      ILE1169 -15.399   0.006  -1.242
  492    H    SER1170           HN       SER1170 -15.423   3.685  -3.588
  493    HA   SER1170           HA       SER1170 -15.157   6.557  -4.027
  494   1HB   SER1170           HB2      SER1170 -17.087   4.540  -5.189
  495   2HB   SER1170           HB1      SER1170 -17.047   6.250  -5.617
  496    HG   SER1170           HG       SER1170 -14.887   4.433  -5.918
  497    H    ARG1171           HN       ARG1171 -15.828   7.704  -2.315
  498    HA   ARG1171           HA       ARG1171 -18.107   6.967  -0.704
  499   1HB   ARG1171           HB2      ARG1171 -17.688   9.133   0.418
  500   2HB   ARG1171           HB1      ARG1171 -16.239   8.143   0.317
  501   1HG   ARG1171           HG2      ARG1171 -15.404   9.470  -1.512
  502   2HG   ARG1171           HG1      ARG1171 -16.899  10.406  -1.556
  503   1HD   ARG1171           HD2      ARG1171 -14.975  10.289   0.763
  504   2HD   ARG1171           HD1      ARG1171 -15.084  11.602  -0.409
  505    HE   ARG1171           HE       ARG1171 -17.547  11.002   0.976
  506   1HH1  ARG1171          1HH1      ARG1171 -14.618  12.888   0.950
  507   2HH1  ARG1171          2HH1      ARG1171 -15.260  14.136   1.966
  508   1HH2  ARG1171          1HH2      ARG1171 -18.401  12.639   2.313
  509   2HH2  ARG1171          2HH2      ARG1171 -17.410  13.993   2.741
  510    H    GLU1172           HN       GLU1172 -18.223   7.683  -3.699
  511    HA   GLU1172           HA       GLU1172 -20.444   9.602  -3.480
  512   1HB   GLU1172           HB2      GLU1172 -18.429  10.427  -4.741
  513   2HB   GLU1172           HB1      GLU1172 -18.699   9.140  -5.907
  514   1HG   GLU1172           HG2      GLU1172 -19.588  11.233  -6.723
  515   2HG   GLU1172           HG1      GLU1172 -20.890  10.078  -6.438
  516    H    ILE1173           HN       ILE1173 -19.805   6.451  -3.758
  517    HA   ILE1173           HA       ILE1173 -22.094   5.975  -5.546
  518    HB   ILE1173           HB       ILE1173 -20.016   5.160  -6.556
  519   1HG1  ILE1173          2HG1      ILE1173 -21.037   2.542  -6.022
  520   2HG1  ILE1173          1HG1      ILE1173 -22.388   3.673  -6.080
  521   1HG2  ILE1173          2HG2      ILE1173 -19.813   3.424  -4.102
  522   2HG2  ILE1173          1HG2      ILE1173 -18.810   3.275  -5.545
  523   3HG2  ILE1173          3HG2      ILE1173 -18.723   4.732  -4.557
  524   1HD1  ILE1173          1HD1      ILE1173 -20.292   3.312  -8.214
  525   2HD1  ILE1173          3HD1      ILE1173 -21.942   2.690  -8.261
  526   3HD1  ILE1173          2HD1      ILE1173 -21.655   4.430  -8.280
  527    H    MET1174           HN       MET1174 -20.306   4.688  -2.731
  528    HA   MET1174           HA       MET1174 -22.422   2.887  -2.055
  529   1HB   MET1174           HB2      MET1174 -21.142   2.367  -0.069
  530   2HB   MET1174           HB1      MET1174 -20.078   2.408  -1.467
  531   1HG   MET1174           HG2      MET1174 -18.963   4.254  -0.746
  532   2HG   MET1174           HG1      MET1174 -20.348   4.879   0.149
  533   1HE   MET1174           HE3      MET1174 -21.251   2.357   1.841
  534   2HE   MET1174           HE2      MET1174 -20.356   2.618   3.338
  535   3HE   MET1174           HE1      MET1174 -21.115   3.980   2.515
  536    H    GLU1175           HN       GLU1175 -21.212   5.903  -0.593
  537    HA   GLU1175           HA       GLU1175 -23.463   6.023   1.198
  538   1HB   GLU1175           HB2      GLU1175 -22.384   7.786   2.228
  539   2HB   GLU1175           HB1      GLU1175 -21.005   6.959   1.507
  540   1HG   GLU1175           HG2      GLU1175 -20.976   8.524  -0.325
  541   2HG   GLU1175           HG1      GLU1175 -22.428   9.315   0.285
  542    H    ASN1176           HN       ASN1176 -23.447   6.253  -1.936
  543    HA   ASN1176           HA       ASN1176 -24.999   8.719  -2.194
  544   1HB   ASN1176           HB2      ASN1176 -23.109   8.274  -3.759
  545   2HB   ASN1176           HB1      ASN1176 -24.017   6.895  -4.363
  546   1HD2  ASN1176          1HD2      ASN1176 -24.137   7.743  -6.431
  547   2HD2  ASN1176          2HD2      ASN1176 -25.171   9.072  -6.822
  548    H    TYR1177           HN       TYR1177 -25.227   5.467  -3.675
  549    HA   TYR1177           HA       TYR1177 -27.941   5.645  -4.304
  550   1HB   TYR1177           HB2      TYR1177 -26.388   3.133  -3.655
  551   2HB   TYR1177           HB1      TYR1177 -27.906   3.213  -4.539
  552    HD1  TYR1177           HD1      TYR1177 -27.360   5.496  -6.367
  553    HD2  TYR1177           HD2      TYR1177 -24.909   2.229  -5.183
  554    HE1  TYR1177           HE1      TYR1177 -26.118   5.667  -8.483
  555    HE2  TYR1177           HE2      TYR1177 -23.658   2.391  -7.285
  556    HH   TYR1177           HH       TYR1177 -23.916   5.053  -9.381
  557    H    ASN1178           HN       ASN1178 -26.704   3.388  -1.894
  558    HA   ASN1178           HA       ASN1178 -28.165   4.332   0.280
  559   1HB   ASN1178           HB2      ASN1178 -29.798   2.227   0.202
  560   2HB   ASN1178           HB1      ASN1178 -30.239   3.777  -0.512
  561   1HD2  ASN1178          1HD2      ASN1178 -29.023   0.567  -1.183
  562   2HD2  ASN1178          2HD2      ASN1178 -29.471   0.537  -2.850
  563    H    ILE1179           HN       ILE1179 -25.582   3.281  -0.136
  564    HA   ILE1179           HA       ILE1179 -25.642   0.634   1.100
  565    HB   ILE1179           HB       ILE1179 -23.172   2.226   0.413
  566   1HG1  ILE1179          2HG1      ILE1179 -24.778   0.328  -1.308
  567   2HG1  ILE1179          1HG1      ILE1179 -24.337   1.996  -1.668
  568   1HG2  ILE1179          1HG2      ILE1179 -23.642  -0.716   0.870
  569   2HG2  ILE1179          3HG2      ILE1179 -22.106   0.008   0.389
  570   3HG2  ILE1179          2HG2      ILE1179 -22.812   0.399   1.958
  571   1HD1  ILE1179          1HD1      ILE1179 -21.922   1.198  -1.639
  572   2HD1  ILE1179          3HD1      ILE1179 -22.581  -0.437  -1.670
  573   3HD1  ILE1179          2HD1      ILE1179 -22.922   0.677  -2.995
  574    H    ALA1180           HN       ALA1180 -24.124   0.289   2.982
  575    HA   ALA1180           HA       ALA1180 -23.914   2.629   4.725
  576   1HB   ALA1180           HB2      ALA1180 -26.057   1.580   5.270
  577   2HB   ALA1180           HB1      ALA1180 -25.237   0.042   5.561
  578   3HB   ALA1180           HB3      ALA1180 -24.912   1.429   6.604
  579    H    LEU1181           HN       LEU1181 -22.763   1.906   6.850
  580    HA   LEU1181           HA       LEU1181 -20.541   0.118   6.102
  581   1HB   LEU1181           HB2      LEU1181 -20.481   2.816   6.871
  582   2HB   LEU1181           HB1      LEU1181 -19.928   1.927   8.276
  583    HG   LEU1181           HG       LEU1181 -18.013   2.573   6.996
  584   1HD1  LEU1181          3HD1      LEU1181 -18.596  -0.350   6.549
  585   2HD1  LEU1181          2HD1      LEU1181 -17.004   0.406   6.485
  586   3HD1  LEU1181          1HD1      LEU1181 -17.900   0.365   8.004
  587   1HD2  LEU1181          1HD2      LEU1181 -19.360   1.255   4.644
  588   2HD2  LEU1181          3HD2      LEU1181 -19.052   2.979   4.857
  589   3HD2  LEU1181          2HD2      LEU1181 -17.703   1.861   4.659
  590    H    ARG1182           HN       ARG1182 -19.566  -1.107   7.877
  591    HA   ARG1182           HA       ARG1182 -21.495  -2.343   9.514
  592   1HB   ARG1182           HB2      ARG1182 -19.483  -3.373  10.666
  593   2HB   ARG1182           HB1      ARG1182 -19.610  -3.645   8.935
  594   1HG   ARG1182           HG2      ARG1182 -17.972  -1.884   8.530
  595   2HG   ARG1182           HG1      ARG1182 -17.847  -1.605  10.268
  596   1HD   ARG1182           HD2      ARG1182 -17.056  -3.898  10.580
  597   2HD   ARG1182           HD1      ARG1182 -17.179  -4.177   8.845
  598    HE   ARG1182           HE       ARG1182 -15.542  -1.970   9.180
  599   1HH1  ARG1182          1HH1      ARG1182 -15.521  -5.345  10.047
  600   2HH1  ARG1182          2HH1      ARG1182 -13.794  -5.473  10.020
  601   1HH2  ARG1182          1HH2      ARG1182 -13.268  -2.130   9.143
  602   2HH2  ARG1182          2HH2      ARG1182 -12.514  -3.646   9.507
  603    H    TRP1183           HN       TRP1183 -20.203   0.647   9.794
  604    HA   TRP1183           HA       TRP1183 -20.549   0.692  12.721
  605   1HB   TRP1183           HB2      TRP1183 -19.001   2.769  11.186
  606   2HB   TRP1183           HB1      TRP1183 -18.920   2.383  12.902
  607    HD1  TRP1183           HD1      TRP1183 -17.727   1.088   9.493
  608    HE1  TRP1183           HE1      TRP1183 -15.753  -0.517   9.874
  609    HE3  TRP1183           HE3      TRP1183 -17.820   0.872  14.602
  610    HZ2  TRP1183           HZ2      TRP1183 -14.406  -1.699  12.036
  611    HZ3  TRP1183           HZ3      TRP1183 -16.147  -0.520  15.751
  612    HH2  TRP1183           HH2      TRP1183 -14.474  -1.780  14.493
  613    H    THR1184           HN       THR1184 -21.628   1.785   9.689
  614    HA   THR1184           HA       THR1184 -23.162   3.310   8.983
  615    HB   THR1184           HB       THR1184 -25.196   3.517  10.356
  616    HG1  THR1184           HG1      THR1184 -25.059   3.233  12.441
  617   1HG2  THR1184          3HG2      THR1184 -24.065   0.718  10.266
  618   2HG2  THR1184          2HG2      THR1184 -25.771   1.131  10.434
  619   3HG2  THR1184          1HG2      THR1184 -24.906   1.541   8.953
  620    H    ALA1185           HN       ALA1185 -21.746   5.098   8.926
  621    HA   ALA1185           HA       ALA1185 -22.545   7.219  10.739
  622   1HB   ALA1185           HB2      ALA1185 -19.641   6.467  10.465
  623   2HB   ALA1185           HB3      ALA1185 -20.642   6.192  11.890
  624   3HB   ALA1185           HB1      ALA1185 -20.285   7.838  11.367
  625    H    LYS1186           HN       LYS1186 -22.495   6.418   7.761
  626    HA   LYS1186           HA       LYS1186 -22.534   7.556   5.811
  627   1HB   LYS1186           HB2      LYS1186 -21.929   9.883   7.623
  628   2HB   LYS1186           HB1      LYS1186 -22.134  10.059   5.886
  629   1HG   LYS1186           HG2      LYS1186 -24.407   9.187   6.062
  630   2HG   LYS1186           HG1      LYS1186 -24.198   8.994   7.805
  631   1HD   LYS1186           HD2      LYS1186 -23.865  11.403   8.038
  632   2HD   LYS1186           HD1      LYS1186 -24.055  11.602   6.294
  633   1HE   LYS1186           HE2      LYS1186 -26.116  12.162   7.471
  634   2HE   LYS1186           HE1      LYS1186 -26.336  10.751   6.436
  635   1HZ   LYS1186           HZ3      LYS1186 -26.094   9.335   8.381
  636   2HZ   LYS1186           HZ2      LYS1186 -25.889  10.691   9.372
  637   3HZ   LYS1186           HZ1      LYS1186 -27.367  10.430   8.592
  638    H    GLN1187           HN       GLN1187 -21.057   6.960   4.471
  639    HA   GLN1187           HA       GLN1187 -19.134   6.995   3.250
  640   1HB   GLN1187           HB2      GLN1187 -18.895   9.384   3.816
  641   2HB   GLN1187           HB1      GLN1187 -18.105   8.946   5.323
  642   1HG   GLN1187           HG2      GLN1187 -16.354   7.789   3.925
  643   2HG   GLN1187           HG1      GLN1187 -17.086   8.576   2.526
  644   1HE2  GLN1187          1HE2      GLN1187 -17.772  10.971   4.068
  645   2HE2  GLN1187          2HE2      GLN1187 -16.293  11.838   4.273
  646    H    LYS1188           HN       LYS1188 -17.165   7.630   5.998
  647    HA   LYS1188           HA       LYS1188 -15.536   6.338   6.962
  648   1HB   LYS1188           HB2      LYS1188 -17.715   5.960   8.226
  649   2HB   LYS1188           HB1      LYS1188 -17.808   4.413   7.397
  650   1HG   LYS1188           HG2      LYS1188 -15.766   3.670   8.409
  651   2HG   LYS1188           HG1      LYS1188 -15.484   5.263   9.112
  652   1HD   LYS1188           HD2      LYS1188 -17.907   3.598   9.751
  653   2HD   LYS1188           HD1      LYS1188 -16.408   3.510  10.677
  654   1HE   LYS1188           HE2      LYS1188 -18.082   5.981  10.251
  655   2HE   LYS1188           HE1      LYS1188 -18.022   5.016  11.726
  656   1HZ   LYS1188           HZ2      LYS1188 -15.734   6.486  10.530
  657   2HZ   LYS1188           HZ1      LYS1188 -16.616   6.970  11.891
  658   3HZ   LYS1188           HZ3      LYS1188 -15.679   5.562  11.947
  659    H    LEU1189           HN       LEU1189 -15.848   5.776   4.060
  660    HA   LEU1189           HA       LEU1189 -15.343   2.909   3.904
  661   1HB   LEU1189           HB2      LEU1189 -15.152   3.453   1.420
  662   2HB   LEU1189           HB1      LEU1189 -16.725   3.516   2.182
  663    HG   LEU1189           HG       LEU1189 -15.906   5.380   0.508
  664   1HD1  LEU1189          2HD1      LEU1189 -17.569   5.661   2.958
  665   2HD1  LEU1189          1HD1      LEU1189 -17.393   6.987   1.806
  666   3HD1  LEU1189          3HD1      LEU1189 -18.078   5.448   1.284
  667   1HD2  LEU1189          2HD2      LEU1189 -14.909   6.427   3.138
  668   2HD2  LEU1189          1HD2      LEU1189 -13.932   6.055   1.718
  669   3HD2  LEU1189          3HD2      LEU1189 -15.103   7.371   1.661
  670    H    TYR1190           HN       TYR1190 -13.335   4.224   5.315
  671    HA   TYR1190           HA       TYR1190 -11.105   4.076   3.395
  672   1HB   TYR1190           HB2      TYR1190 -11.670   6.054   5.545
  673   2HB   TYR1190           HB1      TYR1190  -9.991   5.608   5.264
  674    HD1  TYR1190           HD1      TYR1190 -12.383   5.642   2.482
  675    HD2  TYR1190           HD2      TYR1190  -9.416   7.867   4.582
  676    HE1  TYR1190           HE1      TYR1190 -12.264   7.244   0.619
  677    HE2  TYR1190           HE2      TYR1190  -9.295   9.470   2.723
  678    HH   TYR1190           HH       TYR1190 -11.593   9.573   0.229
  679    H    SER1191           HN       SER1191  -9.457   2.768   3.851
  680    HA   SER1191           HA       SER1191  -8.987   1.836   6.569
  681   1HB   SER1191           HB2      SER1191  -9.741  -0.014   4.300
  682   2HB   SER1191           HB1      SER1191  -8.917  -0.569   5.755
  683    HG   SER1191           HG       SER1191 -10.681   0.000   6.966
  684    H    ARG1192           HN       ARG1192  -7.116   0.074   6.391
  685    HA   ARG1192           HA       ARG1192  -4.985   1.376   4.868
  686   1HB   ARG1192           HB2      ARG1192  -4.667   1.008   7.297
  687   2HB   ARG1192           HB1      ARG1192  -4.843  -0.721   7.048
  688   1HG   ARG1192           HG2      ARG1192  -2.518  -0.202   7.261
  689   2HG   ARG1192           HG1      ARG1192  -2.844  -0.676   5.592
  690   1HD   ARG1192           HD2      ARG1192  -2.898   1.671   4.927
  691   2HD   ARG1192           HD1      ARG1192  -2.601   2.158   6.596
  692    HE   ARG1192           HE       ARG1192  -0.622   0.423   5.350
  693   1HH1  ARG1192          1HH1      ARG1192  -1.556   3.634   6.327
  694   2HH1  ARG1192          2HH1      ARG1192   0.057   4.261   6.264
  695   1HH2  ARG1192          1HH2      ARG1192   1.504   1.240   5.264
  696   2HH2  ARG1192          2HH2      ARG1192   1.796   2.901   5.659
  697    H    THR1193           HN       THR1193  -4.546   0.543   2.936
  698    HA   THR1193           HA       THR1193  -5.516  -1.441   1.547
  699    HB   THR1193           HB       THR1193  -2.571  -0.821   1.758
  700    HG1  THR1193           HG1      THR1193  -4.718   0.040   0.163
  701   1HG2  THR1193          3HG2      THR1193  -3.965  -2.549  -0.286
  702   2HG2  THR1193          2HG2      THR1193  -2.307  -1.963  -0.419
  703   3HG2  THR1193          1HG2      THR1193  -2.750  -3.073   0.879
  704    H    GLY1194           HN       GLY1194  -6.205  -3.347   2.249
  705   1HA   GLY1194           HA1      GLY1194  -4.286  -5.052   3.699
  706   2HA   GLY1194           HA2      GLY1194  -5.339  -5.683   2.437
  707    H    GLU1195           HN       GLU1195  -6.614  -3.267   4.539
  708    HA   GLU1195           HA       GLU1195  -7.646  -5.116   6.490
  709   1HB   GLU1195           HB2      GLU1195  -8.223  -2.195   5.982
  710   2HB   GLU1195           HB1      GLU1195  -8.937  -3.118   7.299
  711   1HG   GLU1195           HG2      GLU1195  -6.554  -3.637   8.015
  712   2HG   GLU1195           HG1      GLU1195  -6.062  -2.370   6.891
  713    H    SER1196           HN       SER1196  -9.794  -5.722   6.799
  714    HA   SER1196           HA       SER1196 -11.322  -5.907   4.334
  715   1HB   SER1196           HB2      SER1196 -11.787  -7.165   7.048
  716   2HB   SER1196           HB1      SER1196 -12.723  -7.507   5.592
  717    HG   SER1196           HG       SER1196  -9.918  -7.855   5.734
  718    H    VAL1197           HN       VAL1197 -13.072  -4.738   3.879
  719    HA   VAL1197           HA       VAL1197 -14.252  -3.124   6.044
  720    HB   VAL1197           HB       VAL1197 -14.109  -2.454   3.100
  721   1HG1  VAL1197          3HG1      VAL1197 -15.199  -0.868   5.428
  722   2HG1  VAL1197          2HG1      VAL1197 -15.035  -0.281   3.772
  723   3HG1  VAL1197          1HG1      VAL1197 -16.145  -1.602   4.133
  724   1HG2  VAL1197          1HG2      VAL1197 -12.656  -1.281   5.470
  725   2HG2  VAL1197          3HG2      VAL1197 -11.944  -2.243   4.175
  726   3HG2  VAL1197          2HG2      VAL1197 -12.606  -0.646   3.826
  727    H    GLU1198           HN       GLU1198 -16.385  -3.239   6.387
  728    HA   GLU1198           HA       GLU1198 -17.945  -4.986   4.610
  729   1HB   GLU1198           HB2      GLU1198 -18.123  -6.052   6.623
  730   2HB   GLU1198           HB1      GLU1198 -17.883  -4.577   7.547
  731   1HG   GLU1198           HG2      GLU1198 -20.120  -3.958   7.378
  732   2HG   GLU1198           HG1      GLU1198 -20.422  -5.070   6.039
  733    H    PHE1199           HN       PHE1199 -19.210  -3.898   3.256
  734    HA   PHE1199           HA       PHE1199 -20.270  -1.293   4.067
  735   1HB   PHE1199           HB2      PHE1199 -20.355  -2.625   1.351
  736   2HB   PHE1199           HB1      PHE1199 -20.836  -0.973   1.713
  737    HD1  PHE1199           HD1      PHE1199 -19.264   0.775   1.762
  738    HD2  PHE1199           HD2      PHE1199 -17.958  -3.269   1.560
  739    HE1  PHE1199           HE1      PHE1199 -16.976   1.548   1.267
  740    HE2  PHE1199           HE2      PHE1199 -15.675  -2.513   1.074
  741    HZ   PHE1199           HZ       PHE1199 -15.175  -0.104   0.928
  742    H    VAL1200           HN       VAL1200 -21.951  -1.894   5.429
  743    HA   VAL1200           HA       VAL1200 -23.886  -3.853   4.885
  744    HB   VAL1200           HB       VAL1200 -24.405  -1.350   6.479
  745   1HG1  VAL1200          3HG1      VAL1200 -25.352  -4.186   6.603
  746   2HG1  VAL1200          2HG1      VAL1200 -25.544  -3.070   7.955
  747   3HG1  VAL1200          1HG1      VAL1200 -26.298  -2.712   6.401
  748   1HG2  VAL1200          3HG2      VAL1200 -22.795  -3.749   7.348
  749   2HG2  VAL1200          2HG2      VAL1200 -22.186  -2.111   7.115
  750   3HG2  VAL1200          1HG2      VAL1200 -23.339  -2.448   8.407
  751    H    CYS1201           HN       CYS1201 -26.365  -2.676   5.023
  752    HA   CYS1201           HA       CYS1201 -26.452  -1.007   2.603
  753   1HB   CYS1201           HB2      CYS1201 -28.815  -2.671   3.343
  754   2HB   CYS1201           HB1      CYS1201 -28.261  -2.149   1.761
  755    H    LYS1202           HN       LYS1202 -27.939   0.659   2.548
  756    HA   LYS1202           HA       LYS1202 -28.314   2.204   4.738
  757   1HB   LYS1202           HB2      LYS1202 -28.793   2.791   2.333
  758   2HB   LYS1202           HB1      LYS1202 -30.352   1.999   2.524
  759   1HG   LYS1202           HG2      LYS1202 -31.030   3.583   4.175
  760   2HG   LYS1202           HG1      LYS1202 -29.417   4.304   4.210
  761   1HD   LYS1202           HD2      LYS1202 -29.695   4.919   1.826
  762   2HD   LYS1202           HD1      LYS1202 -31.349   4.303   1.896
  763   1HE   LYS1202           HE2      LYS1202 -30.248   6.487   3.660
  764   2HE   LYS1202           HE1      LYS1202 -31.174   6.772   2.184
  765   1HZ   LYS1202           HZ2      LYS1202 -32.151   5.324   4.587
  766   2HZ   LYS1202           HZ1      LYS1202 -32.577   6.900   4.143
  767   3HZ   LYS1202           HZ3      LYS1202 -33.039   5.592   3.173
  768    H    ARG1203           HN       ARG1203 -28.984   1.363   6.605
  769    HA   ARG1203           HA       ARG1203 -30.256  -0.349   7.784
  770   1HB   ARG1203           HB2      ARG1203 -31.373   2.437   7.754
  771   2HB   ARG1203           HB1      ARG1203 -31.912   1.213   8.892
  772   1HG   ARG1203           HG2      ARG1203 -29.645   1.011   9.763
  773   2HG   ARG1203           HG1      ARG1203 -29.093   2.223   8.604
  774   1HD   ARG1203           HD2      ARG1203 -31.124   2.656  10.792
  775   2HD   ARG1203           HD1      ARG1203 -29.449   3.204  10.812
  776    HE   ARG1203           HE       ARG1203 -30.613   4.243   8.519
  777   1HH1  ARG1203          1HH1      ARG1203 -31.022   4.499  11.969
  778   2HH1  ARG1203          2HH1      ARG1203 -31.620   6.124  11.907
  779   1HH2  ARG1203          1HH2      ARG1203 -31.398   6.381   8.427
  780   2HH2  ARG1203          2HH2      ARG1203 -31.833   7.193   9.894
  781    H    GLY1204           HN       GLY1204 -31.133  -1.822   6.222
  782   1HA   GLY1204           HA1      GLY1204 -33.859  -1.161   5.331
  783   2HA   GLY1204           HA2      GLY1204 -33.578  -2.623   6.261
  784    H    TYR1205           HN       TYR1205 -31.907  -1.084   3.493
  785    HA   TYR1205           HA       TYR1205 -32.746  -2.762   1.493
  786   1HB   TYR1205           HB2      TYR1205 -30.169  -1.297   1.907
  787   2HB   TYR1205           HB1      TYR1205 -30.374  -2.327   0.500
  788    HD1  TYR1205           HD1      TYR1205 -31.904  -1.693  -1.276
  789    HD2  TYR1205           HD2      TYR1205 -31.417   0.767   2.157
  790    HE1  TYR1205           HE1      TYR1205 -33.023   0.153  -2.450
  791    HE2  TYR1205           HE2      TYR1205 -32.540   2.621   0.994
  792    HH   TYR1205           HH       TYR1205 -32.987   3.348  -1.310
  793    H    ARG1206           HN       ARG1206 -32.333  -4.771   0.816
  794    HA   ARG1206           HA       ARG1206 -30.538  -6.401   2.478
  795   1HB   ARG1206           HB2      ARG1206 -31.913  -8.315   1.856
  796   2HB   ARG1206           HB1      ARG1206 -32.901  -7.046   2.569
  797   1HG   ARG1206           HG2      ARG1206 -33.591  -6.342   0.314
  798   2HG   ARG1206           HG1      ARG1206 -32.640  -7.665  -0.366
  799   1HD   ARG1206           HD2      ARG1206 -34.000  -9.281   0.856
  800   2HD   ARG1206           HD1      ARG1206 -34.950  -7.966   1.546
  801    HE   ARG1206           HE       ARG1206 -35.013  -7.772  -1.254
  802   1HH1  ARG1206          1HH1      ARG1206 -36.198  -9.796   1.322
  803   2HH1  ARG1206          2HH1      ARG1206 -37.602 -10.309   0.447
  804   1HH2  ARG1206          1HH2      ARG1206 -36.859  -8.442  -2.413
  805   2HH2  ARG1206          2HH2      ARG1206 -37.977  -9.540  -1.676
  806    H    LEU1207           HN       LEU1207 -28.920  -7.528   1.602
  807    HA   LEU1207           HA       LEU1207 -27.966  -6.938  -0.981
  808   1HB   LEU1207           HB2      LEU1207 -26.741  -7.819   1.160
  809   2HB   LEU1207           HB1      LEU1207 -27.141  -9.398   0.517
  810    HG   LEU1207           HG       LEU1207 -24.851  -8.684  -0.050
  811   1HD1  LEU1207          2HD1      LEU1207 -26.059 -10.246  -1.504
  812   2HD1  LEU1207          1HD1      LEU1207 -26.643  -8.885  -2.461
  813   3HD1  LEU1207          3HD1      LEU1207 -24.917  -9.243  -2.399
  814   1HD2  LEU1207          1HD2      LEU1207 -26.231  -6.509  -1.606
  815   2HD2  LEU1207          3HD2      LEU1207 -25.198  -6.298  -0.190
  816   3HD2  LEU1207          2HD2      LEU1207 -24.514  -6.906  -1.697
  817    H    SER1208           HN       SER1208 -29.453  -7.439  -2.554
  818    HA   SER1208           HA       SER1208 -29.497 -10.127  -3.464
  819   1HB   SER1208           HB2      SER1208 -31.224 -10.315  -1.709
  820   2HB   SER1208           HB1      SER1208 -32.124  -9.002  -2.469
  821    HG   SER1208           HG       SER1208 -31.438 -11.172  -4.072
  822    H    SER1209           HN       SER1209 -28.661  -7.732  -4.535
  823    HA   SER1209           HA       SER1209 -30.259  -7.698  -6.962
  824   1HB   SER1209           HB2      SER1209 -31.362  -5.984  -5.688
  825   2HB   SER1209           HB1      SER1209 -29.822  -5.247  -5.258
  826    HG   SER1209           HG       SER1209 -30.856  -4.143  -6.982
  827    H    ARG1210           HN       ARG1210 -27.812  -8.781  -6.784
  828    HA   ARG1210           HA       ARG1210 -25.670  -8.745  -7.555
  829   1HB   ARG1210           HB2      ARG1210 -26.999  -6.762  -9.396
  830   2HB   ARG1210           HB1      ARG1210 -25.357  -7.342  -9.640
  831   1HG   ARG1210           HG2      ARG1210 -26.200  -9.632  -9.827
  832   2HG   ARG1210           HG1      ARG1210 -27.846  -9.040  -9.590
  833   1HD   ARG1210           HD2      ARG1210 -26.005  -8.291 -11.857
  834   2HD   ARG1210           HD1      ARG1210 -27.363  -9.411 -11.956
  835    HE   ARG1210           HE       ARG1210 -28.305  -6.959 -10.991
  836   1HH1  ARG1210          1HH1      ARG1210 -26.981  -8.334 -13.906
  837   2HH1  ARG1210          2HH1      ARG1210 -27.815  -7.237 -14.956
  838   1HH2  ARG1210          1HH2      ARG1210 -29.407  -5.512 -12.365
  839   2HH2  ARG1210          2HH2      ARG1210 -29.193  -5.632 -14.079
  840    H    SER1211           HN       SER1211 -24.734  -7.911  -5.663
  841    HA   SER1211           HA       SER1211 -23.769  -5.157  -5.954
  842   1HB   SER1211           HB2      SER1211 -24.930  -6.388  -3.449
  843   2HB   SER1211           HB1      SER1211 -24.044  -4.866  -3.478
  844    HG   SER1211           HG       SER1211 -25.660  -4.191  -5.081
  845    H    HIS1212           HN       HIS1212 -22.611  -7.863  -6.406
  846    HA   HIS1212           HA       HIS1212 -20.683  -9.009  -6.047
  847   1HB   HIS1212           HB2      HIS1212 -19.759  -6.327  -4.992
  848   2HB   HIS1212           HB1      HIS1212 -18.704  -7.664  -5.440
  849    HD1  HIS1212           HD1      HIS1212 -20.475  -4.770  -6.823
  850    HD2  HIS1212           HD2      HIS1212 -18.711  -8.240  -8.276
  851    HE1  HIS1212           HE1      HIS1212 -20.187  -4.395  -9.293
  852    HE2  HIS1212           HE2      HIS1212 -19.201  -6.543 -10.165
  853    H    THR1213           HN       THR1213 -19.506  -7.182  -3.397
  854    HA   THR1213           HA       THR1213 -20.698  -8.998  -1.444
  855    HB   THR1213           HB       THR1213 -18.601  -9.594  -0.446
  856    HG1  THR1213           HG1      THR1213 -16.703  -8.699  -1.051
  857   1HG2  THR1213          2HG2      THR1213 -18.560  -9.959  -3.439
  858   2HG2  THR1213          1HG2      THR1213 -17.526 -10.840  -2.312
  859   3HG2  THR1213          3HG2      THR1213 -19.277 -11.042  -2.245
  860    H    LEU1214           HN       LEU1214 -20.519  -8.312   0.749
  861    HA   LEU1214           HA       LEU1214 -20.464  -5.418   1.014
  862   1HB   LEU1214           HB2      LEU1214 -21.089  -7.535   3.079
  863   2HB   LEU1214           HB1      LEU1214 -21.338  -5.811   3.266
  864    HG   LEU1214           HG       LEU1214 -23.467  -6.702   2.830
  865   1HD1  LEU1214          3HD1      LEU1214 -22.366  -5.681   0.217
  866   2HD1  LEU1214          2HD1      LEU1214 -24.074  -5.775   0.646
  867   3HD1  LEU1214          1HD1      LEU1214 -22.998  -4.701   1.539
  868   1HD2  LEU1214          1HD2      LEU1214 -22.694  -8.909   2.054
  869   2HD2  LEU1214          3HD2      LEU1214 -23.977  -8.243   1.043
  870   3HD2  LEU1214          2HD2      LEU1214 -22.304  -8.199   0.486
  871    H    ARG1215           HN       ARG1215 -19.096  -8.157   2.811
  872    HA   ARG1215           HA       ARG1215 -16.990  -6.427   3.854
  873   1HB   ARG1215           HB2      ARG1215 -18.283  -8.089   5.288
  874   2HB   ARG1215           HB1      ARG1215 -17.392  -9.355   4.455
  875   1HG   ARG1215           HG2      ARG1215 -15.285  -8.364   5.243
  876   2HG   ARG1215           HG1      ARG1215 -16.210  -7.144   6.121
  877   1HD   ARG1215           HD2      ARG1215 -15.517  -8.945   7.605
  878   2HD   ARG1215           HD1      ARG1215 -17.272  -8.893   7.448
  879    HE   ARG1215           HE       ARG1215 -16.248 -10.695   5.558
  880   1HH1  ARG1215          1HH1      ARG1215 -16.634 -10.372   9.006
  881   2HH1  ARG1215          2HH1      ARG1215 -16.729 -12.079   9.284
  882   1HH2  ARG1215          1HH2      ARG1215 -16.372 -12.942   5.916
  883   2HH2  ARG1215          2HH2      ARG1215 -16.580 -13.540   7.528
  884    H    THR1216           HN       THR1216 -15.550  -6.081   2.239
  885    HA   THR1216           HA       THR1216 -14.299  -8.463   1.031
  886    HB   THR1216           HB       THR1216 -15.536  -7.076  -0.604
  887    HG1  THR1216           HG1      THR1216 -13.168  -6.524  -1.649
  888   1HG2  THR1216          1HG2      THR1216 -15.251  -4.895   0.469
  889   2HG2  THR1216          3HG2      THR1216 -13.524  -4.946   0.120
  890   3HG2  THR1216          2HG2      THR1216 -14.688  -4.857  -1.201
  891    H    THR1217           HN       THR1217 -12.133  -7.347  -0.120
  892    HA   THR1217           HA       THR1217 -10.593  -6.231   2.132
  893    HB   THR1217           HB       THR1217  -9.772  -8.272   0.064
  894    HG1  THR1217           HG1      THR1217  -9.071  -9.279   2.160
  895   1HG2  THR1217          2HG2      THR1217  -8.001  -6.712   1.950
  896   2HG2  THR1217          1HG2      THR1217  -7.495  -8.132   1.034
  897   3HG2  THR1217          3HG2      THR1217  -7.969  -6.658   0.187
  898    H    CYS1218           HN       CYS1218  -9.350  -4.447   1.709
  899    HA   CYS1218           HA       CYS1218  -9.590  -3.365  -1.002
  900   1HB   CYS1218           HB2      CYS1218  -8.452  -1.709   1.179
  901   2HB   CYS1218           HB1      CYS1218  -9.506  -1.255  -0.156
  902    H    TRP1219           HN       TRP1219  -7.860  -2.252  -1.944
  903    HA   TRP1219           HA       TRP1219  -5.272  -1.977  -1.227
  904   1HB   TRP1219           HB2      TRP1219  -4.031  -3.882  -1.807
  905   2HB   TRP1219           HB1      TRP1219  -5.401  -4.545  -0.926
  906    HD1  TRP1219           HD1      TRP1219  -3.927  -4.328  -4.440
  907    HE1  TRP1219           HE1      TRP1219  -5.066  -6.097  -5.905
  908    HE3  TRP1219           HE3      TRP1219  -7.536  -5.875  -1.186
  909    HZ2  TRP1219           HZ2      TRP1219  -7.207  -7.917  -5.720
  910    HZ3  TRP1219           HZ3      TRP1219  -9.094  -7.640  -1.899
  911    HH2  TRP1219           HH2      TRP1219  -8.935  -8.643  -4.125
  912    H    ASP1220           HN       ASP1220  -4.018  -1.216  -2.953
  913    HA   ASP1220           HA       ASP1220  -3.672  -0.224  -4.976
  914   1HB   ASP1220           HB2      ASP1220  -3.866  -2.573  -5.803
  915   2HB   ASP1220           HB1      ASP1220  -5.591  -2.310  -6.040
  916    H    GLY1221           HN       GLY1221  -6.290   0.025  -3.228
  917   1HA   GLY1221           HA1      GLY1221  -7.326   2.293  -4.615
  918   2HA   GLY1221           HA2      GLY1221  -7.936   1.620  -3.117
  919    H    LYS1222           HN       LYS1222  -8.059  -1.040  -4.731
  920    HA   LYS1222           HA       LYS1222 -10.478  -0.439  -6.281
  921   1HB   LYS1222           HB2      LYS1222  -8.300  -2.078  -6.841
  922   2HB   LYS1222           HB1      LYS1222  -9.577  -3.197  -6.381
  923   1HG   LYS1222           HG2      LYS1222  -9.828  -1.075  -8.501
  924   2HG   LYS1222           HG1      LYS1222  -9.496  -2.783  -8.802
  925   1HD   LYS1222           HD2      LYS1222 -11.628  -3.382  -7.761
  926   2HD   LYS1222           HD1      LYS1222 -11.960  -1.676  -7.455
  927   1HE   LYS1222           HE2      LYS1222 -11.608  -2.954 -10.163
  928   2HE   LYS1222           HE1      LYS1222 -13.142  -2.470  -9.441
  929   1HZ   LYS1222           HZ1      LYS1222 -10.906  -0.642 -10.136
  930   2HZ   LYS1222           HZ3      LYS1222 -12.345  -0.819 -11.009
  931   3HZ   LYS1222           HZ2      LYS1222 -12.378  -0.178  -9.444
  932    H    LEU1223           HN       LEU1223 -12.429  -1.165  -5.682
  933    HA   LEU1223           HA       LEU1223 -12.680  -3.253  -3.674
  934   1HB   LEU1223           HB2      LEU1223 -13.544  -0.410  -3.283
  935   2HB   LEU1223           HB1      LEU1223 -14.308  -1.725  -2.413
  936    HG   LEU1223           HG       LEU1223 -11.346  -1.181  -2.320
  937   1HD1  LEU1223          2HD1      LEU1223 -12.698   0.737  -1.491
  938   2HD1  LEU1223          1HD1      LEU1223 -13.419  -0.353  -0.306
  939   3HD1  LEU1223          3HD1      LEU1223 -11.687  -0.025  -0.261
  940   1HD2  LEU1223          1HD2      LEU1223 -12.080  -3.451  -1.737
  941   2HD2  LEU1223          3HD2      LEU1223 -11.411  -2.583  -0.355
  942   3HD2  LEU1223          2HD2      LEU1223 -13.157  -2.771  -0.516
  943    H    GLU1224           HN       GLU1224 -15.030  -3.727  -3.222
  944    HA   GLU1224           HA       GLU1224 -16.615  -3.396  -5.686
  945   1HB   GLU1224           HB2      GLU1224 -16.691  -5.735  -3.766
  946   2HB   GLU1224           HB1      GLU1224 -17.585  -5.590  -5.272
  947   1HG   GLU1224           HG2      GLU1224 -14.589  -5.738  -5.020
  948   2HG   GLU1224           HG1      GLU1224 -15.654  -7.061  -5.493
  949    H    TYR1225           HN       TYR1225 -17.630  -1.496  -4.809
  950    HA   TYR1225           HA       TYR1225 -19.018  -1.579  -2.325
  951   1HB   TYR1225           HB2      TYR1225 -20.290   0.432  -3.603
  952   2HB   TYR1225           HB1      TYR1225 -18.731   0.619  -2.805
  953    HD1  TYR1225           HD1      TYR1225 -16.675   0.749  -4.119
  954    HD2  TYR1225           HD2      TYR1225 -20.485   0.506  -5.984
  955    HE1  TYR1225           HE1      TYR1225 -15.670   1.505  -6.224
  956    HE2  TYR1225           HE2      TYR1225 -19.495   1.261  -8.111
  957    HH   TYR1225           HH       TYR1225 -16.144   1.376  -8.641
  958    HA   PRO1226           HA       PRO1226 -22.499  -3.935  -3.725
  959   1HB   PRO1226           HB2      PRO1226 -23.988  -3.712  -1.481
  960   2HB   PRO1226           HB1      PRO1226 -22.559  -4.747  -1.572
  961   1HG   PRO1226           HG2      PRO1226 -22.836  -1.995  -0.420
  962   2HG   PRO1226           HG1      PRO1226 -21.984  -3.402   0.242
  963   1HD   PRO1226           HD2      PRO1226 -20.710  -1.393  -1.054
  964   2HD   PRO1226           HD1      PRO1226 -20.141  -3.074  -1.086
  965    H    THR1227           HN       THR1227 -25.062  -3.324  -2.621
  966    HA   THR1227           HA       THR1227 -25.820  -0.632  -3.162
  967    HB   THR1227           HB       THR1227 -26.625  -2.688  -5.236
  968    HG1  THR1227           HG1      THR1227 -24.724  -2.068  -6.001
  969   1HG2  THR1227          1HG2      THR1227 -28.393  -1.067  -4.753
  970   2HG2  THR1227          3HG2      THR1227 -27.261   0.256  -5.023
  971   3HG2  THR1227          2HG2      THR1227 -27.714  -0.802  -6.359
  972    H    CYS1228           HN       CYS1228 -26.669  -4.000  -2.853
  973    HA   CYS1228           HA       CYS1228 -28.414  -5.109  -1.930
  974   1HB   CYS1228           HB2      CYS1228 -28.571  -2.646  -0.164
  975   2HB   CYS1228           HB1      CYS1228 -29.218  -4.245   0.207
  976    H    ALA1229           HN       ALA1229 -30.925  -4.612  -1.089
  977    HA   ALA1229           HA       ALA1229 -32.136  -2.751  -2.967
  978   1HB   ALA1229           HB1      ALA1229 -32.792  -5.685  -3.066
  979   2HB   ALA1229           HB2      ALA1229 -31.841  -4.804  -4.262
  980   3HB   ALA1229           HB3      ALA1229 -33.543  -4.410  -4.024
  981    H    LYS1230           HN       LYS1230 -34.111  -2.074  -2.506
  982    HA   LYS1230           HA       LYS1230 -35.735  -1.345  -1.135
  983   1HB   LYS1230           HB2      LYS1230 -37.418  -3.020  -0.594
  984   2HB   LYS1230           HB1      LYS1230 -36.789  -3.251  -2.219
  985   1HG   LYS1230           HG2      LYS1230 -35.208  -4.968  -1.100
  986   2HG   LYS1230           HG1      LYS1230 -36.379  -4.925   0.220
  987   1HD   LYS1230           HD2      LYS1230 -37.006  -6.718  -1.209
  988   2HD   LYS1230           HD1      LYS1230 -38.162  -5.412  -1.483
  989   1HE   LYS1230           HE2      LYS1230 -36.939  -4.737  -3.483
  990   2HE   LYS1230           HE1      LYS1230 -35.761  -6.021  -3.205
  991   1HZ   LYS1230           HZ3      LYS1230 -38.655  -6.418  -3.748
  992   2HZ   LYS1230           HZ2      LYS1230 -37.402  -6.665  -4.856
  993   3HZ   LYS1230           HZ1      LYS1230 -37.524  -7.649  -3.486
  994    H    ARG1231           HN       ARG1231 -34.973  -0.328   0.544
  995    HA   ARG1231           HA       ARG1231 -33.757  -1.308   2.797
  996   1HB   ARG1231           HB2      ARG1231 -34.590   0.820   3.872
  997   2HB   ARG1231           HB1      ARG1231 -33.701   1.025   2.380
  998   1HG   ARG1231           HG2      ARG1231 -35.799   1.291   1.160
  999   2HG   ARG1231           HG1      ARG1231 -36.696   1.086   2.666
 1000   1HD   ARG1231           HD2      ARG1231 -35.611   3.075   3.584
 1001   2HD   ARG1231           HD1      ARG1231 -34.708   3.279   2.084
 1002    HE   ARG1231           HE       ARG1231 -37.442   3.209   1.479
 1003   1HH1  ARG1231          1HH1      ARG1231 -35.125   5.247   3.098
 1004   2HH1  ARG1231          2HH1      ARG1231 -35.988   6.711   2.764
 1005   1HH2  ARG1231          1HH2      ARG1231 -38.585   5.132   1.036
 1006   2HH2  ARG1231          2HH2      ARG1231 -37.954   6.645   1.593

  No H/Q in entry =        1006
  Start of MODEL    7
    1    H1   GLU1103           HT3      GLU1103  41.256  -5.995  -7.290
    2    H2   GLU1103           HT2      GLU1103  42.375  -5.541  -6.106
    3    H3   GLU1103           HT1      GLU1103  42.103  -7.178  -6.428
    4    HA   GLU1103           HA       GLU1103  39.838  -6.993  -5.638
    5   1HB   GLU1103           HB2      GLU1103  41.900  -5.948  -3.685
    6   2HB   GLU1103           HB1      GLU1103  40.357  -6.670  -3.247
    7   1HG   GLU1103           HG2      GLU1103  42.603  -8.056  -4.697
    8   2HG   GLU1103           HG1      GLU1103  42.194  -8.245  -2.992
    9    H    ALA1104           HN       ALA1104  38.119  -5.719  -5.606
   10    HA   ALA1104           HA       ALA1104  38.461  -2.835  -5.663
   11   1HB   ALA1104           HB3      ALA1104  35.957  -4.495  -5.933
   12   2HB   ALA1104           HB2      ALA1104  36.092  -2.762  -6.228
   13   3HB   ALA1104           HB1      ALA1104  36.949  -3.902  -7.265
   14    H    GLU1105           HN       GLU1105  37.907  -1.442  -4.081
   15    HA   GLU1105           HA       GLU1105  36.555  -2.509  -1.697
   16   1HB   GLU1105           HB2      GLU1105  38.982  -0.704  -1.702
   17   2HB   GLU1105           HB1      GLU1105  38.073  -1.180  -0.274
   18   1HG   GLU1105           HG2      GLU1105  38.673  -3.512  -0.664
   19   2HG   GLU1105           HG1      GLU1105  39.577  -3.040  -2.103
   20    H    PHE1106           HN       PHE1106  36.362  -0.410  -4.155
   21    HA   PHE1106           HA       PHE1106  35.004   1.651  -2.544
   22   1HB   PHE1106           HB2      PHE1106  36.934   2.520  -3.796
   23   2HB   PHE1106           HB1      PHE1106  36.235   1.920  -5.296
   24    HD1  PHE1106           HD1      PHE1106  35.809   4.364  -2.566
   25    HD2  PHE1106           HD2      PHE1106  34.580   3.142  -6.453
   26    HE1  PHE1106           HE1      PHE1106  34.607   6.492  -2.852
   27    HE2  PHE1106           HE2      PHE1106  33.377   5.267  -6.746
   28    HZ   PHE1106           HZ       PHE1106  33.390   6.946  -4.944
   29    H    GLY1107           HN       GLY1107  32.870   1.396  -2.590
   30   1HA   GLY1107           HA1      GLY1107  31.419  -0.213  -4.301
   31   2HA   GLY1107           HA2      GLY1107  31.410   1.393  -5.011
   32    H    LYS1108           HN       LYS1108  31.450   2.778  -2.455
   33    HA   LYS1108           HA       LYS1108  29.430   2.037  -0.711
   34   1HB   LYS1108           HB2      LYS1108  30.318   4.802  -1.544
   35   2HB   LYS1108           HB1      LYS1108  29.237   4.483  -0.194
   36   1HG   LYS1108           HG2      LYS1108  31.048   3.065   0.800
   37   2HG   LYS1108           HG1      LYS1108  32.116   3.661  -0.473
   38   1HD   LYS1108           HD2      LYS1108  30.598   5.533   1.317
   39   2HD   LYS1108           HD1      LYS1108  32.162   4.864   1.790
   40   1HE   LYS1108           HE2      LYS1108  32.540   7.005   0.795
   41   2HE   LYS1108           HE1      LYS1108  33.117   5.771  -0.323
   42   1HZ   LYS1108           HZ1      LYS1108  30.477   7.114  -0.520
   43   2HZ   LYS1108           HZ3      LYS1108  31.847   7.554  -1.412
   44   3HZ   LYS1108           HZ2      LYS1108  31.144   6.032  -1.636
   45    H    CYS1109           HN       CYS1109  27.310   1.913  -0.838
   46    HA   CYS1109           HA       CYS1109  25.977   2.417  -3.302
   47   1HB   CYS1109           HB2      CYS1109  24.556   1.918  -0.704
   48   2HB   CYS1109           HB1      CYS1109  24.101   1.411  -2.330
   49    H    GLY1110           HN       GLY1110  23.963   3.705  -3.436
   50   1HA   GLY1110           HA1      GLY1110  23.746   6.146  -3.635
   51   2HA   GLY1110           HA2      GLY1110  24.294   6.249  -1.968
   52    HA   PRO1111           HA       PRO1111  19.969   6.756  -0.997
   53   1HB   PRO1111           HB2      PRO1111  19.042   7.627  -3.688
   54   2HB   PRO1111           HB1      PRO1111  18.788   8.380  -2.110
   55   1HG   PRO1111           HG2      PRO1111  20.536   9.402  -3.846
   56   2HG   PRO1111           HG1      PRO1111  20.879   9.384  -2.106
   57   1HD   PRO1111           HD2      PRO1111  21.963   7.638  -4.272
   58   2HD   PRO1111           HD1      PRO1111  22.767   8.269  -2.820
   59    HA   PRO1112           HA       PRO1112  18.637   2.738  -2.514
   60   1HB   PRO1112           HB2      PRO1112  16.797   2.279  -0.575
   61   2HB   PRO1112           HB1      PRO1112  18.535   2.084  -0.314
   62   1HG   PRO1112           HG2      PRO1112  16.757   4.388   0.404
   63   2HG   PRO1112           HG1      PRO1112  18.022   3.609   1.373
   64   1HD   PRO1112           HD2      PRO1112  18.437   5.929   0.050
   65   2HD   PRO1112           HD1      PRO1112  19.722   4.725   0.280
   66    HA   PRO1113           HA       PRO1113  15.217   4.578  -4.901
   67   1HB   PRO1113           HB2      PRO1113  14.884   2.232  -6.374
   68   2HB   PRO1113           HB1      PRO1113  15.904   3.596  -6.837
   69   1HG   PRO1113           HG2      PRO1113  16.654   1.024  -5.523
   70   2HG   PRO1113           HG1      PRO1113  17.538   1.966  -6.737
   71   1HD   PRO1113           HD2      PRO1113  18.258   1.993  -4.157
   72   2HD   PRO1113           HD1      PRO1113  18.364   3.457  -5.160
   73    HA   PRO1114           HA       PRO1114  12.396   2.409  -2.075
   74   1HB   PRO1114           HB2      PRO1114  10.561   4.353  -1.909
   75   2HB   PRO1114           HB1      PRO1114  12.115   4.475  -1.072
   76   1HG   PRO1114           HG2      PRO1114  11.288   5.653  -3.707
   77   2HG   PRO1114           HG1      PRO1114  12.099   6.450  -2.344
   78   1HD   PRO1114           HD2      PRO1114  13.452   5.543  -4.504
   79   2HD   PRO1114           HD1      PRO1114  14.154   5.529  -2.872
   80    H    ILE1115           HN       ILE1115   9.711   2.825  -2.246
   81    HA   ILE1115           HA       ILE1115   8.979   1.963  -4.966
   82    HB   ILE1115           HB       ILE1115   7.231   0.514  -3.765
   83   1HG1  ILE1115          2HG1      ILE1115   9.195   0.997  -1.510
   84   2HG1  ILE1115          1HG1      ILE1115   7.493   1.440  -1.530
   85   1HG2  ILE1115          3HG2      ILE1115   9.130  -0.381  -5.010
   86   2HG2  ILE1115          2HG2      ILE1115  10.150  -0.219  -3.580
   87   3HG2  ILE1115          1HG2      ILE1115   8.797  -1.350  -3.574
   88   1HD1  ILE1115          2HD1      ILE1115   8.547  -1.376  -1.587
   89   2HD1  ILE1115          1HD1      ILE1115   7.938  -0.536  -0.159
   90   3HD1  ILE1115          3HD1      ILE1115   6.854  -0.889  -1.507
   91    H    ASP1116           HN       ASP1116   6.371   1.829  -4.921
   92    HA   ASP1116           HA       ASP1116   5.468   4.473  -4.884
   93   1HB   ASP1116           HB2      ASP1116   4.050   1.819  -4.962
   94   2HB   ASP1116           HB1      ASP1116   3.149   3.329  -4.923
   95    H    ASN1117           HN       ASN1117   5.470   5.663  -3.071
   96    HA   ASN1117           HA       ASN1117   4.971   6.391  -0.971
   97   1HB   ASN1117           HB2      ASN1117   2.877   4.202  -1.086
   98   2HB   ASN1117           HB1      ASN1117   2.932   5.501   0.103
   99   1HD2  ASN1117          1HD2      ASN1117   3.815   7.480  -1.839
  100   2HD2  ASN1117          2HD2      ASN1117   2.431   7.861  -2.799
  101    H    GLY1118           HN       GLY1118   6.946   4.276  -1.427
  102   1HA   GLY1118           HA1      GLY1118   7.959   2.470  -0.310
  103   2HA   GLY1118           HA2      GLY1118   6.756   2.609   0.961
  104    H    ASP1119           HN       ASP1119   9.189   2.211   1.828
  105    HA   ASP1119           HA       ASP1119  10.994   4.268   2.165
  106   1HB   ASP1119           HB2      ASP1119  10.359   5.206   4.375
  107   2HB   ASP1119           HB1      ASP1119   9.201   5.620   3.116
  108    H    ILE1120           HN       ILE1120  12.581   3.829   3.786
  109    HA   ILE1120           HA       ILE1120  13.010   1.102   4.222
  110    HB   ILE1120           HB       ILE1120  14.294   3.194   5.920
  111   1HG1  ILE1120          2HG1      ILE1120  14.761   2.693   2.975
  112   2HG1  ILE1120          1HG1      ILE1120  14.285   4.208   3.728
  113   1HG2  ILE1120          1HG2      ILE1120  15.185   0.660   4.582
  114   2HG2  ILE1120          3HG2      ILE1120  16.255   1.727   5.491
  115   3HG2  ILE1120          2HG2      ILE1120  14.917   0.916   6.306
  116   1HD1  ILE1120          1HD1      ILE1120  16.454   4.333   4.843
  117   2HD1  ILE1120          3HD1      ILE1120  16.934   2.830   4.056
  118   3HD1  ILE1120          2HD1      ILE1120  16.610   4.268   3.087
  119    H    THR1121           HN       THR1121  10.756   2.927   5.656
  120    HA   THR1121           HA       THR1121   9.334   2.552   7.391
  121    HB   THR1121           HB       THR1121   9.252   0.539   8.546
  122    HG1  THR1121           HG1      THR1121  11.247  -0.804   8.681
  123   1HG2  THR1121          1HG2      THR1121   9.066   0.146   6.127
  124   2HG2  THR1121          3HG2      THR1121  10.803  -0.143   6.044
  125   3HG2  THR1121          2HG2      THR1121   9.770  -1.243   6.954
  126    H    SER1122           HN       SER1122  12.498   3.382   7.547
  127    HA   SER1122           HA       SER1122  12.217   4.284  10.341
  128   1HB   SER1122           HB2      SER1122  14.763   3.371   8.972
  129   2HB   SER1122           HB1      SER1122  14.664   4.047  10.598
  130    HG   SER1122           HG       SER1122  14.115   1.520   9.721
  131    H    PHE1123           HN       PHE1123  14.340   4.834   7.541
  132    HA   PHE1123           HA       PHE1123  13.486   7.430   6.971
  133   1HB   PHE1123           HB2      PHE1123  14.532   7.786   9.247
  134   2HB   PHE1123           HB1      PHE1123  16.075   7.359   8.520
  135    HD1  PHE1123           HD1      PHE1123  17.311   8.919   7.264
  136    HD2  PHE1123           HD2      PHE1123  13.319   9.815   8.435
  137    HE1  PHE1123           HE1      PHE1123  17.630  11.254   6.552
  138    HE2  PHE1123           HE2      PHE1123  13.630  12.149   7.726
  139    HZ   PHE1123           HZ       PHE1123  15.787  12.872   6.782
  140    HA   PRO1124           HA       PRO1124  16.000   6.168   3.503
  141   1HB   PRO1124           HB2      PRO1124  15.569   8.822   2.378
  142   2HB   PRO1124           HB1      PRO1124  14.940   7.267   1.827
  143   1HG   PRO1124           HG2      PRO1124  13.372   9.192   2.930
  144   2HG   PRO1124           HG1      PRO1124  13.017   7.461   3.060
  145   1HD   PRO1124           HD2      PRO1124  14.246   9.298   5.077
  146   2HD   PRO1124           HD1      PRO1124  13.067   7.993   5.312
  147    H    LEU1125           HN       LEU1125  18.160   6.301   3.093
  148    HA   LEU1125           HA       LEU1125  19.583   8.618   4.220
  149   1HB   LEU1125           HB2      LEU1125  21.112   6.180   3.491
  150   2HB   LEU1125           HB1      LEU1125  21.335   7.293   4.825
  151    HG   LEU1125           HG       LEU1125  19.456   4.957   4.645
  152   1HD1  LEU1125          1HD1      LEU1125  21.585   5.751   6.623
  153   2HD1  LEU1125          3HD1      LEU1125  20.580   4.306   6.719
  154   3HD1  LEU1125          2HD1      LEU1125  21.720   4.500   5.388
  155   1HD2  LEU1125          3HD2      LEU1125  19.180   7.408   6.268
  156   2HD2  LEU1125          2HD2      LEU1125  17.954   6.271   5.692
  157   3HD2  LEU1125          1HD2      LEU1125  18.942   5.868   7.099
  158    H    SER1126           HN       SER1126  21.379   9.474   3.063
  159    HA   SER1126           HA       SER1126  20.952   9.385   0.185
  160   1HB   SER1126           HB2      SER1126  21.109  11.589   1.224
  161   2HB   SER1126           HB1      SER1126  22.699  11.192   1.875
  162    HG   SER1126           HG       SER1126  22.051  11.278  -0.887
  163    H    VAL1127           HN       VAL1127  23.574   8.923   2.523
  164    HA   VAL1127           HA       VAL1127  25.137   7.598   0.409
  165    HB   VAL1127           HB       VAL1127  26.133   8.708   3.039
  166   1HG1  VAL1127          2HG1      VAL1127  27.431   6.795   2.264
  167   2HG1  VAL1127          1HG1      VAL1127  27.628   7.553   0.684
  168   3HG1  VAL1127          3HG1      VAL1127  28.363   8.285   2.111
  169   1HG2  VAL1127          1HG2      VAL1127  25.458  10.489   1.521
  170   2HG2  VAL1127          3HG2      VAL1127  27.215  10.433   1.672
  171   3HG2  VAL1127          2HG2      VAL1127  26.432   9.777   0.234
  172    H    TYR1128           HN       TYR1128  25.191   5.469   0.480
  173    HA   TYR1128           HA       TYR1128  24.706   4.130   3.056
  174   1HB   TYR1128           HB2      TYR1128  23.589   3.718   0.393
  175   2HB   TYR1128           HB1      TYR1128  24.229   2.237   1.098
  176    HD1  TYR1128           HD1      TYR1128  23.457   1.679   3.509
  177    HD2  TYR1128           HD2      TYR1128  21.456   4.434   0.960
  178    HE1  TYR1128           HE1      TYR1128  21.410   1.421   4.846
  179    HE2  TYR1128           HE2      TYR1128  19.405   4.186   2.288
  180    HH   TYR1128           HH       TYR1128  19.357   2.679   5.329
  181    H    ALA1129           HN       ALA1129  25.765   2.120   3.423
  182    HA   ALA1129           HA       ALA1129  28.497   2.125   2.443
  183   1HB   ALA1129           HB2      ALA1129  28.064   1.792   4.830
  184   2HB   ALA1129           HB1      ALA1129  27.159   0.324   4.463
  185   3HB   ALA1129           HB3      ALA1129  28.888   0.400   4.128
  186    HA   PRO1130           HA       PRO1130  28.016  -0.957  -0.672
  187   1HB   PRO1130           HB2      PRO1130  30.542  -2.188   0.227
  188   2HB   PRO1130           HB1      PRO1130  30.135  -1.466  -1.332
  189   1HG   PRO1130           HG2      PRO1130  31.788  -0.244   0.394
  190   2HG   PRO1130           HG1      PRO1130  30.671   0.667  -0.637
  191   1HD   PRO1130           HD2      PRO1130  30.446  -0.011   2.268
  192   2HD   PRO1130           HD1      PRO1130  30.011   1.490   1.422
  193    H    ALA1131           HN       ALA1131  27.136  -2.939  -0.883
  194    HA   ALA1131           HA       ALA1131  26.276  -4.976  -0.365
  195   1HB   ALA1131           HB3      ALA1131  28.618  -5.599  -0.020
  196   2HB   ALA1131           HB1      ALA1131  27.544  -6.460   1.082
  197   3HB   ALA1131           HB2      ALA1131  28.499  -5.097   1.666
  198    H    SER1132           HN       SER1132  25.549  -2.455   1.182
  199    HA   SER1132           HA       SER1132  24.693  -3.509   3.745
  200   1HB   SER1132           HB2      SER1132  24.290  -0.825   2.416
  201   2HB   SER1132           HB1      SER1132  23.632  -1.236   4.000
  202    HG   SER1132           HG       SER1132  26.185  -1.898   4.026
  203    H    SER1133           HN       SER1133  22.489  -3.581   4.435
  204    HA   SER1133           HA       SER1133  20.491  -3.694   2.286
  205   1HB   SER1133           HB2      SER1133  20.491  -5.810   4.414
  206   2HB   SER1133           HB1      SER1133  19.770  -5.844   2.807
  207    HG   SER1133           HG       SER1133  21.602  -7.122   2.791
  208    H    VAL1134           HN       VAL1134  18.289  -3.494   3.023
  209    HA   VAL1134           HA       VAL1134  17.962  -2.647   5.810
  210    HB   VAL1134           HB       VAL1134  16.762  -0.658   5.275
  211   1HG1  VAL1134          2HG1      VAL1134  19.212  -0.498   5.338
  212   2HG1  VAL1134          1HG1      VAL1134  19.245  -0.692   3.584
  213   3HG1  VAL1134          3HG1      VAL1134  18.467   0.720   4.301
  214   1HG2  VAL1134          1HG2      VAL1134  15.650  -1.446   3.248
  215   2HG2  VAL1134          3HG2      VAL1134  16.402   0.130   3.005
  216   3HG2  VAL1134          2HG2      VAL1134  17.172  -1.322   2.365
  217    H    GLU1135           HN       GLU1135  15.557  -2.057   6.140
  218    HA   GLU1135           HA       GLU1135  13.923  -4.186   4.916
  219   1HB   GLU1135           HB2      GLU1135  14.402  -4.577   7.308
  220   2HB   GLU1135           HB1      GLU1135  13.691  -3.018   7.698
  221   1HG   GLU1135           HG2      GLU1135  11.533  -3.792   6.848
  222   2HG   GLU1135           HG1      GLU1135  12.249  -5.359   6.475
  223    H    TYR1136           HN       TYR1136  13.094  -2.903   3.284
  224    HA   TYR1136           HA       TYR1136  11.930  -0.336   3.809
  225   1HB   TYR1136           HB2      TYR1136  12.525  -1.985   1.482
  226   2HB   TYR1136           HB1      TYR1136  10.978  -1.159   1.343
  227    HD1  TYR1136           HD1      TYR1136  14.610  -0.680   1.711
  228    HD2  TYR1136           HD2      TYR1136  10.859   1.206   1.040
  229    HE1  TYR1136           HE1      TYR1136  15.773   1.372   1.018
  230    HE2  TYR1136           HE2      TYR1136  12.008   3.263   0.346
  231    HH   TYR1136           HH       TYR1136  15.354   3.369  -0.304
  232    H    GLN1137           HN       GLN1137   9.692   0.082   2.888
  233    HA   GLN1137           HA       GLN1137   7.624  -1.710   2.731
  234   1HB   GLN1137           HB2      GLN1137   8.196  -2.324   5.073
  235   2HB   GLN1137           HB1      GLN1137   7.868  -0.666   5.559
  236   1HG   GLN1137           HG2      GLN1137   5.547  -0.912   4.852
  237   2HG   GLN1137           HG1      GLN1137   5.874  -2.574   4.360
  238   1HE2  GLN1137          1HE2      GLN1137   5.463  -0.401   7.037
  239   2HE2  GLN1137          2HE2      GLN1137   5.297  -1.612   8.258
  240    H    CYS1138           HN       CYS1138   5.584  -0.674   2.544
  241    HA   CYS1138           HA       CYS1138   5.825   2.132   1.938
  242   1HB   CYS1138           HB2      CYS1138   3.548   0.172   1.672
  243   2HB   CYS1138           HB1      CYS1138   3.405   1.875   1.245
  244    H    GLN1139           HN       GLN1139   4.400   3.761   2.733
  245    HA   GLN1139           HA       GLN1139   4.337   4.069   5.456
  246   1HB   GLN1139           HB2      GLN1139   2.354   5.297   3.539
  247   2HB   GLN1139           HB1      GLN1139   2.832   5.931   5.108
  248   1HG   GLN1139           HG2      GLN1139   4.641   5.634   2.720
  249   2HG   GLN1139           HG1      GLN1139   3.881   7.133   3.254
  250   1HE2  GLN1139          1HE2      GLN1139   6.697   6.510   2.959
  251   2HE2  GLN1139          2HE2      GLN1139   7.415   6.755   4.512
  252    H    ASN1140           HN       ASN1140   2.180   4.615   6.667
  253    HA   ASN1140           HA       ASN1140   0.964   2.260   7.405
  254   1HB   ASN1140           HB2      ASN1140  -0.637   3.586   8.609
  255   2HB   ASN1140           HB1      ASN1140   0.916   4.408   8.689
  256   1HD2  ASN1140          1HD2      ASN1140   0.629   5.286   5.877
  257   2HD2  ASN1140          2HD2      ASN1140  -0.479   6.609   5.924
  258    H    LEU1141           HN       LEU1141  -1.413   1.795   7.299
  259    HA   LEU1141           HA       LEU1141  -3.098   0.938   6.084
  260   1HB   LEU1141           HB2      LEU1141  -4.383   2.518   4.716
  261   2HB   LEU1141           HB1      LEU1141  -3.982   3.132   6.304
  262    HG   LEU1141           HG       LEU1141  -2.099   4.425   5.198
  263   1HD1  LEU1141          1HD1      LEU1141  -2.149   3.021   3.117
  264   2HD1  LEU1141          3HD1      LEU1141  -3.646   3.847   2.685
  265   3HD1  LEU1141          2HD1      LEU1141  -2.149   4.765   2.850
  266   1HD2  LEU1141          1HD2      LEU1141  -4.947   5.037   4.413
  267   2HD2  LEU1141          3HD2      LEU1141  -4.164   5.480   5.930
  268   3HD2  LEU1141          2HD2      LEU1141  -3.610   6.188   4.413
  269    H    TYR1142           HN       TYR1142  -0.209   1.260   4.631
  270    HA   TYR1142           HA       TYR1142  -1.188   0.382   2.004
  271   1HB   TYR1142           HB2      TYR1142   1.512   1.341   2.948
  272   2HB   TYR1142           HB1      TYR1142   1.286   0.564   1.385
  273    HD1  TYR1142           HD1      TYR1142   1.363   3.643   3.070
  274    HD2  TYR1142           HD2      TYR1142  -0.609   1.624  -0.112
  275    HE1  TYR1142           HE1      TYR1142   0.740   5.810   2.091
  276    HE2  TYR1142           HE2      TYR1142  -1.238   3.787  -1.101
  277    HH   TYR1142           HH       TYR1142  -1.559   6.117  -0.383
  278    H    GLN1143           HN       GLN1143  -1.103  -1.712   1.420
  279    HA   GLN1143           HA       GLN1143   0.156  -3.574   3.297
  280   1HB   GLN1143           HB2      GLN1143  -2.290  -3.723   2.314
  281   2HB   GLN1143           HB1      GLN1143  -1.467  -4.490   0.964
  282   1HG   GLN1143           HG2      GLN1143  -1.475  -5.389   3.833
  283   2HG   GLN1143           HG1      GLN1143  -2.254  -6.180   2.464
  284   1HE2  GLN1143          1HE2      GLN1143  -1.002  -7.311   0.981
  285   2HE2  GLN1143          2HE2      GLN1143   0.619  -7.792   1.330
  286    H    LEU1144           HN       LEU1144   2.282  -3.687   2.816
  287    HA   LEU1144           HA       LEU1144   3.389  -3.536   0.246
  288   1HB   LEU1144           HB2      LEU1144   4.702  -3.138   2.256
  289   2HB   LEU1144           HB1      LEU1144   4.511  -4.812   2.739
  290    HG   LEU1144           HG       LEU1144   5.726  -4.413   0.077
  291   1HD1  LEU1144          3HD1      LEU1144   7.199  -3.644   2.591
  292   2HD1  LEU1144          2HD1      LEU1144   7.917  -3.846   0.994
  293   3HD1  LEU1144          1HD1      LEU1144   6.745  -2.558   1.278
  294   1HD2  LEU1144          2HD2      LEU1144   6.447  -6.085   2.481
  295   2HD2  LEU1144          1HD2      LEU1144   5.491  -6.614   1.096
  296   3HD2  LEU1144          3HD2      LEU1144   7.192  -6.194   0.885
  297    H    GLU1145           HN       GLU1145   4.536  -5.193  -0.909
  298    HA   GLU1145           HA       GLU1145   3.684  -7.943  -0.536
  299   1HB   GLU1145           HB2      GLU1145   1.893  -7.007  -1.912
  300   2HB   GLU1145           HB1      GLU1145   3.073  -6.373  -3.050
  301   1HG   GLU1145           HG2      GLU1145   3.752  -8.644  -3.620
  302   2HG   GLU1145           HG1      GLU1145   2.574  -9.284  -2.473
  303    H    GLY1146           HN       GLY1146   5.422  -9.175  -0.813
  304   1HA   GLY1146           HA1      GLY1146   7.458  -8.324  -2.773
  305   2HA   GLY1146           HA2      GLY1146   7.159  -9.990  -2.301
  306    H    ASN1147           HN       ASN1147   9.709  -9.166  -2.234
  307    HA   ASN1147           HA       ASN1147  10.371  -9.453   0.542
  308   1HB   ASN1147           HB2      ASN1147  12.750  -9.328  -0.335
  309   2HB   ASN1147           HB1      ASN1147  11.760 -10.632  -0.983
  310   1HD2  ASN1147          1HD2      ASN1147  13.417  -7.686  -1.664
  311   2HD2  ASN1147          2HD2      ASN1147  13.232  -7.731  -3.382
  312    H    LYS1148           HN       LYS1148   9.671  -7.596   1.572
  313    HA   LYS1148           HA       LYS1148  10.144  -4.964   0.779
  314   1HB   LYS1148           HB2      LYS1148   9.916  -4.496   3.296
  315   2HB   LYS1148           HB1      LYS1148   8.557  -5.236   2.461
  316   1HG   LYS1148           HG2      LYS1148   8.728  -6.422   4.458
  317   2HG   LYS1148           HG1      LYS1148   9.506  -7.467   3.267
  318   1HD   LYS1148           HD2      LYS1148  11.698  -6.664   3.986
  319   2HD   LYS1148           HD1      LYS1148  10.927  -5.602   5.167
  320   1HE   LYS1148           HE2      LYS1148  11.752  -7.639   6.224
  321   2HE   LYS1148           HE1      LYS1148   9.994  -7.544   6.313
  322   1HZ   LYS1148           HZ1      LYS1148  11.537  -9.154   4.352
  323   2HZ   LYS1148           HZ3      LYS1148  10.731  -9.761   5.710
  324   3HZ   LYS1148           HZ2      LYS1148   9.851  -9.067   4.445
  325    H    ARG1149           HN       ARG1149  12.284  -7.284   2.187
  326    HA   ARG1149           HA       ARG1149  14.243  -5.250   2.921
  327   1HB   ARG1149           HB2      ARG1149  13.972  -7.129   4.446
  328   2HB   ARG1149           HB1      ARG1149  14.308  -8.266   3.147
  329   1HG   ARG1149           HG2      ARG1149  16.582  -7.415   2.971
  330   2HG   ARG1149           HG1      ARG1149  16.251  -6.249   4.254
  331   1HD   ARG1149           HD2      ARG1149  17.443  -8.188   5.124
  332   2HD   ARG1149           HD1      ARG1149  15.823  -8.077   5.814
  333    HE   ARG1149           HE       ARG1149  15.734  -9.737   3.556
  334   1HH1  ARG1149          1HH1      ARG1149  17.019  -9.697   6.795
  335   2HH1  ARG1149          2HH1      ARG1149  16.956 -11.419   6.978
  336   1HH2  ARG1149          1HH2      ARG1149  15.649 -12.004   3.789
  337   2HH2  ARG1149          2HH2      ARG1149  16.178 -12.729   5.269
  338    H    ILE1150           HN       ILE1150  15.911  -4.661   1.650
  339    HA   ILE1150           HA       ILE1150  16.611  -6.429  -0.591
  340    HB   ILE1150           HB       ILE1150  16.540  -4.796  -2.214
  341   1HG1  ILE1150          2HG1      ILE1150  17.846  -3.093  -1.015
  342   2HG1  ILE1150          1HG1      ILE1150  16.454  -2.387  -1.826
  343   1HG2  ILE1150          3HG2      ILE1150  14.290  -5.371  -1.530
  344   2HG2  ILE1150          2HG2      ILE1150  14.298  -4.071  -0.338
  345   3HG2  ILE1150          1HG2      ILE1150  14.358  -3.690  -2.058
  346   1HD1  ILE1150          1HD1      ILE1150  15.262  -2.318   0.309
  347   2HD1  ILE1150          3HD1      ILE1150  16.683  -2.990   1.111
  348   3HD1  ILE1150          2HD1      ILE1150  16.770  -1.401   0.349
  349    H    THR1151           HN       THR1151  18.643  -5.270  -1.750
  350    HA   THR1151           HA       THR1151  20.549  -4.260   0.189
  351    HB   THR1151           HB       THR1151  21.104  -6.843  -1.284
  352    HG1  THR1151           HG1      THR1151  20.903  -7.818   0.745
  353   1HG2  THR1151          2HG2      THR1151  23.093  -5.468  -0.907
  354   2HG2  THR1151          1HG2      THR1151  22.700  -5.362   0.809
  355   3HG2  THR1151          3HG2      THR1151  23.126  -6.918   0.096
  356    H    CYS1152           HN       CYS1152  22.126  -3.035  -0.752
  357    HA   CYS1152           HA       CYS1152  21.833  -2.440  -3.555
  358   1HB   CYS1152           HB2      CYS1152  23.603  -0.739  -3.108
  359   2HB   CYS1152           HB1      CYS1152  22.200  -0.591  -2.060
  360    H    ARG1153           HN       ARG1153  23.318  -2.725  -5.162
  361    HA   ARG1153           HA       ARG1153  25.723  -4.280  -4.533
  362   1HB   ARG1153           HB2      ARG1153  25.369  -5.685  -6.512
  363   2HB   ARG1153           HB1      ARG1153  24.069  -5.873  -5.346
  364   1HG   ARG1153           HG2      ARG1153  23.856  -4.058  -7.729
  365   2HG   ARG1153           HG1      ARG1153  23.402  -5.762  -7.775
  366   1HD   ARG1153           HD2      ARG1153  21.898  -5.256  -5.789
  367   2HD   ARG1153           HD1      ARG1153  22.181  -3.552  -6.141
  368    HE   ARG1153           HE       ARG1153  20.401  -5.275  -7.497
  369   1HH1  ARG1153          1HH1      ARG1153  22.693  -2.719  -8.108
  370   2HH1  ARG1153          2HH1      ARG1153  21.882  -2.160  -9.532
  371   1HH2  ARG1153          1HH2      ARG1153  19.332  -4.546  -9.371
  372   2HH2  ARG1153          2HH2      ARG1153  19.972  -3.198 -10.249
  373    H    ASN1154           HN       ASN1154  27.426  -3.187  -5.176
  374    HA   ASN1154           HA       ASN1154  28.817  -1.817  -6.335
  375   1HB   ASN1154           HB2      ASN1154  26.942  -2.430  -8.633
  376   2HB   ASN1154           HB1      ASN1154  28.531  -1.684  -8.786
  377   1HD2  ASN1154          1HD2      ASN1154  27.503  -4.177  -9.903
  378   2HD2  ASN1154          2HD2      ASN1154  28.570  -5.419  -9.355
  379    H    GLY1155           HN       GLY1155  27.446  -0.356  -4.764
  380   1HA   GLY1155           HA1      GLY1155  27.266   2.169  -5.828
  381   2HA   GLY1155           HA2      GLY1155  26.447   1.668  -4.360
  382    H    GLN1156           HN       GLN1156  24.734  -0.274  -5.678
  383    HA   GLN1156           HA       GLN1156  22.690   1.547  -6.611
  384   1HB   GLN1156           HB2      GLN1156  23.941  -0.523  -8.407
  385   2HB   GLN1156           HB1      GLN1156  22.312   0.079  -8.677
  386   1HG   GLN1156           HG2      GLN1156  23.185   2.348  -8.905
  387   2HG   GLN1156           HG1      GLN1156  24.819   1.743  -8.633
  388   1HE2  GLN1156          1HE2      GLN1156  25.832   0.535 -10.234
  389   2HE2  GLN1156          2HE2      GLN1156  25.264   0.510 -11.865
  390    H    TRP1157           HN       TRP1157  21.074   0.914  -5.284
  391    HA   TRP1157           HA       TRP1157  20.790  -1.701  -4.254
  392   1HB   TRP1157           HB2      TRP1157  18.824   0.586  -4.392
  393   2HB   TRP1157           HB1      TRP1157  18.531  -0.912  -3.518
  394    HD1  TRP1157           HD1      TRP1157  20.836   2.162  -3.434
  395    HE1  TRP1157           HE1      TRP1157  21.700   2.443  -1.025
  396    HE3  TRP1157           HE3      TRP1157  18.945  -2.115  -1.414
  397    HZ2  TRP1157           HZ2      TRP1157  21.602   1.004   1.417
  398    HZ3  TRP1157           HZ3      TRP1157  19.374  -2.604   0.954
  399    HH2  TRP1157           HH2      TRP1157  20.674  -1.083   2.337
  400    H    SER1158           HN       SER1158  18.297  -2.525  -4.414
  401    HA   SER1158           HA       SER1158  17.817  -3.043  -7.267
  402   1HB   SER1158           HB2      SER1158  17.282  -4.873  -4.933
  403   2HB   SER1158           HB1      SER1158  17.012  -5.266  -6.632
  404    HG   SER1158           HG       SER1158  19.006  -5.890  -6.674
  405    H    GLU1159           HN       GLU1159  16.709  -1.326  -4.899
  406    HA   GLU1159           HA       GLU1159  14.767  -0.420  -4.187
  407   1HB   GLU1159           HB2      GLU1159  14.642   0.435  -6.322
  408   2HB   GLU1159           HB1      GLU1159  14.333  -1.131  -7.040
  409   1HG   GLU1159           HG2      GLU1159  12.079  -1.128  -6.079
  410   2HG   GLU1159           HG1      GLU1159  12.395   0.450  -5.360
  411    HA   PRO1160           HA       PRO1160  12.272  -3.613  -2.429
  412   1HB   PRO1160           HB2      PRO1160  10.104  -1.668  -2.108
  413   2HB   PRO1160           HB1      PRO1160  11.040  -2.512  -0.876
  414   1HG   PRO1160           HG2      PRO1160  11.296   0.142  -1.395
  415   2HG   PRO1160           HG1      PRO1160  12.609  -0.855  -0.744
  416   1HD   PRO1160           HD2      PRO1160  12.204   0.205  -3.491
  417   2HD   PRO1160           HD1      PRO1160  13.706  -0.128  -2.607
  418    HA   PRO1161           HA       PRO1161   9.388  -5.064  -5.434
  419   1HB   PRO1161           HB2      PRO1161   7.433  -5.811  -3.375
  420   2HB   PRO1161           HB1      PRO1161   8.361  -6.842  -4.465
  421   1HG   PRO1161           HG2      PRO1161   8.882  -6.732  -1.829
  422   2HG   PRO1161           HG1      PRO1161  10.164  -6.959  -3.033
  423   1HD   PRO1161           HD2      PRO1161   9.364  -4.473  -1.566
  424   2HD   PRO1161           HD1      PRO1161  10.989  -5.089  -1.935
  425    H    LYS1162           HN       LYS1162   6.688  -4.574  -3.296
  426    HA   LYS1162           HA       LYS1162   5.955  -1.954  -4.006
  427   1HB   LYS1162           HB2      LYS1162   5.841  -3.201  -6.263
  428   2HB   LYS1162           HB1      LYS1162   4.403  -3.967  -5.605
  429   1HG   LYS1162           HG2      LYS1162   3.756  -2.100  -6.961
  430   2HG   LYS1162           HG1      LYS1162   3.400  -1.747  -5.269
  431   1HD   LYS1162           HD2      LYS1162   4.367   0.205  -6.312
  432   2HD   LYS1162           HD1      LYS1162   5.500  -0.452  -5.130
  433   1HE   LYS1162           HE2      LYS1162   6.651   0.195  -7.179
  434   2HE   LYS1162           HE1      LYS1162   6.745  -1.548  -6.922
  435   1HZ   LYS1162           HZ1      LYS1162   4.859  -0.170  -8.758
  436   2HZ   LYS1162           HZ3      LYS1162   6.247  -1.021  -9.222
  437   3HZ   LYS1162           HZ2      LYS1162   4.950  -1.842  -8.513
  438    H    CYS1163           HN       CYS1163   3.729  -1.439  -3.412
  439    HA   CYS1163           HA       CYS1163   2.595  -3.428  -1.554
  440   1HB   CYS1163           HB2      CYS1163   1.650  -1.321  -0.388
  441   2HB   CYS1163           HB1      CYS1163   3.346  -1.729  -0.139
  442    H    LEU1164           HN       LEU1164   0.217  -2.623  -0.983
  443    HA   LEU1164           HA       LEU1164  -1.137  -2.044  -3.528
  444   1HB   LEU1164           HB2      LEU1164  -2.191  -3.915  -1.414
  445   2HB   LEU1164           HB1      LEU1164  -2.851  -3.635  -3.013
  446    HG   LEU1164           HG       LEU1164  -0.256  -5.035  -2.358
  447   1HD1  LEU1164          2HD1      LEU1164  -2.832  -6.036  -3.559
  448   2HD1  LEU1164          1HD1      LEU1164  -1.359  -6.982  -3.338
  449   3HD1  LEU1164          3HD1      LEU1164  -2.237  -6.377  -1.933
  450   1HD2  LEU1164          2HD2      LEU1164  -1.486  -4.431  -5.045
  451   2HD2  LEU1164          1HD2      LEU1164  -0.006  -3.726  -4.397
  452   3HD2  LEU1164          3HD2      LEU1164  -0.074  -5.449  -4.765
  453    H    HIS1165           HN       HIS1165  -2.288  -0.268  -3.439
  454    HA   HIS1165           HA       HIS1165  -2.707   1.279  -1.162
  455   1HB   HIS1165           HB2      HIS1165  -4.345   1.309  -3.708
  456   2HB   HIS1165           HB1      HIS1165  -4.210   2.618  -2.538
  457    HD1  HIS1165           HD1      HIS1165  -2.381   0.966  -5.337
  458    HD2  HIS1165           HD2      HIS1165  -1.836   4.109  -2.675
  459    HE1  HIS1165           HE1      HIS1165  -0.411   2.258  -6.216
  460    HE2  HIS1165           HE2      HIS1165  -0.040   4.098  -4.536
  461    HA   PRO1166           HA       PRO1166  -6.106  -0.482   1.023
  462   1HB   PRO1166           HB2      PRO1166  -7.220   2.262   1.220
  463   2HB   PRO1166           HB1      PRO1166  -6.802   1.122   2.502
  464   1HG   PRO1166           HG2      PRO1166  -5.275   3.252   2.004
  465   2HG   PRO1166           HG1      PRO1166  -4.560   1.694   2.462
  466   1HD   PRO1166           HD2      PRO1166  -4.733   2.986  -0.227
  467   2HD   PRO1166           HD1      PRO1166  -3.416   2.034   0.487
  468    H    CYS1167           HN       CYS1167  -8.609  -0.149   1.203
  469    HA   CYS1167           HA       CYS1167  -9.660  -0.612  -1.433
  470   1HB   CYS1167           HB2      CYS1167 -11.821  -0.542   0.282
  471   2HB   CYS1167           HB1      CYS1167 -10.900  -1.979  -0.152
  472    H    VAL1168           HN       VAL1168  -8.762   1.998  -1.281
  473    HA   VAL1168           HA       VAL1168 -10.555   3.955  -0.529
  474    HB   VAL1168           HB       VAL1168  -8.391   4.621  -1.259
  475   1HG1  VAL1168          2HG1      VAL1168  -7.938   2.814  -2.820
  476   2HG1  VAL1168          1HG1      VAL1168  -9.093   3.493  -3.967
  477   3HG1  VAL1168          3HG1      VAL1168  -7.619   4.377  -3.573
  478   1HG2  VAL1168          3HG2      VAL1168 -10.178   6.241  -1.663
  479   2HG2  VAL1168          2HG2      VAL1168  -8.889   6.391  -2.857
  480   3HG2  VAL1168          1HG2      VAL1168 -10.401   5.592  -3.287
  481    H    ILE1169           HN       ILE1169 -12.681   3.242  -0.902
  482    HA   ILE1169           HA       ILE1169 -13.532   2.800  -3.645
  483    HB   ILE1169           HB       ILE1169 -14.961   2.635  -1.005
  484   1HG1  ILE1169          2HG1      ILE1169 -14.097   0.721  -3.149
  485   2HG1  ILE1169          1HG1      ILE1169 -13.795   0.653  -1.414
  486   1HG2  ILE1169          3HG2      ILE1169 -16.510   3.691  -2.562
  487   2HG2  ILE1169          2HG2      ILE1169 -16.219   2.409  -3.738
  488   3HG2  ILE1169          1HG2      ILE1169 -17.010   2.038  -2.206
  489   1HD1  ILE1169          3HD1      ILE1169 -16.200   0.155  -1.077
  490   2HD1  ILE1169          2HD1      ILE1169 -16.388   0.080  -2.826
  491   3HD1  ILE1169          1HD1      ILE1169 -15.338  -1.071  -2.003
  492    H    SER1170           HN       SER1170 -15.057   4.045  -4.730
  493    HA   SER1170           HA       SER1170 -14.735   6.807  -4.564
  494   1HB   SER1170           HB2      SER1170 -15.562   5.593  -6.573
  495   2HB   SER1170           HB1      SER1170 -17.106   5.350  -5.757
  496    HG   SER1170           HG       SER1170 -15.953   7.897  -6.231
  497    H    ARG1171           HN       ARG1171 -15.094   7.694  -2.577
  498    HA   ARG1171           HA       ARG1171 -17.223   7.167  -0.843
  499   1HB   ARG1171           HB2      ARG1171 -16.681   9.380   0.157
  500   2HB   ARG1171           HB1      ARG1171 -15.271   8.357  -0.076
  501   1HG   ARG1171           HG2      ARG1171 -14.716   9.604  -2.114
  502   2HG   ARG1171           HG1      ARG1171 -16.113  10.648  -1.840
  503   1HD   ARG1171           HD2      ARG1171 -15.159  11.371   0.289
  504   2HD   ARG1171           HD1      ARG1171 -13.769  10.319   0.029
  505    HE   ARG1171           HE       ARG1171 -14.032  12.063  -2.159
  506   1HH1  ARG1171          1HH1      ARG1171 -13.167  12.094   1.217
  507   2HH1  ARG1171          2HH1      ARG1171 -12.111  13.458   1.066
  508   1HH2  ARG1171          1HH2      ARG1171 -12.644  13.860  -2.366
  509   2HH2  ARG1171          2HH2      ARG1171 -11.815  14.462  -0.970
  510    H    GLU1172           HN       GLU1172 -16.909   9.561  -3.433
  511    HA   GLU1172           HA       GLU1172 -19.384  10.842  -2.970
  512   1HB   GLU1172           HB2      GLU1172 -17.772  10.629  -5.520
  513   2HB   GLU1172           HB1      GLU1172 -19.102  11.748  -5.250
  514   1HG   GLU1172           HG2      GLU1172 -17.838  12.812  -3.449
  515   2HG   GLU1172           HG1      GLU1172 -16.503  11.696  -3.733
  516    H    ILE1173           HN       ILE1173 -18.903   7.718  -3.739
  517    HA   ILE1173           HA       ILE1173 -21.319   7.575  -5.404
  518    HB   ILE1173           HB       ILE1173 -18.902   5.804  -5.301
  519   1HG1  ILE1173          2HG1      ILE1173 -19.162   7.807  -6.843
  520   2HG1  ILE1173          1HG1      ILE1173 -18.752   6.278  -7.616
  521   1HG2  ILE1173          1HG2      ILE1173 -21.582   5.083  -6.482
  522   2HG2  ILE1173          3HG2      ILE1173 -20.083   4.181  -6.712
  523   3HG2  ILE1173          2HG2      ILE1173 -20.802   4.302  -5.106
  524   1HD1  ILE1173          3HD1      ILE1173 -21.487   7.532  -7.493
  525   2HD1  ILE1173          2HD1      ILE1173 -20.415   7.498  -8.893
  526   3HD1  ILE1173          1HD1      ILE1173 -21.092   5.995  -8.265
  527    H    MET1174           HN       MET1174 -19.640   5.280  -3.201
  528    HA   MET1174           HA       MET1174 -21.909   3.887  -2.488
  529   1HB   MET1174           HB2      MET1174 -20.601   2.764  -0.985
  530   2HB   MET1174           HB1      MET1174 -19.347   3.498  -1.971
  531   1HG   MET1174           HG2      MET1174 -18.570   3.921   0.133
  532   2HG   MET1174           HG1      MET1174 -19.460   5.406  -0.205
  533   1HE   MET1174           HE3      MET1174 -19.677   6.131   2.243
  534   2HE   MET1174           HE2      MET1174 -20.273   5.114   3.555
  535   3HE   MET1174           HE1      MET1174 -18.726   4.751   2.791
  536    H    GLU1175           HN       GLU1175 -20.395   6.555  -0.651
  537    HA   GLU1175           HA       GLU1175 -22.521   6.665   1.239
  538   1HB   GLU1175           HB2      GLU1175 -21.237   8.195   2.328
  539   2HB   GLU1175           HB1      GLU1175 -19.985   7.574   1.258
  540   1HG   GLU1175           HG2      GLU1175 -20.492   9.429  -0.315
  541   2HG   GLU1175           HG1      GLU1175 -21.611  10.080   0.881
  542    H    ASN1176           HN       ASN1176 -22.830   7.164  -1.864
  543    HA   ASN1176           HA       ASN1176 -24.552   9.522  -1.576
  544   1HB   ASN1176           HB2      ASN1176 -22.574   8.773  -3.629
  545   2HB   ASN1176           HB1      ASN1176 -24.081   9.448  -4.229
  546   1HD2  ASN1176          1HD2      ASN1176 -23.096  11.323  -4.950
  547   2HD2  ASN1176          2HD2      ASN1176 -22.522  12.542  -3.870
  548    H    TYR1177           HN       TYR1177 -24.209   6.458  -3.445
  549    HA   TYR1177           HA       TYR1177 -27.041   6.702  -4.083
  550   1HB   TYR1177           HB2      TYR1177 -26.770   5.101  -5.818
  551   2HB   TYR1177           HB1      TYR1177 -25.473   6.275  -5.956
  552    HD1  TYR1177           HD1      TYR1177 -25.644   3.534  -7.226
  553    HD2  TYR1177           HD2      TYR1177 -23.844   4.876  -3.616
  554    HE1  TYR1177           HE1      TYR1177 -24.022   1.694  -7.362
  555    HE2  TYR1177           HE2      TYR1177 -22.217   3.040  -3.744
  556    HH   TYR1177           HH       TYR1177 -21.775   1.159  -6.530
  557    H    ASN1178           HN       ASN1178 -26.779   6.200  -1.522
  558    HA   ASN1178           HA       ASN1178 -27.942   4.981  -0.019
  559   1HB   ASN1178           HB2      ASN1178 -28.237   2.818  -2.088
  560   2HB   ASN1178           HB1      ASN1178 -29.180   3.017  -0.614
  561   1HD2  ASN1178          1HD2      ASN1178 -29.435   5.860  -0.830
  562   2HD2  ASN1178          2HD2      ASN1178 -30.541   6.173  -2.117
  563    H    ILE1179           HN       ILE1179 -25.049   4.804  -0.093
  564    HA   ILE1179           HA       ILE1179 -24.879   2.195   1.257
  565    HB   ILE1179           HB       ILE1179 -22.536   3.305  -0.239
  566   1HG1  ILE1179          2HG1      ILE1179 -24.789   1.595  -1.223
  567   2HG1  ILE1179          1HG1      ILE1179 -23.976   2.930  -2.031
  568   1HG2  ILE1179          1HG2      ILE1179 -22.100   1.695   1.550
  569   2HG2  ILE1179          3HG2      ILE1179 -23.176   0.539   0.764
  570   3HG2  ILE1179          2HG2      ILE1179 -21.684   1.040  -0.034
  571   1HD1  ILE1179          3HD1      ILE1179 -21.982   1.519  -2.304
  572   2HD1  ILE1179          2HD1      ILE1179 -22.863   0.175  -1.576
  573   3HD1  ILE1179          1HD1      ILE1179 -23.408   0.860  -3.107
  574    H    ALA1180           HN       ALA1180 -23.358   2.013   2.896
  575    HA   ALA1180           HA       ALA1180 -22.031   4.401   3.889
  576   1HB   ALA1180           HB1      ALA1180 -24.227   4.498   4.952
  577   2HB   ALA1180           HB3      ALA1180 -24.027   2.848   5.542
  578   3HB   ALA1180           HB2      ALA1180 -22.978   4.132   6.142
  579    H    LEU1181           HN       LEU1181 -21.190   3.413   6.332
  580    HA   LEU1181           HA       LEU1181 -19.479   1.213   5.445
  581   1HB   LEU1181           HB2      LEU1181 -19.095   3.522   7.083
  582   2HB   LEU1181           HB1      LEU1181 -18.737   2.093   8.031
  583    HG   LEU1181           HG       LEU1181 -16.730   2.997   6.948
  584   1HD1  LEU1181          1HD1      LEU1181 -17.607   0.340   5.827
  585   2HD1  LEU1181          3HD1      LEU1181 -15.945   0.924   5.915
  586   3HD1  LEU1181          2HD1      LEU1181 -16.849   0.608   7.397
  587   1HD2  LEU1181          2HD2      LEU1181 -18.245   2.457   4.401
  588   2HD2  LEU1181          1HD2      LEU1181 -17.656   4.014   4.989
  589   3HD2  LEU1181          3HD2      LEU1181 -16.511   2.772   4.478
  590    H    ARG1182           HN       ARG1182 -18.807  -0.302   7.342
  591    HA   ARG1182           HA       ARG1182 -21.031  -1.856   8.008
  592   1HB   ARG1182           HB2      ARG1182 -19.227  -2.724   9.818
  593   2HB   ARG1182           HB1      ARG1182 -19.212  -3.192   8.125
  594   1HG   ARG1182           HG2      ARG1182 -17.564  -1.474   7.641
  595   2HG   ARG1182           HG1      ARG1182 -17.599  -0.953   9.326
  596   1HD   ARG1182           HD2      ARG1182 -16.799  -3.157  10.023
  597   2HD   ARG1182           HD1      ARG1182 -16.765  -3.677   8.339
  598    HE   ARG1182           HE       ARG1182 -15.203  -1.371   8.578
  599   1HH1  ARG1182          1HH1      ARG1182 -15.192  -4.697   9.617
  600   2HH1  ARG1182          2HH1      ARG1182 -13.464  -4.803   9.688
  601   1HH2  ARG1182          1HH2      ARG1182 -12.929  -1.502   8.668
  602   2HH2  ARG1182          2HH2      ARG1182 -12.179  -2.987   9.149
  603    H    TRP1183           HN       TRP1183 -20.003   1.017   9.388
  604    HA   TRP1183           HA       TRP1183 -21.674   0.524  11.760
  605   1HB   TRP1183           HB2      TRP1183 -19.160   2.209  11.747
  606   2HB   TRP1183           HB1      TRP1183 -20.167   1.817  13.140
  607    HD1  TRP1183           HD1      TRP1183 -17.905  -0.001  10.576
  608    HE1  TRP1183           HE1      TRP1183 -16.877  -2.056  11.730
  609    HE3  TRP1183           HE3      TRP1183 -20.260   0.342  15.103
  610    HZ2  TRP1183           HZ2      TRP1183 -17.021  -3.345  14.222
  611    HZ3  TRP1183           HZ3      TRP1183 -19.753  -1.346  16.822
  612    HH2  TRP1183           HH2      TRP1183 -18.167  -3.152  16.390
  613    H    THR1184           HN       THR1184 -21.778   1.907   8.994
  614    HA   THR1184           HA       THR1184 -22.630   3.786   8.038
  615    HB   THR1184           HB       THR1184 -24.650   4.671   9.045
  616    HG1  THR1184           HG1      THR1184 -24.986   3.370  11.260
  617   1HG2  THR1184          2HG2      THR1184 -24.799   2.471   7.992
  618   2HG2  THR1184          1HG2      THR1184 -24.397   1.701   9.527
  619   3HG2  THR1184          3HG2      THR1184 -25.910   2.591   9.357
  620    H    ALA1185           HN       ALA1185 -20.432   4.727   8.429
  621    HA   ALA1185           HA       ALA1185 -20.544   6.980  10.320
  622   1HB   ALA1185           HB3      ALA1185 -18.116   5.675   9.098
  623   2HB   ALA1185           HB1      ALA1185 -18.721   5.395  10.731
  624   3HB   ALA1185           HB2      ALA1185 -18.113   6.987  10.276
  625    H    LYS1186           HN       LYS1186 -20.781   6.219   7.070
  626    HA   LYS1186           HA       LYS1186 -20.966   7.495   5.205
  627   1HB   LYS1186           HB2      LYS1186 -22.095   9.145   6.657
  628   2HB   LYS1186           HB1      LYS1186 -20.534   9.843   7.066
  629   1HG   LYS1186           HG2      LYS1186 -20.200  10.461   4.723
  630   2HG   LYS1186           HG1      LYS1186 -21.774   9.770   4.322
  631   1HD   LYS1186           HD2      LYS1186 -21.333  12.027   6.276
  632   2HD   LYS1186           HD1      LYS1186 -21.823  12.235   4.594
  633   1HE   LYS1186           HE2      LYS1186 -23.847  10.931   5.021
  634   2HE   LYS1186           HE1      LYS1186 -23.356  10.717   6.702
  635   1HZ   LYS1186           HZ1      LYS1186 -23.480  13.114   7.003
  636   2HZ   LYS1186           HZ3      LYS1186 -23.961  13.314   5.392
  637   3HZ   LYS1186           HZ2      LYS1186 -24.966  12.497   6.480
  638    H    GLN1187           HN       GLN1187 -19.322   7.006   3.964
  639    HA   GLN1187           HA       GLN1187 -17.290   7.052   2.946
  640   1HB   GLN1187           HB2      GLN1187 -17.752   9.441   2.702
  641   2HB   GLN1187           HB1      GLN1187 -17.076   9.748   4.296
  642   1HG   GLN1187           HG2      GLN1187 -14.933   8.690   3.363
  643   2HG   GLN1187           HG1      GLN1187 -15.670   8.942   1.783
  644   1HE2  GLN1187          1HE2      GLN1187 -17.039  11.377   2.650
  645   2HE2  GLN1187          2HE2      GLN1187 -15.826  12.604   2.718
  646    H    LYS1188           HN       LYS1188 -16.388   5.335   4.069
  647    HA   LYS1188           HA       LYS1188 -14.077   5.976   5.632
  648   1HB   LYS1188           HB2      LYS1188 -15.932   6.087   7.319
  649   2HB   LYS1188           HB1      LYS1188 -16.257   4.390   7.002
  650   1HG   LYS1188           HG2      LYS1188 -14.947   4.597   9.004
  651   2HG   LYS1188           HG1      LYS1188 -13.965   3.847   7.744
  652   1HD   LYS1188           HD2      LYS1188 -12.907   6.010   7.287
  653   2HD   LYS1188           HD1      LYS1188 -13.883   6.752   8.558
  654   1HE   LYS1188           HE2      LYS1188 -12.851   5.271  10.211
  655   2HE   LYS1188           HE1      LYS1188 -11.874   4.535   8.941
  656   1HZ   LYS1188           HZ3      LYS1188 -10.832   6.681   8.551
  657   2HZ   LYS1188           HZ2      LYS1188 -11.768   7.386   9.770
  658   3HZ   LYS1188           HZ1      LYS1188 -10.626   6.202  10.161
  659    H    LEU1189           HN       LEU1189 -14.925   4.532   3.195
  660    HA   LEU1189           HA       LEU1189 -14.404   1.742   3.739
  661   1HB   LEU1189           HB2      LEU1189 -14.359   1.799   1.088
  662   2HB   LEU1189           HB1      LEU1189 -15.849   1.772   2.005
  663    HG   LEU1189           HG       LEU1189 -15.769   3.377   0.067
  664   1HD1  LEU1189          3HD1      LEU1189 -17.440   3.566   1.809
  665   2HD1  LEU1189          2HD1      LEU1189 -16.331   4.527   2.787
  666   3HD1  LEU1189          1HD1      LEU1189 -16.930   5.160   1.254
  667   1HD2  LEU1189          1HD2      LEU1189 -13.502   4.187   0.336
  668   2HD2  LEU1189          3HD2      LEU1189 -14.657   5.519   0.401
  669   3HD2  LEU1189          2HD2      LEU1189 -13.931   4.907   1.888
  670    H    TYR1190           HN       TYR1190 -12.271   3.002   4.678
  671    HA   TYR1190           HA       TYR1190 -10.201   2.563   2.628
  672   1HB   TYR1190           HB2      TYR1190 -10.415   4.660   4.767
  673   2HB   TYR1190           HB1      TYR1190  -8.843   4.182   4.140
  674    HD1  TYR1190           HD1      TYR1190 -11.836   4.297   1.972
  675    HD2  TYR1190           HD2      TYR1190  -8.335   6.358   3.273
  676    HE1  TYR1190           HE1      TYR1190 -12.081   5.895   0.119
  677    HE2  TYR1190           HE2      TYR1190  -8.580   7.952   1.420
  678    HH   TYR1190           HH       TYR1190 -11.401   8.194  -0.439
  679    H    SER1191           HN       SER1191  -9.348   0.627   3.056
  680    HA   SER1191           HA       SER1191  -8.258   0.163   5.738
  681   1HB   SER1191           HB2      SER1191 -10.089  -1.644   4.231
  682   2HB   SER1191           HB1      SER1191  -8.885  -2.330   5.310
  683    HG   SER1191           HG       SER1191 -10.115  -0.333   6.575
  684    H    ARG1192           HN       ARG1192  -6.332  -0.973   5.791
  685    HA   ARG1192           HA       ARG1192  -4.708  -0.868   3.509
  686   1HB   ARG1192           HB2      ARG1192  -3.740  -0.926   5.747
  687   2HB   ARG1192           HB1      ARG1192  -4.396  -2.534   6.017
  688   1HG   ARG1192           HG2      ARG1192  -2.969  -3.426   4.253
  689   2HG   ARG1192           HG1      ARG1192  -2.323  -1.811   3.955
  690   1HD   ARG1192           HD2      ARG1192  -0.822  -3.183   5.336
  691   2HD   ARG1192           HD1      ARG1192  -1.379  -1.735   6.178
  692    HE   ARG1192           HE       ARG1192  -3.114  -3.814   6.831
  693   1HH1  ARG1192          1HH1      ARG1192   0.233  -2.960   7.283
  694   2HH1  ARG1192          2HH1      ARG1192   0.382  -3.816   8.782
  695   1HH2  ARG1192          1HH2      ARG1192  -2.927  -4.943   8.803
  696   2HH2  ARG1192          2HH2      ARG1192  -1.413  -4.944   9.645
  697    H    THR1193           HN       THR1193  -4.579  -2.166   1.796
  698    HA   THR1193           HA       THR1193  -6.320  -4.017   1.004
  699    HB   THR1193           HB       THR1193  -3.373  -3.830   0.476
  700    HG1  THR1193           HG1      THR1193  -4.532  -3.623  -1.731
  701   1HG2  THR1193          2HG2      THR1193  -3.899  -6.242   0.401
  702   2HG2  THR1193          1HG2      THR1193  -5.173  -5.909  -0.772
  703   3HG2  THR1193          3HG2      THR1193  -3.487  -5.592  -1.186
  704    H    GLY1194           HN       GLY1194  -6.815  -6.135   1.290
  705   1HA   GLY1194           HA1      GLY1194  -5.131  -7.738   3.085
  706   2HA   GLY1194           HA2      GLY1194  -6.382  -8.363   2.017
  707    H    GLU1195           HN       GLU1195  -7.014  -5.533   3.888
  708    HA   GLU1195           HA       GLU1195  -8.232  -6.943   6.090
  709   1HB   GLU1195           HB2      GLU1195  -8.102  -4.014   5.350
  710   2HB   GLU1195           HB1      GLU1195  -8.952  -4.611   6.770
  711   1HG   GLU1195           HG2      GLU1195  -6.014  -4.949   6.209
  712   2HG   GLU1195           HG1      GLU1195  -6.728  -3.780   7.319
  713    H    SER1196           HN       SER1196 -10.455  -6.935   6.601
  714    HA   SER1196           HA       SER1196 -12.156  -6.965   4.241
  715   1HB   SER1196           HB2      SER1196 -13.804  -8.059   5.718
  716   2HB   SER1196           HB1      SER1196 -12.248  -8.888   5.745
  717    HG   SER1196           HG       SER1196 -13.036  -8.629   7.847
  718    H    VAL1197           HN       VAL1197 -13.720  -5.546   3.794
  719    HA   VAL1197           HA       VAL1197 -14.407  -3.541   5.839
  720    HB   VAL1197           HB       VAL1197 -14.130  -3.023   2.869
  721   1HG1  VAL1197          2HG1      VAL1197 -14.755  -1.154   5.159
  722   2HG1  VAL1197          1HG1      VAL1197 -14.488  -0.674   3.482
  723   3HG1  VAL1197          3HG1      VAL1197 -15.879  -1.673   3.903
  724   1HG2  VAL1197          3HG2      VAL1197 -12.394  -2.183   5.188
  725   2HG2  VAL1197          2HG2      VAL1197 -11.959  -3.313   3.906
  726   3HG2  VAL1197          1HG2      VAL1197 -12.223  -1.612   3.528
  727    H    GLU1198           HN       GLU1198 -16.417  -3.944   6.445
  728    HA   GLU1198           HA       GLU1198 -18.330  -5.101   4.597
  729   1HB   GLU1198           HB2      GLU1198 -18.501  -6.108   6.685
  730   2HB   GLU1198           HB1      GLU1198 -18.262  -4.594   7.548
  731   1HG   GLU1198           HG2      GLU1198 -20.468  -3.887   7.106
  732   2HG   GLU1198           HG1      GLU1198 -20.730  -5.189   5.944
  733    H    PHE1199           HN       PHE1199 -19.938  -4.041   3.607
  734    HA   PHE1199           HA       PHE1199 -20.274  -1.184   4.243
  735   1HB   PHE1199           HB2      PHE1199 -20.704  -2.650   1.632
  736   2HB   PHE1199           HB1      PHE1199 -21.106  -0.958   1.899
  737    HD1  PHE1199           HD1      PHE1199 -19.532   0.687   1.477
  738    HD2  PHE1199           HD2      PHE1199 -18.259  -3.335   2.032
  739    HE1  PHE1199           HE1      PHE1199 -17.241   1.331   0.826
  740    HE2  PHE1199           HE2      PHE1199 -15.975  -2.706   1.390
  741    HZ   PHE1199           HZ       PHE1199 -15.461  -0.374   0.790
  742    H    VAL1200           HN       VAL1200 -22.410  -0.286   3.869
  743    HA   VAL1200           HA       VAL1200 -24.642  -2.172   4.003
  744    HB   VAL1200           HB       VAL1200 -25.675  -1.017   5.876
  745   1HG1  VAL1200          3HG1      VAL1200 -24.248  -2.917   6.396
  746   2HG1  VAL1200          2HG1      VAL1200 -22.848  -1.849   6.514
  747   3HG1  VAL1200          1HG1      VAL1200 -24.166  -1.708   7.678
  748   1HG2  VAL1200          2HG2      VAL1200 -23.169   0.652   5.961
  749   2HG2  VAL1200          1HG2      VAL1200 -24.782   1.207   5.513
  750   3HG2  VAL1200          3HG2      VAL1200 -24.457   0.678   7.164
  751    H    CYS1201           HN       CYS1201 -26.634  -0.286   4.479
  752    HA   CYS1201           HA       CYS1201 -26.276   1.614   2.259
  753   1HB   CYS1201           HB2      CYS1201 -29.035   0.761   2.644
  754   2HB   CYS1201           HB1      CYS1201 -28.082   0.851   1.171
  755    H    LYS1202           HN       LYS1202 -27.021   3.665   2.586
  756    HA   LYS1202           HA       LYS1202 -27.199   4.725   5.085
  757   1HB   LYS1202           HB2      LYS1202 -28.586   6.584   4.025
  758   2HB   LYS1202           HB1      LYS1202 -26.993   6.274   3.346
  759   1HG   LYS1202           HG2      LYS1202 -27.829   5.443   1.393
  760   2HG   LYS1202           HG1      LYS1202 -29.332   4.898   2.139
  761   1HD   LYS1202           HD2      LYS1202 -29.578   6.840   0.583
  762   2HD   LYS1202           HD1      LYS1202 -30.196   7.115   2.212
  763   1HE   LYS1202           HE2      LYS1202 -28.954   9.055   1.399
  764   2HE   LYS1202           HE1      LYS1202 -28.142   8.321   2.782
  765   1HZ   LYS1202           HZ1      LYS1202 -26.620   7.223   1.260
  766   2HZ   LYS1202           HZ3      LYS1202 -27.400   7.928  -0.067
  767   3HZ   LYS1202           HZ2      LYS1202 -26.572   8.900   1.043
  768    H    ARG1203           HN       ARG1203 -28.366   3.910   6.611
  769    HA   ARG1203           HA       ARG1203 -30.231   2.606   7.408
  770   1HB   ARG1203           HB2      ARG1203 -29.780   4.559   8.711
  771   2HB   ARG1203           HB1      ARG1203 -30.632   5.577   7.560
  772   1HG   ARG1203           HG2      ARG1203 -32.738   4.480   8.152
  773   2HG   ARG1203           HG1      ARG1203 -31.875   3.460   9.306
  774   1HD   ARG1203           HD2      ARG1203 -32.963   5.331  10.430
  775   2HD   ARG1203           HD1      ARG1203 -31.209   5.437  10.570
  776    HE   ARG1203           HE       ARG1203 -32.011   6.919   8.335
  777   1HH1  ARG1203          1HH1      ARG1203 -32.272   6.998  11.809
  778   2HH1  ARG1203          2HH1      ARG1203 -32.377   8.726  11.890
  779   1HH2  ARG1203          1HH2      ARG1203 -32.148   9.193   8.433
  780   2HH2  ARG1203          2HH2      ARG1203 -32.308   9.972   9.971
  781    H    GLY1204           HN       GLY1204 -31.495   1.462   5.966
  782   1HA   GLY1204           HA1      GLY1204 -33.647   3.007   4.665
  783   2HA   GLY1204           HA2      GLY1204 -33.988   1.539   5.563
  784    H    TYR1205           HN       TYR1205 -32.245   2.794   2.748
  785    HA   TYR1205           HA       TYR1205 -33.248   1.188   0.840
  786   1HB   TYR1205           HB2      TYR1205 -30.392   2.122   1.072
  787   2HB   TYR1205           HB1      TYR1205 -31.086   1.446  -0.393
  788    HD1  TYR1205           HD1      TYR1205 -32.648   2.724  -1.724
  789    HD2  TYR1205           HD2      TYR1205 -31.067   4.331   1.879
  790    HE1  TYR1205           HE1      TYR1205 -33.476   4.947  -2.363
  791    HE2  TYR1205           HE2      TYR1205 -31.893   6.560   1.250
  792    HH   TYR1205           HH       TYR1205 -32.513   7.790  -0.788
  793    H    ARG1206           HN       ARG1206 -33.434  -0.872   0.509
  794    HA   ARG1206           HA       ARG1206 -31.874  -2.779   2.024
  795   1HB   ARG1206           HB2      ARG1206 -33.408  -4.435   1.107
  796   2HB   ARG1206           HB1      ARG1206 -34.302  -3.065   1.752
  797   1HG   ARG1206           HG2      ARG1206 -34.431  -2.167  -0.589
  798   2HG   ARG1206           HG1      ARG1206 -33.757  -3.706  -1.135
  799   1HD   ARG1206           HD2      ARG1206 -35.630  -4.896  -0.111
  800   2HD   ARG1206           HD1      ARG1206 -36.310  -3.363   0.431
  801    HE   ARG1206           HE       ARG1206 -35.968  -3.185  -2.320
  802   1HH1  ARG1206          1HH1      ARG1206 -37.827  -5.061  -0.049
  803   2HH1  ARG1206          2HH1      ARG1206 -39.146  -5.316  -1.142
  804   1HH2  ARG1206          1HH2      ARG1206 -37.700  -3.516  -3.766
  805   2HH2  ARG1206          2HH2      ARG1206 -39.074  -4.439  -3.255
  806    H    LEU1207           HN       LEU1207 -30.425  -4.231   1.228
  807    HA   LEU1207           HA       LEU1207 -28.756  -3.636  -0.843
  808   1HB   LEU1207           HB2      LEU1207 -28.337  -5.372   0.866
  809   2HB   LEU1207           HB1      LEU1207 -29.483  -6.425   0.057
  810    HG   LEU1207           HG       LEU1207 -27.970  -6.239  -1.995
  811   1HD1  LEU1207          3HD1      LEU1207 -26.703  -4.280  -1.243
  812   2HD1  LEU1207          2HD1      LEU1207 -26.035  -5.231   0.087
  813   3HD1  LEU1207          1HD1      LEU1207 -25.648  -5.654  -1.581
  814   1HD2  LEU1207          3HD2      LEU1207 -26.919  -7.577   0.493
  815   2HD2  LEU1207          2HD2      LEU1207 -28.109  -8.246  -0.624
  816   3HD2  LEU1207          1HD2      LEU1207 -26.452  -7.966  -1.162
  817    H    SER1208           HN       SER1208 -28.644  -3.977  -3.012
  818    HA   SER1208           HA       SER1208 -31.108  -4.525  -4.383
  819   1HB   SER1208           HB2      SER1208 -29.596  -2.781  -5.201
  820   2HB   SER1208           HB1      SER1208 -28.335  -3.984  -5.470
  821    HG   SER1208           HG       SER1208 -30.348  -3.277  -7.084
  822    H    SER1209           HN       SER1209 -29.070  -6.570  -2.979
  823    HA   SER1209           HA       SER1209 -28.743  -8.815  -3.117
  824   1HB   SER1209           HB2      SER1209 -31.078  -8.986  -3.829
  825   2HB   SER1209           HB1      SER1209 -30.607  -8.659  -5.497
  826    HG   SER1209           HG       SER1209 -29.644 -10.854  -3.982
  827    H    ARG1210           HN       ARG1210 -29.037  -7.960  -6.568
  828    HA   ARG1210           HA       ARG1210 -26.769  -9.452  -7.328
  829   1HB   ARG1210           HB2      ARG1210 -28.180  -7.205  -8.776
  830   2HB   ARG1210           HB1      ARG1210 -26.995  -8.282  -9.501
  831   1HG   ARG1210           HG2      ARG1210 -29.632  -9.145  -8.330
  832   2HG   ARG1210           HG1      ARG1210 -29.303  -8.909 -10.048
  833   1HD   ARG1210           HD2      ARG1210 -27.936 -10.893  -8.233
  834   2HD   ARG1210           HD1      ARG1210 -29.165 -11.268  -9.439
  835    HE   ARG1210           HE       ARG1210 -27.117  -9.960 -10.768
  836   1HH1  ARG1210          1HH1      ARG1210 -27.545 -12.908  -8.959
  837   2HH1  ARG1210          2HH1      ARG1210 -26.324 -13.771  -9.831
  838   1HH2  ARG1210          1HH2      ARG1210 -25.506 -11.089 -11.920
  839   2HH2  ARG1210          2HH2      ARG1210 -25.164 -12.738 -11.513
  840    H    SER1211           HN       SER1211 -26.808  -6.786  -5.479
  841    HA   SER1211           HA       SER1211 -24.939  -5.027  -6.549
  842   1HB   SER1211           HB2      SER1211 -25.515  -5.763  -3.674
  843   2HB   SER1211           HB1      SER1211 -24.471  -4.422  -4.147
  844    HG   SER1211           HG       SER1211 -26.465  -3.833  -5.476
  845    H    HIS1212           HN       HIS1212 -22.713  -4.682  -5.407
  846    HA   HIS1212           HA       HIS1212 -21.170  -7.076  -5.953
  847   1HB   HIS1212           HB2      HIS1212 -20.276  -4.268  -5.267
  848   2HB   HIS1212           HB1      HIS1212 -19.211  -5.583  -5.752
  849    HD1  HIS1212           HD1      HIS1212 -21.359  -2.933  -7.098
  850    HD2  HIS1212           HD2      HIS1212 -19.567  -6.410  -8.497
  851    HE1  HIS1212           HE1      HIS1212 -21.444  -2.770  -9.605
  852    HE2  HIS1212           HE2      HIS1212 -20.432  -4.925 -10.430
  853    H    THR1213           HN       THR1213 -22.456  -7.826  -3.875
  854    HA   THR1213           HA       THR1213 -22.395  -8.541  -1.723
  855    HB   THR1213           HB       THR1213 -20.232  -9.177  -0.808
  856    HG1  THR1213           HG1      THR1213 -18.605  -7.918  -1.283
  857   1HG2  THR1213          3HG2      THR1213 -20.404  -9.651  -3.785
  858   2HG2  THR1213          2HG2      THR1213 -19.446 -10.597  -2.646
  859   3HG2  THR1213          1HG2      THR1213 -21.206 -10.600  -2.535
  860    H    LEU1214           HN       LEU1214 -21.383  -8.081   0.545
  861    HA   LEU1214           HA       LEU1214 -21.474  -5.164   0.947
  862   1HB   LEU1214           HB2      LEU1214 -22.275  -7.462   2.724
  863   2HB   LEU1214           HB1      LEU1214 -22.055  -5.838   3.342
  864    HG   LEU1214           HG       LEU1214 -24.396  -6.215   2.972
  865   1HD1  LEU1214          2HD1      LEU1214 -23.224  -4.445   0.832
  866   2HD1  LEU1214          1HD1      LEU1214 -24.902  -4.415   1.373
  867   3HD1  LEU1214          3HD1      LEU1214 -23.607  -3.980   2.489
  868   1HD2  LEU1214          1HD2      LEU1214 -24.223  -8.029   1.355
  869   2HD2  LEU1214          3HD2      LEU1214 -25.298  -6.759   0.772
  870   3HD2  LEU1214          2HD2      LEU1214 -23.662  -6.893   0.129
  871    H    ARG1215           HN       ARG1215 -20.159  -8.037   2.577
  872    HA   ARG1215           HA       ARG1215 -17.870  -6.463   3.476
  873   1HB   ARG1215           HB2      ARG1215 -19.121  -7.996   5.035
  874   2HB   ARG1215           HB1      ARG1215 -18.501  -9.350   4.100
  875   1HG   ARG1215           HG2      ARG1215 -16.198  -8.583   4.619
  876   2HG   ARG1215           HG1      ARG1215 -16.896  -7.349   5.671
  877   1HD   ARG1215           HD2      ARG1215 -17.244 -10.328   5.964
  878   2HD   ARG1215           HD1      ARG1215 -16.191  -9.309   6.943
  879    HE   ARG1215           HE       ARG1215 -18.813  -8.311   7.071
  880   1HH1  ARG1215          1HH1      ARG1215 -16.929 -11.043   8.133
  881   2HH1  ARG1215          2HH1      ARG1215 -17.903 -11.332   9.536
  882   1HH2  ARG1215          1HH2      ARG1215 -20.100  -8.684   8.914
  883   2HH2  ARG1215          2HH2      ARG1215 -19.706  -9.992   9.979
  884    H    THR1216           HN       THR1216 -16.370  -6.245   1.946
  885    HA   THR1216           HA       THR1216 -15.465  -8.673   0.539
  886    HB   THR1216           HB       THR1216 -16.486  -7.316  -1.111
  887    HG1  THR1216           HG1      THR1216 -14.681  -7.922  -2.102
  888   1HG2  THR1216          1HG2      THR1216 -14.930  -5.010   0.052
  889   2HG2  THR1216          3HG2      THR1216 -15.865  -4.936  -1.442
  890   3HG2  THR1216          2HG2      THR1216 -16.678  -5.238   0.093
  891    H    THR1217           HN       THR1217 -13.186  -8.021  -0.545
  892    HA   THR1217           HA       THR1217 -11.503  -7.112   1.696
  893    HB   THR1217           HB       THR1217 -10.955  -9.134  -0.473
  894    HG1  THR1217           HG1      THR1217 -10.869  -9.283   2.374
  895   1HG2  THR1217          2HG2      THR1217  -8.992  -7.626  -0.148
  896   2HG2  THR1217          1HG2      THR1217  -8.972  -8.095   1.554
  897   3HG2  THR1217          3HG2      THR1217  -8.680  -9.304   0.303
  898    H    CYS1218           HN       CYS1218  -9.889  -5.653   1.354
  899    HA   CYS1218           HA       CYS1218 -10.111  -3.953  -0.949
  900   1HB   CYS1218           HB2      CYS1218  -7.861  -3.789   1.033
  901   2HB   CYS1218           HB1      CYS1218  -8.704  -2.485   0.201
  902    H    TRP1219           HN       TRP1219  -8.704  -3.840  -2.720
  903    HA   TRP1219           HA       TRP1219  -6.158  -5.158  -2.628
  904   1HB   TRP1219           HB2      TRP1219  -8.243  -6.829  -3.194
  905   2HB   TRP1219           HB1      TRP1219  -7.729  -6.342  -4.807
  906    HD1  TRP1219           HD1      TRP1219  -4.888  -6.623  -5.151
  907    HE1  TRP1219           HE1      TRP1219  -3.470  -8.663  -4.476
  908    HE3  TRP1219           HE3      TRP1219  -8.037  -8.720  -1.716
  909    HZ2  TRP1219           HZ2      TRP1219  -3.654 -10.858  -2.740
  910    HZ3  TRP1219           HZ3      TRP1219  -7.341 -10.797  -0.591
  911    HH2  TRP1219           HH2      TRP1219  -5.192 -11.845  -1.093
  912    H    ASP1220           HN       ASP1220  -4.811  -4.077  -3.843
  913    HA   ASP1220           HA       ASP1220  -3.923  -2.729  -5.439
  914   1HB   ASP1220           HB2      ASP1220  -4.774  -4.540  -6.921
  915   2HB   ASP1220           HB1      ASP1220  -6.265  -3.626  -7.128
  916    H    GLY1221           HN       GLY1221  -6.609  -1.974  -3.841
  917   1HA   GLY1221           HA1      GLY1221  -6.797   0.662  -5.157
  918   2HA   GLY1221           HA2      GLY1221  -7.010   0.393  -3.434
  919    H    LYS1222           HN       LYS1222  -8.375  -1.338  -6.213
  920    HA   LYS1222           HA       LYS1222 -11.027  -0.290  -5.603
  921   1HB   LYS1222           HB2      LYS1222 -10.191  -0.445  -7.957
  922   2HB   LYS1222           HB1      LYS1222 -10.195  -2.196  -7.788
  923   1HG   LYS1222           HG2      LYS1222 -12.709  -1.730  -7.067
  924   2HG   LYS1222           HG1      LYS1222 -12.456  -0.312  -8.086
  925   1HD   LYS1222           HD2      LYS1222 -11.778  -3.090  -9.013
  926   2HD   LYS1222           HD1      LYS1222 -13.393  -2.405  -9.205
  927   1HE   LYS1222           HE2      LYS1222 -12.205  -2.039 -11.241
  928   2HE   LYS1222           HE1      LYS1222 -12.354  -0.486 -10.420
  929   1HZ   LYS1222           HZ3      LYS1222  -9.940  -2.210 -10.313
  930   2HZ   LYS1222           HZ2      LYS1222 -10.128  -0.894 -11.358
  931   3HZ   LYS1222           HZ1      LYS1222 -10.096  -0.647  -9.685
  932    H    LEU1223           HN       LEU1223 -12.851  -1.683  -5.311
  933    HA   LEU1223           HA       LEU1223 -12.678  -4.457  -5.022
  934   1HB   LEU1223           HB2      LEU1223 -12.739  -4.758  -2.624
  935   2HB   LEU1223           HB1      LEU1223 -11.249  -3.991  -3.126
  936    HG   LEU1223           HG       LEU1223 -11.807  -2.880  -1.168
  937   1HD1  LEU1223          2HD1      LEU1223 -13.006  -1.200  -3.360
  938   2HD1  LEU1223          1HD1      LEU1223 -12.474  -0.619  -1.780
  939   3HD1  LEU1223          3HD1      LEU1223 -11.299  -1.279  -2.919
  940   1HD2  LEU1223          2HD2      LEU1223 -14.616  -3.083  -2.141
  941   2HD2  LEU1223          1HD2      LEU1223 -13.910  -3.643  -0.625
  942   3HD2  LEU1223          3HD2      LEU1223 -14.168  -1.917  -0.893
  943    H    GLU1224           HN       GLU1224 -14.588  -5.439  -4.565
  944    HA   GLU1224           HA       GLU1224 -16.899  -4.454  -5.477
  945   1HB   GLU1224           HB2      GLU1224 -16.509  -6.436  -3.244
  946   2HB   GLU1224           HB1      GLU1224 -18.080  -6.111  -3.960
  947   1HG   GLU1224           HG2      GLU1224 -17.129  -8.085  -4.935
  948   2HG   GLU1224           HG1      GLU1224 -17.209  -6.807  -6.147
  949    H    TYR1225           HN       TYR1225 -18.796  -3.594  -4.732
  950    HA   TYR1225           HA       TYR1225 -19.172  -2.739  -2.038
  951   1HB   TYR1225           HB2      TYR1225 -19.420  -0.307  -2.594
  952   2HB   TYR1225           HB1      TYR1225 -17.768  -0.903  -2.606
  953    HD1  TYR1225           HD1      TYR1225 -19.877   1.246  -4.195
  954    HD2  TYR1225           HD2      TYR1225 -17.123  -1.860  -5.116
  955    HE1  TYR1225           HE1      TYR1225 -19.548   2.214  -6.432
  956    HE2  TYR1225           HE2      TYR1225 -16.786  -0.908  -7.357
  957    HH   TYR1225           HH       TYR1225 -17.852   2.197  -8.214
  958    HA   PRO1226           HA       PRO1226 -23.275  -3.645  -3.385
  959   1HB   PRO1226           HB2      PRO1226 -24.630  -2.358  -1.378
  960   2HB   PRO1226           HB1      PRO1226 -23.869  -3.943  -1.208
  961   1HG   PRO1226           HG2      PRO1226 -22.828  -1.247  -0.418
  962   2HG   PRO1226           HG1      PRO1226 -22.782  -2.772   0.487
  963   1HD   PRO1226           HD2      PRO1226 -20.631  -1.873  -0.824
  964   2HD   PRO1226           HD1      PRO1226 -21.016  -3.606  -0.772
  965    H    THR1227           HN       THR1227 -25.464  -1.985  -2.722
  966    HA   THR1227           HA       THR1227 -25.159   0.631  -3.856
  967    HB   THR1227           HB       THR1227 -26.616  -1.473  -5.470
  968    HG1  THR1227           HG1      THR1227 -24.974  -0.349  -7.038
  969   1HG2  THR1227          2HG2      THR1227 -26.370   1.504  -5.925
  970   2HG2  THR1227          1HG2      THR1227 -27.101   0.351  -7.042
  971   3HG2  THR1227          3HG2      THR1227 -27.838   0.641  -5.466
  972    H    CYS1228           HN       CYS1228 -27.372  -2.020  -3.179
  973    HA   CYS1228           HA       CYS1228 -29.390  -2.151  -2.156
  974   1HB   CYS1228           HB2      CYS1228 -28.418   0.327  -0.714
  975   2HB   CYS1228           HB1      CYS1228 -29.730  -0.727  -0.193
  976    H    ALA1229           HN       ALA1229 -31.438  -0.700  -1.503
  977    HA   ALA1229           HA       ALA1229 -31.953   1.600  -3.052
  978   1HB   ALA1229           HB1      ALA1229 -32.983  -0.994  -4.165
  979   2HB   ALA1229           HB3      ALA1229 -33.495   0.608  -4.695
  980   3HB   ALA1229           HB2      ALA1229 -31.822   0.092  -4.930
  981    H    LYS1230           HN       LYS1230 -34.014   2.431  -2.791
  982    HA   LYS1230           HA       LYS1230 -35.909   2.907  -1.677
  983   1HB   LYS1230           HB2      LYS1230 -37.045   1.248  -2.810
  984   2HB   LYS1230           HB1      LYS1230 -36.089  -0.041  -2.095
  985   1HG   LYS1230           HG2      LYS1230 -37.266   0.129  -0.037
  986   2HG   LYS1230           HG1      LYS1230 -38.116   1.579  -0.577
  987   1HD   LYS1230           HD2      LYS1230 -39.219   0.271  -2.331
  988   2HD   LYS1230           HD1      LYS1230 -38.369  -1.177  -1.784
  989   1HE   LYS1230           HE2      LYS1230 -40.648  -1.122  -0.920
  990   2HE   LYS1230           HE1      LYS1230 -39.471  -1.011   0.388
  991   1HZ   LYS1230           HZ3      LYS1230 -40.953   1.273  -0.798
  992   2HZ   LYS1230           HZ2      LYS1230 -41.285   0.551   0.695
  993   3HZ   LYS1230           HZ1      LYS1230 -39.827   1.376   0.461
  994    H    ARG1231           HN       ARG1231 -35.209   3.840   0.163
  995    HA   ARG1231           HA       ARG1231 -34.306   2.417   2.424
  996   1HB   ARG1231           HB2      ARG1231 -34.602   4.666   3.556
  997   2HB   ARG1231           HB1      ARG1231 -33.515   4.631   2.189
  998   1HG   ARG1231           HG2      ARG1231 -35.231   5.588   0.766
  999   2HG   ARG1231           HG1      ARG1231 -36.380   5.558   2.107
 1000   1HD   ARG1231           HD2      ARG1231 -34.938   7.092   3.364
 1001   2HD   ARG1231           HD1      ARG1231 -33.809   7.133   2.010
 1002    HE   ARG1231           HE       ARG1231 -36.269   7.875   0.993
 1003   1HH1  ARG1231          1HH1      ARG1231 -34.036   9.050   3.396
 1004   2HH1  ARG1231          2HH1      ARG1231 -34.485  10.709   3.190
 1005   1HH2  ARG1231          1HH2      ARG1231 -36.867  10.057   0.713
 1006   2HH2  ARG1231          2HH2      ARG1231 -36.094  11.282   1.664

  No H/Q in entry =        1006
  Start of MODEL    8
    1    H1   GLU1103           HT1      GLU1103  40.692   4.288  -3.336
    2    H2   GLU1103           HT3      GLU1103  42.199   4.999  -3.040
    3    H3   GLU1103           HT2      GLU1103  42.076   3.680  -4.092
    4    HA   GLU1103           HA       GLU1103  42.983   2.981  -1.989
    5   1HB   GLU1103           HB2      GLU1103  41.580   3.108   0.034
    6   2HB   GLU1103           HB1      GLU1103  41.985   4.702  -0.586
    7   1HG   GLU1103           HG2      GLU1103  39.776   4.871  -1.608
    8   2HG   GLU1103           HG1      GLU1103  39.369   3.271  -0.991
    9    H    ALA1104           HN       ALA1104  41.923   1.116  -0.593
   10    HA   ALA1104           HA       ALA1104  40.706  -0.665  -2.528
   11   1HB   ALA1104           HB2      ALA1104  42.576  -1.447  -1.154
   12   2HB   ALA1104           HB3      ALA1104  41.126  -2.415  -0.885
   13   3HB   ALA1104           HB1      ALA1104  41.609  -1.201   0.301
   14    H    GLU1105           HN       GLU1105  38.954  -2.172  -1.718
   15    HA   GLU1105           HA       GLU1105  36.793  -2.483  -1.092
   16   1HB   GLU1105           HB2      GLU1105  37.559  -0.622   1.164
   17   2HB   GLU1105           HB1      GLU1105  36.111  -1.617   1.117
   18   1HG   GLU1105           HG2      GLU1105  38.945  -2.631   1.131
   19   2HG   GLU1105           HG1      GLU1105  37.843  -2.611   2.508
   20    H    PHE1106           HN       PHE1106  35.623  -1.598  -2.717
   21    HA   PHE1106           HA       PHE1106  34.605   1.117  -2.261
   22   1HB   PHE1106           HB2      PHE1106  36.349   1.251  -3.996
   23   2HB   PHE1106           HB1      PHE1106  35.499   0.035  -4.942
   24    HD1  PHE1106           HD1      PHE1106  33.673   0.609  -6.324
   25    HD2  PHE1106           HD2      PHE1106  35.313   3.482  -3.647
   26    HE1  PHE1106           HE1      PHE1106  32.366   2.377  -7.428
   27    HE2  PHE1106           HE2      PHE1106  34.007   5.256  -4.746
   28    HZ   PHE1106           HZ       PHE1106  32.532   4.703  -6.639
   29    H    GLY1107           HN       GLY1107  32.465   1.072  -2.117
   30   1HA   GLY1107           HA1      GLY1107  30.920  -1.208  -2.681
   31   2HA   GLY1107           HA2      GLY1107  30.738  -0.049  -3.983
   32    H    LYS1108           HN       LYS1108  31.370   1.678  -1.229
   33    HA   LYS1108           HA       LYS1108  29.099   1.662   0.303
   34   1HB   LYS1108           HB2      LYS1108  30.631   4.112  -0.593
   35   2HB   LYS1108           HB1      LYS1108  29.516   4.040   0.765
   36   1HG   LYS1108           HG2      LYS1108  31.865   2.200   0.672
   37   2HG   LYS1108           HG1      LYS1108  32.073   3.878   1.175
   38   1HD   LYS1108           HD2      LYS1108  30.388   3.569   2.918
   39   2HD   LYS1108           HD1      LYS1108  30.161   1.895   2.408
   40   1HE   LYS1108           HE2      LYS1108  32.709   3.092   3.490
   41   2HE   LYS1108           HE1      LYS1108  31.608   2.030   4.367
   42   1HZ   LYS1108           HZ2      LYS1108  33.128   1.299   1.923
   43   2HZ   LYS1108           HZ1      LYS1108  33.504   0.815   3.500
   44   3HZ   LYS1108           HZ3      LYS1108  32.074   0.282   2.768
   45    H    CYS1109           HN       CYS1109  27.066   1.751  -0.244
   46    HA   CYS1109           HA       CYS1109  26.270   2.855  -2.780
   47   1HB   CYS1109           HB2      CYS1109  23.919   2.201  -1.690
   48   2HB   CYS1109           HB1      CYS1109  24.977   1.014  -2.444
   49    H    GLY1110           HN       GLY1110  24.032   4.095  -2.638
   50   1HA   GLY1110           HA1      GLY1110  23.814   6.522  -2.418
   51   2HA   GLY1110           HA2      GLY1110  24.508   6.366  -0.811
   52    HA   PRO1111           HA       PRO1111  20.311   6.649   0.620
   53   1HB   PRO1111           HB2      PRO1111  19.155   8.228  -1.604
   54   2HB   PRO1111           HB1      PRO1111  19.215   8.592   0.124
   55   1HG   PRO1111           HG2      PRO1111  20.776   9.888  -1.619
   56   2HG   PRO1111           HG1      PRO1111  21.357   9.461   0.000
   57   1HD   PRO1111           HD2      PRO1111  21.933   8.154  -2.629
   58   2HD   PRO1111           HD1      PRO1111  23.020   8.454  -1.256
   59    HA   PRO1112           HA       PRO1112  18.700   3.007  -1.521
   60   1HB   PRO1112           HB2      PRO1112  16.612   3.487   0.562
   61   2HB   PRO1112           HB1      PRO1112  17.410   1.981   0.094
   62   1HG   PRO1112           HG2      PRO1112  18.122   3.257   2.318
   63   2HG   PRO1112           HG1      PRO1112  19.337   2.481   1.286
   64   1HD   PRO1112           HD2      PRO1112  18.700   5.369   1.622
   65   2HD   PRO1112           HD1      PRO1112  20.253   4.587   1.270
   66    HA   PRO1113           HA       PRO1113  15.508   5.374  -3.717
   67   1HB   PRO1113           HB2      PRO1113  16.322   4.764  -6.198
   68   2HB   PRO1113           HB1      PRO1113  17.174   5.959  -5.214
   69   1HG   PRO1113           HG2      PRO1113  17.984   3.228  -5.973
   70   2HG   PRO1113           HG1      PRO1113  18.986   4.598  -5.473
   71   1HD   PRO1113           HD2      PRO1113  18.073   2.372  -3.883
   72   2HD   PRO1113           HD1      PRO1113  19.134   3.710  -3.398
   73    HA   PRO1114           HA       PRO1114  13.420   1.337  -4.418
   74   1HB   PRO1114           HB2      PRO1114  11.627   1.419  -2.473
   75   2HB   PRO1114           HB1      PRO1114  13.325   1.105  -2.100
   76   1HG   PRO1114           HG2      PRO1114  11.717   3.569  -1.681
   77   2HG   PRO1114           HG1      PRO1114  13.083   2.944  -0.742
   78   1HD   PRO1114           HD2      PRO1114  13.137   4.939  -2.790
   79   2HD   PRO1114           HD1      PRO1114  14.512   4.250  -1.909
   80    H    ILE1115           HN       ILE1115  10.684   1.308  -3.781
   81    HA   ILE1115           HA       ILE1115   9.350   2.014  -6.006
   82    HB   ILE1115           HB       ILE1115   7.388   2.552  -4.246
   83   1HG1  ILE1115          2HG1      ILE1115   9.505   1.052  -2.685
   84   2HG1  ILE1115          1HG1      ILE1115   8.877   2.654  -2.319
   85   1HG2  ILE1115          3HG2      ILE1115   8.572  -0.164  -4.805
   86   2HG2  ILE1115          2HG2      ILE1115   6.948   0.126  -4.184
   87   3HG2  ILE1115          1HG2      ILE1115   7.391   0.694  -5.794
   88   1HD1  ILE1115          2HD1      ILE1115   7.314   0.088  -2.217
   89   2HD1  ILE1115          1HD1      ILE1115   7.955   0.974  -0.833
   90   3HD1  ILE1115          3HD1      ILE1115   6.694   1.694  -1.836
   91    H    ASP1116           HN       ASP1116   8.210   3.791  -6.806
   92    HA   ASP1116           HA       ASP1116   9.273   6.352  -6.077
   93   1HB   ASP1116           HB2      ASP1116   8.708   5.663  -8.433
   94   2HB   ASP1116           HB1      ASP1116   7.007   5.767  -7.991
   95    H    ASN1117           HN       ASN1117   7.702   4.907  -4.105
   96    HA   ASN1117           HA       ASN1117   6.103   7.066  -3.154
   97   1HB   ASN1117           HB2      ASN1117   4.786   4.523  -4.111
   98   2HB   ASN1117           HB1      ASN1117   4.038   5.567  -2.905
   99   1HD2  ASN1117          1HD2      ASN1117   3.589   4.800  -5.863
  100   2HD2  ASN1117          2HD2      ASN1117   3.234   6.318  -6.604
  101    H    GLY1118           HN       GLY1118   8.323   4.988  -2.528
  102   1HA   GLY1118           HA1      GLY1118   8.200   3.171  -0.756
  103   2HA   GLY1118           HA2      GLY1118   7.303   4.360   0.170
  104    H    ASP1119           HN       ASP1119   9.657   3.023   0.970
  105    HA   ASP1119           HA       ASP1119  12.100   4.128   0.805
  106   1HB   ASP1119           HB2      ASP1119  10.965   6.363   1.211
  107   2HB   ASP1119           HB1      ASP1119  10.591   5.793   2.834
  108    H    ILE1120           HN       ILE1120  13.394   3.921   2.942
  109    HA   ILE1120           HA       ILE1120  12.936   1.418   4.019
  110    HB   ILE1120           HB       ILE1120  14.235   3.075   5.995
  111   1HG1  ILE1120          2HG1      ILE1120  15.159   3.301   3.126
  112   2HG1  ILE1120          1HG1      ILE1120  14.741   4.616   4.213
  113   1HG2  ILE1120          2HG2      ILE1120  15.182   0.884   4.158
  114   2HG2  ILE1120          1HG2      ILE1120  16.069   1.496   5.555
  115   3HG2  ILE1120          3HG2      ILE1120  14.523   0.678   5.782
  116   1HD1  ILE1120          1HD1      ILE1120  16.688   4.042   5.606
  117   2HD1  ILE1120          3HD1      ILE1120  17.124   2.798   4.435
  118   3HD1  ILE1120          2HD1      ILE1120  17.124   4.497   3.959
  119    H    THR1121           HN       THR1121  11.901   0.602   5.745
  120    HA   THR1121           HA       THR1121   9.661   2.071   6.737
  121    HB   THR1121           HB       THR1121   9.062   0.058   7.938
  122    HG1  THR1121           HG1      THR1121  11.175  -0.527   8.652
  123   1HG2  THR1121          2HG2      THR1121   8.676   0.119   5.489
  124   2HG2  THR1121          1HG2      THR1121  10.231  -0.677   5.246
  125   3HG2  THR1121          3HG2      THR1121   8.933  -1.518   6.093
  126    H    SER1122           HN       SER1122  12.723   2.495   7.543
  127    HA   SER1122           HA       SER1122  12.102   2.905  10.399
  128   1HB   SER1122           HB2      SER1122  14.781   2.209   9.171
  129   2HB   SER1122           HB1      SER1122  14.507   2.570  10.876
  130    HG   SER1122           HG       SER1122  12.827   0.646   9.913
  131    H    PHE1123           HN       PHE1123  14.878   3.932   8.473
  132    HA   PHE1123           HA       PHE1123  13.977   6.676   8.366
  133   1HB   PHE1123           HB2      PHE1123  14.949   6.447  10.650
  134   2HB   PHE1123           HB1      PHE1123  16.475   5.964   9.920
  135    HD1  PHE1123           HD1      PHE1123  17.995   7.559   9.093
  136    HD2  PHE1123           HD2      PHE1123  14.079   8.752  10.254
  137    HE1  PHE1123           HE1      PHE1123  18.671   9.920   8.932
  138    HE2  PHE1123           HE2      PHE1123  14.747  11.115  10.095
  139    HZ   PHE1123           HZ       PHE1123  17.046  11.702   9.433
  140    HA   PRO1124           HA       PRO1124  16.459   6.215   4.700
  141   1HB   PRO1124           HB2      PRO1124  16.281   8.729   3.755
  142   2HB   PRO1124           HB1      PRO1124  14.909   7.615   3.727
  143   1HG   PRO1124           HG2      PRO1124  15.521   9.822   5.657
  144   2HG   PRO1124           HG1      PRO1124  13.974   9.392   4.905
  145   1HD   PRO1124           HD2      PRO1124  14.660   8.667   7.445
  146   2HD   PRO1124           HD1      PRO1124  13.561   7.718   6.423
  147    H    LEU1125           HN       LEU1125  18.586   6.347   4.245
  148    HA   LEU1125           HA       LEU1125  20.177   8.377   5.665
  149   1HB   LEU1125           HB2      LEU1125  21.108   5.584   4.970
  150   2HB   LEU1125           HB1      LEU1125  21.991   6.799   5.874
  151    HG   LEU1125           HG       LEU1125  20.020   6.659   7.558
  152   1HD1  LEU1125          2HD1      LEU1125  18.594   5.279   6.043
  153   2HD1  LEU1125          1HD1      LEU1125  19.752   3.962   6.245
  154   3HD1  LEU1125          3HD1      LEU1125  18.857   4.566   7.637
  155   1HD2  LEU1125          2HD2      LEU1125  22.302   5.940   8.029
  156   2HD2  LEU1125          1HD2      LEU1125  21.129   4.824   8.728
  157   3HD2  LEU1125          3HD2      LEU1125  21.983   4.391   7.249
  158    H    SER1126           HN       SER1126  21.906   9.301   4.555
  159    HA   SER1126           HA       SER1126  21.591   9.340   1.689
  160   1HB   SER1126           HB2      SER1126  23.585  10.788   3.448
  161   2HB   SER1126           HB1      SER1126  23.291  11.112   1.740
  162    HG   SER1126           HG       SER1126  21.656  12.289   2.299
  163    H    VAL1127           HN       VAL1127  24.223   8.541   3.947
  164    HA   VAL1127           HA       VAL1127  25.596   7.161   1.749
  165    HB   VAL1127           HB       VAL1127  26.994   8.780   2.894
  166   1HG1  VAL1127          1HG1      VAL1127  25.853   8.828   5.045
  167   2HG1  VAL1127          3HG1      VAL1127  26.431   7.201   5.401
  168   3HG1  VAL1127          2HG1      VAL1127  27.579   8.533   5.258
  169   1HG2  VAL1127          3HG2      VAL1127  28.064   6.762   2.055
  170   2HG2  VAL1127          2HG2      VAL1127  28.863   7.323   3.524
  171   3HG2  VAL1127          1HG2      VAL1127  27.762   5.947   3.590
  172    H    TYR1128           HN       TYR1128  25.494   5.029   1.640
  173    HA   TYR1128           HA       TYR1128  24.830   3.539   4.091
  174   1HB   TYR1128           HB2      TYR1128  23.528   3.583   1.529
  175   2HB   TYR1128           HB1      TYR1128  24.138   1.965   1.857
  176    HD1  TYR1128           HD1      TYR1128  23.460   0.832   4.014
  177    HD2  TYR1128           HD2      TYR1128  21.600   4.385   2.600
  178    HE1  TYR1128           HE1      TYR1128  21.533   0.400   5.482
  179    HE2  TYR1128           HE2      TYR1128  19.670   3.966   4.060
  180    HH   TYR1128           HH       TYR1128  19.716   1.666   6.552
  181    H    ALA1129           HN       ALA1129  25.749   1.504   4.384
  182    HA   ALA1129           HA       ALA1129  28.418   1.260   3.325
  183   1HB   ALA1129           HB2      ALA1129  27.947   0.751   5.672
  184   2HB   ALA1129           HB1      ALA1129  26.894  -0.576   5.175
  185   3HB   ALA1129           HB3      ALA1129  28.624  -0.647   4.837
  186    HA   PRO1130           HA       PRO1130  27.567  -1.478  -0.030
  187   1HB   PRO1130           HB2      PRO1130  29.829  -3.003  -0.047
  188   2HB   PRO1130           HB1      PRO1130  29.766  -1.345  -0.653
  189   1HG   PRO1130           HG2      PRO1130  30.734  -2.367   1.989
  190   2HG   PRO1130           HG1      PRO1130  31.440  -1.120   0.943
  191   1HD   PRO1130           HD2      PRO1130  29.979  -0.513   3.134
  192   2HD   PRO1130           HD1      PRO1130  29.977   0.505   1.679
  193    H    ALA1131           HN       ALA1131  26.780  -3.507  -0.465
  194    HA   ALA1131           HA       ALA1131  25.893  -5.563  -0.083
  195   1HB   ALA1131           HB1      ALA1131  28.219  -6.213   0.321
  196   2HB   ALA1131           HB2      ALA1131  27.100  -7.121   1.337
  197   3HB   ALA1131           HB3      ALA1131  28.037  -5.793   2.025
  198    H    SER1132           HN       SER1132  25.383  -3.061   1.779
  199    HA   SER1132           HA       SER1132  24.325  -4.269   4.161
  200   1HB   SER1132           HB2      SER1132  24.049  -1.495   3.000
  201   2HB   SER1132           HB1      SER1132  23.304  -1.989   4.521
  202    HG   SER1132           HG       SER1132  25.246  -2.128   5.450
  203    H    SER1133           HN       SER1133  22.170  -4.569   4.727
  204    HA   SER1133           HA       SER1133  20.267  -4.508   2.479
  205   1HB   SER1133           HB2      SER1133  20.109  -6.536   4.694
  206   2HB   SER1133           HB1      SER1133  19.391  -6.593   3.086
  207    HG   SER1133           HG       SER1133  21.951  -6.421   2.674
  208    H    VAL1134           HN       VAL1134  18.143  -3.942   2.922
  209    HA   VAL1134           HA       VAL1134  17.453  -3.238   5.672
  210    HB   VAL1134           HB       VAL1134  16.499  -1.052   4.937
  211   1HG1  VAL1134          1HG1      VAL1134  19.480  -1.397   4.670
  212   2HG1  VAL1134          3HG1      VAL1134  18.652   0.137   4.939
  213   3HG1  VAL1134          2HG1      VAL1134  18.576  -1.132   6.161
  214   1HG2  VAL1134          3HG2      VAL1134  16.414  -1.541   2.528
  215   2HG2  VAL1134          2HG2      VAL1134  17.260  -0.034   2.881
  216   3HG2  VAL1134          1HG2      VAL1134  18.174  -1.486   2.470
  217    H    GLU1135           HN       GLU1135  15.106  -2.328   5.659
  218    HA   GLU1135           HA       GLU1135  13.465  -3.873   3.770
  219   1HB   GLU1135           HB2      GLU1135  13.563  -5.163   5.816
  220   2HB   GLU1135           HB1      GLU1135  13.158  -3.746   6.775
  221   1HG   GLU1135           HG2      GLU1135  10.952  -3.670   5.715
  222   2HG   GLU1135           HG1      GLU1135  11.361  -5.109   4.783
  223    H    TYR1136           HN       TYR1136  12.492  -2.321   2.618
  224    HA   TYR1136           HA       TYR1136  11.334  -0.056   4.089
  225   1HB   TYR1136           HB2      TYR1136  11.232   1.005   1.750
  226   2HB   TYR1136           HB1      TYR1136  12.799   0.882   2.538
  227    HD1  TYR1136           HD1      TYR1136  14.278   0.854   0.757
  228    HD2  TYR1136           HD2      TYR1136  10.947  -1.788   0.726
  229    HE1  TYR1136           HE1      TYR1136  15.194  -0.266  -1.227
  230    HE2  TYR1136           HE2      TYR1136  11.855  -2.917  -1.257
  231    HH   TYR1136           HH       TYR1136  13.378  -2.449  -3.100
  232    H    GLN1137           HN       GLN1137   9.359   0.885   2.958
  233    HA   GLN1137           HA       GLN1137   7.651  -1.091   1.684
  234   1HB   GLN1137           HB2      GLN1137   7.459  -1.347   4.214
  235   2HB   GLN1137           HB1      GLN1137   6.728   0.251   4.225
  236   1HG   GLN1137           HG2      GLN1137   4.953  -0.570   2.739
  237   2HG   GLN1137           HG1      GLN1137   5.674  -2.178   2.795
  238   1HE2  GLN1137          1HE2      GLN1137   6.425  -1.890   5.610
  239   2HE2  GLN1137          2HE2      GLN1137   4.965  -2.080   6.511
  240    H    CYS1138           HN       CYS1138   5.371  -0.025   1.365
  241    HA   CYS1138           HA       CYS1138   5.844   2.481   0.019
  242   1HB   CYS1138           HB2      CYS1138   3.197   1.063   0.308
  243   2HB   CYS1138           HB1      CYS1138   3.690   2.190  -0.952
  244    H    GLN1139           HN       GLN1139   5.181   4.467   0.633
  245    HA   GLN1139           HA       GLN1139   4.493   4.924   3.345
  246   1HB   GLN1139           HB2      GLN1139   4.401   6.831   1.000
  247   2HB   GLN1139           HB1      GLN1139   4.352   7.289   2.697
  248   1HG   GLN1139           HG2      GLN1139   6.593   6.376   3.013
  249   2HG   GLN1139           HG1      GLN1139   6.641   5.909   1.313
  250   1HE2  GLN1139          1HE2      GLN1139   5.238   8.323   0.456
  251   2HE2  GLN1139          2HE2      GLN1139   6.392   9.604   0.551
  252    H    ASN1140           HN       ASN1140   2.637   6.796   3.550
  253    HA   ASN1140           HA       ASN1140   0.396   6.983   3.941
  254   1HB   ASN1140           HB2      ASN1140   0.848   7.686   1.486
  255   2HB   ASN1140           HB1      ASN1140   0.002   6.197   1.073
  256   1HD2  ASN1140          1HD2      ASN1140  -1.730   7.161   0.147
  257   2HD2  ASN1140          2HD2      ASN1140  -2.898   8.065   1.037
  258    H    LEU1141           HN       LEU1141  -1.780   5.713   2.661
  259    HA   LEU1141           HA       LEU1141  -1.949   3.339   4.208
  260   1HB   LEU1141           HB2      LEU1141  -3.779   4.302   2.010
  261   2HB   LEU1141           HB1      LEU1141  -4.160   3.080   3.208
  262    HG   LEU1141           HG       LEU1141  -3.597   5.980   3.832
  263   1HD1  LEU1141          2HD1      LEU1141  -6.211   4.485   3.702
  264   2HD1  LEU1141          1HD1      LEU1141  -5.999   6.142   4.268
  265   3HD1  LEU1141          3HD1      LEU1141  -5.671   5.736   2.583
  266   1HD2  LEU1141          2HD2      LEU1141  -4.614   3.728   5.560
  267   2HD2  LEU1141          1HD2      LEU1141  -3.021   4.478   5.659
  268   3HD2  LEU1141          3HD2      LEU1141  -4.463   5.417   6.049
  269    H    TYR1142           HN       TYR1142  -0.214   3.767   1.503
  270    HA   TYR1142           HA       TYR1142  -1.024   1.595  -0.137
  271   1HB   TYR1142           HB2      TYR1142   1.608   3.062   0.079
  272   2HB   TYR1142           HB1      TYR1142   1.271   1.835  -1.137
  273    HD1  TYR1142           HD1      TYR1142   0.743   5.279  -0.127
  274    HD2  TYR1142           HD2      TYR1142  -0.430   2.260  -2.885
  275    HE1  TYR1142           HE1      TYR1142  -0.241   7.000  -1.583
  276    HE2  TYR1142           HE2      TYR1142  -1.416   3.972  -4.349
  277    HH   TYR1142           HH       TYR1142  -2.304   6.258  -4.171
  278    H    GLN1143           HN       GLN1143  -0.584  -0.522  -0.032
  279    HA   GLN1143           HA       GLN1143   1.185  -1.431   2.141
  280   1HB   GLN1143           HB2      GLN1143  -1.406  -2.045   1.879
  281   2HB   GLN1143           HB1      GLN1143  -0.735  -3.303   0.851
  282   1HG   GLN1143           HG2      GLN1143  -0.031  -2.810   3.735
  283   2HG   GLN1143           HG1      GLN1143  -1.063  -4.099   3.119
  284   1HE2  GLN1143          1HE2      GLN1143  -0.143  -5.834   2.044
  285   2HE2  GLN1143          2HE2      GLN1143   1.549  -6.170   2.113
  286    H    LEU1144           HN       LEU1144   3.120  -2.018   1.425
  287    HA   LEU1144           HA       LEU1144   3.742  -2.558  -1.260
  288   1HB   LEU1144           HB2      LEU1144   5.348  -1.762   0.463
  289   2HB   LEU1144           HB1      LEU1144   5.315  -3.357   1.187
  290    HG   LEU1144           HG       LEU1144   6.057  -3.156  -1.695
  291   1HD1  LEU1144          3HD1      LEU1144   7.339  -1.351  -0.674
  292   2HD1  LEU1144          2HD1      LEU1144   7.919  -2.455   0.572
  293   3HD1  LEU1144          1HD1      LEU1144   8.387  -2.701  -1.112
  294   1HD2  LEU1144          2HD2      LEU1144   5.854  -5.333  -0.603
  295   2HD2  LEU1144          1HD2      LEU1144   7.519  -5.012  -1.086
  296   3HD2  LEU1144          3HD2      LEU1144   7.043  -4.843   0.603
  297    H    GLU1145           HN       GLU1145   4.494  -4.484  -2.230
  298    HA   GLU1145           HA       GLU1145   3.650  -6.995  -0.986
  299   1HB   GLU1145           HB2      GLU1145   1.809  -6.265  -2.452
  300   2HB   GLU1145           HB1      GLU1145   2.929  -6.158  -3.802
  301   1HG   GLU1145           HG2      GLU1145   1.635  -8.195  -3.927
  302   2HG   GLU1145           HG1      GLU1145   3.338  -8.562  -3.654
  303    H    GLY1146           HN       GLY1146   5.016  -8.650  -1.335
  304   1HA   GLY1146           HA1      GLY1146   7.047  -8.385  -3.446
  305   2HA   GLY1146           HA2      GLY1146   6.582  -9.886  -2.659
  306    H    ASN1147           HN       ASN1147   9.234  -9.271  -2.921
  307    HA   ASN1147           HA       ASN1147  10.088  -9.316  -0.196
  308   1HB   ASN1147           HB2      ASN1147  12.386  -9.438  -1.191
  309   2HB   ASN1147           HB1      ASN1147  11.279 -10.674  -1.779
  310   1HD2  ASN1147          1HD2      ASN1147  13.169  -7.915  -2.580
  311   2HD2  ASN1147          2HD2      ASN1147  12.911  -7.965  -4.289
  312    H    LYS1148           HN       LYS1148   9.728  -7.418   0.834
  313    HA   LYS1148           HA       LYS1148  10.456  -4.885  -0.333
  314   1HB   LYS1148           HB2      LYS1148   9.912  -4.172   2.152
  315   2HB   LYS1148           HB1      LYS1148   8.639  -4.570   1.004
  316   1HG   LYS1148           HG2      LYS1148   8.223  -5.586   3.173
  317   2HG   LYS1148           HG1      LYS1148   8.488  -6.817   1.936
  318   1HD   LYS1148           HD2      LYS1148  10.804  -7.073   2.697
  319   2HD   LYS1148           HD1      LYS1148  10.523  -5.858   3.944
  320   1HE   LYS1148           HE2      LYS1148  10.361  -8.106   4.869
  321   2HE   LYS1148           HE1      LYS1148   8.807  -7.274   4.949
  322   1HZ   LYS1148           HZ1      LYS1148   8.104  -8.478   2.973
  323   2HZ   LYS1148           HZ3      LYS1148   9.592  -9.279   2.902
  324   3HZ   LYS1148           HZ2      LYS1148   8.546  -9.552   4.202
  325    H    ARG1149           HN       ARG1149  12.237  -7.287   1.036
  326    HA   ARG1149           HA       ARG1149  14.178  -5.448   2.255
  327   1HB   ARG1149           HB2      ARG1149  13.466  -7.367   3.628
  328   2HB   ARG1149           HB1      ARG1149  14.026  -8.467   2.378
  329   1HG   ARG1149           HG2      ARG1149  16.313  -7.675   2.694
  330   2HG   ARG1149           HG1      ARG1149  15.754  -6.568   3.950
  331   1HD   ARG1149           HD2      ARG1149  16.705  -8.583   4.931
  332   2HD   ARG1149           HD1      ARG1149  14.982  -8.464   5.284
  333    HE   ARG1149           HE       ARG1149  15.227  -9.991   2.985
  334   1HH1  ARG1149          1HH1      ARG1149  16.203 -10.183   6.324
  335   2HH1  ARG1149          2HH1      ARG1149  16.164 -11.914   6.369
  336   1HH2  ARG1149          1HH2      ARG1149  15.174 -12.270   3.035
  337   2HH2  ARG1149          2HH2      ARG1149  15.580 -13.101   4.499
  338    H    ILE1150           HN       ILE1150  16.025  -4.968   1.199
  339    HA   ILE1150           HA       ILE1150  16.964  -6.805  -0.883
  340    HB   ILE1150           HB       ILE1150  17.174  -5.192  -2.559
  341   1HG1  ILE1150          2HG1      ILE1150  18.088  -3.328  -1.358
  342   2HG1  ILE1150          1HG1      ILE1150  16.639  -2.767  -2.182
  343   1HG2  ILE1150          3HG2      ILE1150  14.557  -4.678  -1.160
  344   2HG2  ILE1150          2HG2      ILE1150  14.909  -4.285  -2.844
  345   3HG2  ILE1150          1HG2      ILE1150  14.901  -5.967  -2.313
  346   1HD1  ILE1150          2HD1      ILE1150  15.394  -2.932  -0.082
  347   2HD1  ILE1150          1HD1      ILE1150  16.867  -3.452   0.736
  348   3HD1  ILE1150          3HD1      ILE1150  16.772  -1.835   0.036
  349    H    THR1151           HN       THR1151  19.025  -5.334  -1.900
  350    HA   THR1151           HA       THR1151  20.717  -4.394   0.253
  351    HB   THR1151           HB       THR1151  21.461  -6.872  -1.318
  352    HG1  THR1151           HG1      THR1151  20.849  -7.959   0.401
  353   1HG2  THR1151          2HG2      THR1151  23.380  -5.400  -0.885
  354   2HG2  THR1151          1HG2      THR1151  22.991  -5.406   0.835
  355   3HG2  THR1151          3HG2      THR1151  23.487  -6.899   0.038
  356    H    CYS1152           HN       CYS1152  22.076  -2.854  -0.505
  357    HA   CYS1152           HA       CYS1152  21.971  -2.079  -3.229
  358   1HB   CYS1152           HB2      CYS1152  23.498  -0.327  -2.645
  359   2HB   CYS1152           HB1      CYS1152  22.361  -0.518  -1.319
  360    H    ARG1153           HN       ARG1153  23.503  -2.175  -4.834
  361    HA   ARG1153           HA       ARG1153  25.894  -3.791  -4.334
  362   1HB   ARG1153           HB2      ARG1153  25.507  -5.110  -6.360
  363   2HB   ARG1153           HB1      ARG1153  24.211  -5.334  -5.197
  364   1HG   ARG1153           HG2      ARG1153  24.012  -3.423  -7.504
  365   2HG   ARG1153           HG1      ARG1153  23.518  -5.113  -7.604
  366   1HD   ARG1153           HD2      ARG1153  21.966  -4.728  -5.714
  367   2HD   ARG1153           HD1      ARG1153  22.408  -3.019  -5.737
  368    HE   ARG1153           HE       ARG1153  21.322  -2.805  -7.837
  369   1HH1  ARG1153          1HH1      ARG1153  20.934  -5.942  -6.369
  370   2HH1  ARG1153          2HH1      ARG1153  19.561  -6.365  -7.334
  371   1HH2  ARG1153          1HH2      ARG1153  19.514  -3.355  -9.112
  372   2HH2  ARG1153          2HH2      ARG1153  18.754  -4.896  -8.894
  373    H    ASN1154           HN       ASN1154  27.614  -2.721  -5.005
  374    HA   ASN1154           HA       ASN1154  28.973  -1.277  -6.119
  375   1HB   ASN1154           HB2      ASN1154  27.070  -1.857  -8.401
  376   2HB   ASN1154           HB1      ASN1154  28.645  -1.085  -8.565
  377   1HD2  ASN1154          1HD2      ASN1154  26.956  -4.048  -7.923
  378   2HD2  ASN1154          2HD2      ASN1154  28.312  -5.100  -8.112
  379    H    GLY1155           HN       GLY1155  27.026  -0.090  -4.532
  380   1HA   GLY1155           HA1      GLY1155  27.077   2.565  -5.458
  381   2HA   GLY1155           HA2      GLY1155  26.135   1.977  -4.098
  382    H    GLN1156           HN       GLN1156  24.325   0.304  -5.216
  383    HA   GLN1156           HA       GLN1156  22.456   2.105  -6.358
  384   1HB   GLN1156           HB2      GLN1156  23.805   1.712  -8.375
  385   2HB   GLN1156           HB1      GLN1156  23.552  -0.020  -8.210
  386   1HG   GLN1156           HG2      GLN1156  21.150   0.301  -8.534
  387   2HG   GLN1156           HG1      GLN1156  21.412   2.036  -8.713
  388   1HE2  GLN1156          1HE2      GLN1156  22.398   2.822 -10.572
  389   2HE2  GLN1156          2HE2      GLN1156  22.542   1.870 -12.007
  390    H    TRP1157           HN       TRP1157  21.107   1.372  -4.748
  391    HA   TRP1157           HA       TRP1157  20.621  -1.269  -4.020
  392   1HB   TRP1157           HB2      TRP1157  18.839   1.160  -3.889
  393   2HB   TRP1157           HB1      TRP1157  18.421  -0.385  -3.159
  394    HD1  TRP1157           HD1      TRP1157  20.897   2.514  -2.782
  395    HE1  TRP1157           HE1      TRP1157  21.848   2.455  -0.389
  396    HE3  TRP1157           HE3      TRP1157  18.884  -1.908  -1.243
  397    HZ2  TRP1157           HZ2      TRP1157  21.763   0.728   1.855
  398    HZ3  TRP1157           HZ3      TRP1157  19.367  -2.707   1.030
  399    HH2  TRP1157           HH2      TRP1157  20.775  -1.421   2.544
  400    H    SER1158           HN       SER1158  18.470  -2.360  -4.214
  401    HA   SER1158           HA       SER1158  17.608  -2.372  -7.025
  402   1HB   SER1158           HB2      SER1158  16.771  -4.682  -6.492
  403   2HB   SER1158           HB1      SER1158  18.519  -4.501  -6.367
  404    HG   SER1158           HG       SER1158  16.604  -4.813  -4.343
  405    H    GLU1159           HN       GLU1159  15.638  -1.651  -7.481
  406    HA   GLU1159           HA       GLU1159  13.886  -0.575  -5.594
  407   1HB   GLU1159           HB2      GLU1159  13.904   0.115  -7.935
  408   2HB   GLU1159           HB1      GLU1159  13.335  -1.473  -8.426
  409   1HG   GLU1159           HG2      GLU1159  11.238  -1.093  -7.239
  410   2HG   GLU1159           HG1      GLU1159  11.810   0.498  -6.740
  411    HA   PRO1160           HA       PRO1160  11.722  -4.097  -3.969
  412   1HB   PRO1160           HB2      PRO1160   9.348  -2.878  -3.346
  413   2HB   PRO1160           HB1      PRO1160  10.804  -2.760  -2.356
  414   1HG   PRO1160           HG2      PRO1160   9.719  -0.831  -4.370
  415   2HG   PRO1160           HG1      PRO1160  10.412  -0.507  -2.770
  416   1HD   PRO1160           HD2      PRO1160  11.831  -0.140  -5.016
  417   2HD   PRO1160           HD1      PRO1160  12.584  -0.739  -3.521
  418    HA   PRO1161           HA       PRO1161   9.074  -5.934  -6.973
  419   1HB   PRO1161           HB2      PRO1161   7.005  -6.328  -4.874
  420   2HB   PRO1161           HB1      PRO1161   7.759  -7.510  -5.950
  421   1HG   PRO1161           HG2      PRO1161   8.450  -7.390  -3.385
  422   2HG   PRO1161           HG1      PRO1161   9.672  -7.675  -4.639
  423   1HD   PRO1161           HD2      PRO1161   9.052  -5.170  -3.125
  424   2HD   PRO1161           HD1      PRO1161  10.626  -5.830  -3.619
  425    H    LYS1162           HN       LYS1162   6.534  -4.618  -4.804
  426    HA   LYS1162           HA       LYS1162   5.972  -2.367  -6.436
  427   1HB   LYS1162           HB2      LYS1162   5.306  -4.353  -7.918
  428   2HB   LYS1162           HB1      LYS1162   3.955  -4.562  -6.812
  429   1HG   LYS1162           HG2      LYS1162   3.235  -3.303  -8.723
  430   2HG   LYS1162           HG1      LYS1162   3.229  -2.260  -7.300
  431   1HD   LYS1162           HD2      LYS1162   5.383  -1.318  -7.981
  432   2HD   LYS1162           HD1      LYS1162   5.392  -2.363  -9.404
  433   1HE   LYS1162           HE2      LYS1162   3.356  -0.227  -8.783
  434   2HE   LYS1162           HE1      LYS1162   4.656  -0.104  -9.968
  435   1HZ   LYS1162           HZ1      LYS1162   2.416  -2.053 -10.058
  436   2HZ   LYS1162           HZ3      LYS1162   2.556  -0.665 -11.015
  437   3HZ   LYS1162           HZ2      LYS1162   3.662  -1.932 -11.195
  438    H    CYS1163           HN       CYS1163   3.890  -1.327  -5.927
  439    HA   CYS1163           HA       CYS1163   3.151  -1.824  -3.131
  440   1HB   CYS1163           HB2      CYS1163   2.839   0.609  -4.899
  441   2HB   CYS1163           HB1      CYS1163   2.160   0.491  -3.280
  442    H    LEU1164           HN       LEU1164   0.890  -1.573  -2.521
  443    HA   LEU1164           HA       LEU1164  -0.970  -2.269  -4.697
  444   1HB   LEU1164           HB2      LEU1164  -0.475  -3.590  -2.095
  445   2HB   LEU1164           HB1      LEU1164  -2.153  -3.429  -2.573
  446    HG   LEU1164           HG       LEU1164  -1.169  -5.607  -3.207
  447   1HD1  LEU1164          3HD1      LEU1164  -1.940  -3.845  -5.528
  448   2HD1  LEU1164          2HD1      LEU1164  -1.954  -5.608  -5.523
  449   3HD1  LEU1164          1HD1      LEU1164  -3.047  -4.715  -4.466
  450   1HD2  LEU1164          1HD2      LEU1164   1.117  -4.859  -3.624
  451   2HD2  LEU1164          3HD2      LEU1164   0.459  -5.724  -5.013
  452   3HD2  LEU1164          2HD2      LEU1164   0.568  -3.964  -5.042
  453    H    HIS1165           HN       HIS1165  -2.424  -0.731  -4.969
  454    HA   HIS1165           HA       HIS1165  -2.850   1.477  -3.396
  455   1HB   HIS1165           HB2      HIS1165  -4.870   0.085  -5.169
  456   2HB   HIS1165           HB1      HIS1165  -5.010   1.737  -4.576
  457    HD1  HIS1165           HD1      HIS1165  -3.807   3.538  -5.861
  458    HD2  HIS1165           HD2      HIS1165  -2.763  -0.293  -7.089
  459    HE1  HIS1165           HE1      HIS1165  -2.438   3.850  -7.947
  460    HE2  HIS1165           HE2      HIS1165  -1.879   1.516  -8.714
  461    HA   PRO1166           HA       PRO1166  -4.909  -0.138   0.182
  462   1HB   PRO1166           HB2      PRO1166  -5.809   2.204   1.214
  463   2HB   PRO1166           HB1      PRO1166  -4.116   1.703   1.303
  464   1HG   PRO1166           HG2      PRO1166  -5.438   3.594  -0.607
  465   2HG   PRO1166           HG1      PRO1166  -3.880   3.753   0.227
  466   1HD   PRO1166           HD2      PRO1166  -4.078   2.968  -2.358
  467   2HD   PRO1166           HD1      PRO1166  -2.796   2.388  -1.280
  468    H    CYS1167           HN       CYS1167  -7.106   0.506   1.369
  469    HA   CYS1167           HA       CYS1167  -9.179  -0.255  -0.421
  470   1HB   CYS1167           HB2      CYS1167  -8.911  -0.717   2.125
  471   2HB   CYS1167           HB1      CYS1167  -9.676   0.857   2.319
  472    H    VAL1168           HN       VAL1168  -8.815   1.633  -1.897
  473    HA   VAL1168           HA       VAL1168 -10.092   4.084  -0.930
  474    HB   VAL1168           HB       VAL1168  -7.984   4.501  -1.993
  475   1HG1  VAL1168          3HG1      VAL1168  -9.068   3.018  -4.384
  476   2HG1  VAL1168          2HG1      VAL1168  -7.531   3.881  -4.320
  477   3HG1  VAL1168          1HG1      VAL1168  -7.790   2.464  -3.303
  478   1HG2  VAL1168          3HG2      VAL1168 -10.253   5.254  -3.829
  479   2HG2  VAL1168          2HG2      VAL1168  -9.717   6.147  -2.407
  480   3HG2  VAL1168          1HG2      VAL1168  -8.658   6.009  -3.811
  481    H    ILE1169           HN       ILE1169 -12.223   3.256  -0.929
  482    HA   ILE1169           HA       ILE1169 -13.344   2.484  -3.509
  483    HB   ILE1169           HB       ILE1169 -14.250   2.232  -0.690
  484   1HG1  ILE1169          2HG1      ILE1169 -14.010   0.522  -3.137
  485   2HG1  ILE1169          1HG1      ILE1169 -13.353   0.258  -1.525
  486   1HG2  ILE1169          2HG2      ILE1169 -16.086   3.480  -1.719
  487   2HG2  ILE1169          1HG2      ILE1169 -16.185   2.274  -2.999
  488   3HG2  ILE1169          3HG2      ILE1169 -16.561   1.827  -1.336
  489   1HD1  ILE1169          1HD1      ILE1169 -16.262   0.025  -2.266
  490   2HD1  ILE1169          3HD1      ILE1169 -15.137  -1.321  -2.091
  491   3HD1  ILE1169          2HD1      ILE1169 -15.542  -0.326  -0.694
  492    H    SER1170           HN       SER1170 -14.964   3.583  -4.550
  493    HA   SER1170           HA       SER1170 -14.870   6.384  -4.454
  494   1HB   SER1170           HB2      SER1170 -16.982   4.594  -5.676
  495   2HB   SER1170           HB1      SER1170 -16.774   6.310  -6.024
  496    HG   SER1170           HG       SER1170 -15.167   4.135  -6.751
  497    H    ARG1171           HN       ARG1171 -15.737   7.765  -3.075
  498    HA   ARG1171           HA       ARG1171 -17.649   6.942  -1.098
  499   1HB   ARG1171           HB2      ARG1171 -17.524   9.331  -0.377
  500   2HB   ARG1171           HB1      ARG1171 -15.963   8.527  -0.454
  501   1HG   ARG1171           HG2      ARG1171 -15.489   9.602  -2.580
  502   2HG   ARG1171           HG1      ARG1171 -17.075  10.374  -2.557
  503   1HD   ARG1171           HD2      ARG1171 -14.865  10.797  -0.550
  504   2HD   ARG1171           HD1      ARG1171 -15.333  11.918  -1.828
  505    HE   ARG1171           HE       ARG1171 -17.597  11.402  -0.290
  506   1HH1  ARG1171          1HH1      ARG1171 -14.468  12.891   0.080
  507   2HH1  ARG1171          2HH1      ARG1171 -14.998  14.002   1.299
  508   1HH2  ARG1171          1HH2      ARG1171 -18.303  12.861   1.313
  509   2HH2  ARG1171          2HH2      ARG1171 -17.178  13.984   1.999
  510    H    GLU1172           HN       GLU1172 -17.721   9.294  -3.776
  511    HA   GLU1172           HA       GLU1172 -20.441   9.972  -3.469
  512   1HB   GLU1172           HB2      GLU1172 -18.695  10.128  -5.932
  513   2HB   GLU1172           HB1      GLU1172 -20.248  10.929  -5.735
  514   1HG   GLU1172           HG2      GLU1172 -17.783  11.440  -4.085
  515   2HG   GLU1172           HG1      GLU1172 -18.390  12.463  -5.387
  516    H    ILE1173           HN       ILE1173 -19.311   7.026  -4.088
  517    HA   ILE1173           HA       ILE1173 -21.434   6.355  -6.003
  518    HB   ILE1173           HB       ILE1173 -18.747   5.174  -5.495
  519   1HG1  ILE1173          2HG1      ILE1173 -18.903   4.943  -8.017
  520   2HG1  ILE1173          1HG1      ILE1173 -20.426   5.821  -7.912
  521   1HG2  ILE1173          2HG2      ILE1173 -21.075   3.612  -6.579
  522   2HG2  ILE1173          1HG2      ILE1173 -19.386   3.113  -6.653
  523   3HG2  ILE1173          3HG2      ILE1173 -20.188   3.280  -5.092
  524   1HD1  ILE1173          2HD1      ILE1173 -19.265   7.711  -6.918
  525   2HD1  ILE1173          1HD1      ILE1173 -17.743   6.830  -7.034
  526   3HD1  ILE1173          3HD1      ILE1173 -18.605   7.295  -8.500
  527    H    MET1174           HN       MET1174 -19.808   4.961  -3.116
  528    HA   MET1174           HA       MET1174 -22.021   3.194  -2.670
  529   1HB   MET1174           HB2      MET1174 -20.734   2.164  -1.079
  530   2HB   MET1174           HB1      MET1174 -19.474   2.901  -2.055
  531   1HG   MET1174           HG2      MET1174 -18.791   3.395   0.077
  532   2HG   MET1174           HG1      MET1174 -19.657   4.860  -0.379
  533   1HE   MET1174           HE3      MET1174 -18.932   4.068   2.638
  534   2HE   MET1174           HE2      MET1174 -19.786   5.547   2.200
  535   3HE   MET1174           HE1      MET1174 -20.435   4.494   3.456
  536    H    GLU1175           HN       GLU1175 -20.711   6.041  -0.953
  537    HA   GLU1175           HA       GLU1175 -22.831   6.090   0.938
  538   1HB   GLU1175           HB2      GLU1175 -21.784   7.904   1.865
  539   2HB   GLU1175           HB1      GLU1175 -20.430   7.244   0.953
  540   1HG   GLU1175           HG2      GLU1175 -20.814   8.845  -0.823
  541   2HG   GLU1175           HG1      GLU1175 -22.236   9.467   0.011
  542    H    ASN1176           HN       ASN1176 -23.080   6.395  -2.235
  543    HA   ASN1176           HA       ASN1176 -25.222   8.403  -2.086
  544   1HB   ASN1176           HB2      ASN1176 -22.961   8.188  -3.889
  545   2HB   ASN1176           HB1      ASN1176 -24.489   8.213  -4.757
  546   1HD2  ASN1176          1HD2      ASN1176 -22.365  10.211  -4.623
  547   2HD2  ASN1176          2HD2      ASN1176 -23.110  11.662  -4.055
  548    H    TYR1177           HN       TYR1177 -24.216   5.249  -3.250
  549    HA   TYR1177           HA       TYR1177 -26.690   4.816  -4.699
  550   1HB   TYR1177           HB2      TYR1177 -24.290   3.070  -4.151
  551   2HB   TYR1177           HB1      TYR1177 -25.738   2.457  -4.938
  552    HD1  TYR1177           HD1      TYR1177 -25.960   5.447  -6.288
  553    HD2  TYR1177           HD2      TYR1177 -23.135   2.267  -6.229
  554    HE1  TYR1177           HE1      TYR1177 -25.086   6.189  -8.463
  555    HE2  TYR1177           HE2      TYR1177 -22.252   2.998  -8.399
  556    HH   TYR1177           HH       TYR1177 -23.015   6.005  -9.777
  557    H    ASN1178           HN       ASN1178 -26.961   5.417  -1.923
  558    HA   ASN1178           HA       ASN1178 -28.228   4.752  -0.171
  559   1HB   ASN1178           HB2      ASN1178 -28.799   2.240  -1.753
  560   2HB   ASN1178           HB1      ASN1178 -29.740   2.882  -0.411
  561   1HD2  ASN1178          1HD2      ASN1178 -30.564   2.278  -3.132
  562   2HD2  ASN1178          2HD2      ASN1178 -31.194   3.749  -3.782
  563    H    ILE1179           HN       ILE1179 -25.354   4.002  -0.482
  564    HA   ILE1179           HA       ILE1179 -25.347   1.700   1.364
  565    HB   ILE1179           HB       ILE1179 -22.837   2.562   0.012
  566   1HG1  ILE1179          2HG1      ILE1179 -24.919   0.810  -1.313
  567   2HG1  ILE1179          1HG1      ILE1179 -24.472   2.433  -1.832
  568   1HG2  ILE1179          1HG2      ILE1179 -23.962  -0.092   0.882
  569   2HG2  ILE1179          3HG2      ILE1179 -22.377   0.142   0.142
  570   3HG2  ILE1179          2HG2      ILE1179 -22.731   0.861   1.713
  571   1HD1  ILE1179          1HD1      ILE1179 -22.175   1.634  -2.246
  572   2HD1  ILE1179          3HD1      ILE1179 -22.692   0.006  -1.811
  573   3HD1  ILE1179          2HD1      ILE1179 -23.382   0.801  -3.226
  574    H    ALA1180           HN       ALA1180 -23.787   1.722   3.067
  575    HA   ALA1180           HA       ALA1180 -22.625   4.303   3.775
  576   1HB   ALA1180           HB2      ALA1180 -24.697   4.404   4.951
  577   2HB   ALA1180           HB1      ALA1180 -24.526   2.742   5.517
  578   3HB   ALA1180           HB3      ALA1180 -23.449   3.996   6.130
  579    H    LEU1181           HN       LEU1181 -22.178   2.939   6.541
  580    HA   LEU1181           HA       LEU1181 -20.451   0.747   5.779
  581   1HB   LEU1181           HB2      LEU1181 -19.243   2.990   5.416
  582   2HB   LEU1181           HB1      LEU1181 -19.161   3.062   7.164
  583    HG   LEU1181           HG       LEU1181 -18.234   0.507   6.126
  584   1HD1  LEU1181          1HD1      LEU1181 -17.592   1.865   4.212
  585   2HD1  LEU1181          3HD1      LEU1181 -16.774   3.003   5.282
  586   3HD1  LEU1181          2HD1      LEU1181 -16.173   1.351   5.127
  587   1HD2  LEU1181          2HD2      LEU1181 -16.959   2.646   7.825
  588   2HD2  LEU1181          1HD2      LEU1181 -17.862   1.247   8.407
  589   3HD2  LEU1181          3HD2      LEU1181 -16.325   1.019   7.573
  590    H    ARG1182           HN       ARG1182 -21.803  -0.413   7.174
  591    HA   ARG1182           HA       ARG1182 -22.618  -1.231   9.141
  592   1HB   ARG1182           HB2      ARG1182 -20.296  -2.079   9.017
  593   2HB   ARG1182           HB1      ARG1182 -19.767  -0.709   9.985
  594   1HG   ARG1182           HG2      ARG1182 -20.862  -1.489  11.897
  595   2HG   ARG1182           HG1      ARG1182 -21.860  -2.613  10.973
  596   1HD   ARG1182           HD2      ARG1182 -20.064  -3.747  12.223
  597   2HD   ARG1182           HD1      ARG1182 -19.936  -3.984  10.481
  598    HE   ARG1182           HE       ARG1182 -18.345  -1.830  10.989
  599   1HH1  ARG1182          1HH1      ARG1182 -18.517  -5.094  12.193
  600   2HH1  ARG1182          2HH1      ARG1182 -16.817  -5.205  12.506
  601   1HH2  ARG1182          1HH2      ARG1182 -16.106  -1.967  11.395
  602   2HH2  ARG1182          2HH2      ARG1182 -15.447  -3.428  12.053
  603    H    TRP1183           HN       TRP1183 -20.257   0.903  10.644
  604    HA   TRP1183           HA       TRP1183 -22.070   1.752  12.651
  605   1HB   TRP1183           HB2      TRP1183 -19.829   3.551  12.332
  606   2HB   TRP1183           HB1      TRP1183 -20.202   2.462  13.665
  607    HD1  TRP1183           HD1      TRP1183 -19.581  -0.317  12.802
  608    HE1  TRP1183           HE1      TRP1183 -17.303  -1.064  11.855
  609    HE3  TRP1183           HE3      TRP1183 -17.801   4.225  11.303
  610    HZ2  TRP1183           HZ2      TRP1183 -15.054   0.115  10.652
  611    HZ3  TRP1183           HZ3      TRP1183 -15.570   4.335  10.264
  612    HH2  TRP1183           HH2      TRP1183 -14.225   2.320   9.945
  613    H    THR1184           HN       THR1184 -21.990   2.535   9.482
  614    HA   THR1184           HA       THR1184 -22.691   4.273   8.190
  615    HB   THR1184           HB       THR1184 -24.761   5.370   8.928
  616    HG1  THR1184           HG1      THR1184 -24.797   3.924  11.321
  617   1HG2  THR1184          2HG2      THR1184 -24.643   2.420   9.573
  618   2HG2  THR1184          1HG2      THR1184 -26.118   3.336   9.262
  619   3HG2  THR1184          3HG2      THR1184 -24.920   3.134   7.985
  620    H    ALA1185           HN       ALA1185 -20.578   5.312   8.531
  621    HA   ALA1185           HA       ALA1185 -20.777   7.768  10.142
  622   1HB   ALA1185           HB2      ALA1185 -18.297   6.351   9.177
  623   2HB   ALA1185           HB3      ALA1185 -18.957   6.274  10.810
  624   3HB   ALA1185           HB1      ALA1185 -18.343   7.801  10.179
  625    H    LYS1186           HN       LYS1186 -21.305   6.825   7.124
  626    HA   LYS1186           HA       LYS1186 -21.498   7.912   5.146
  627   1HB   LYS1186           HB2      LYS1186 -20.523  10.287   6.732
  628   2HB   LYS1186           HB1      LYS1186 -21.109  10.370   5.077
  629   1HG   LYS1186           HG2      LYS1186 -22.694   9.538   7.500
  630   2HG   LYS1186           HG1      LYS1186 -22.835  11.062   6.621
  631   1HD   LYS1186           HD2      LYS1186 -23.529   9.817   4.613
  632   2HD   LYS1186           HD1      LYS1186 -23.437   8.312   5.532
  633   1HE   LYS1186           HE2      LYS1186 -25.249  10.646   6.137
  634   2HE   LYS1186           HE1      LYS1186 -25.737   9.129   5.383
  635   1HZ   LYS1186           HZ2      LYS1186 -25.093   7.963   7.400
  636   2HZ   LYS1186           HZ1      LYS1186 -24.629   9.419   8.123
  637   3HZ   LYS1186           HZ3      LYS1186 -26.253   9.145   7.737
  638    H    GLN1187           HN       GLN1187 -20.115   7.001   3.823
  639    HA   GLN1187           HA       GLN1187 -18.318   6.842   2.428
  640   1HB   GLN1187           HB2      GLN1187 -18.011   9.257   2.498
  641   2HB   GLN1187           HB1      GLN1187 -17.204   9.138   4.055
  642   1HG   GLN1187           HG2      GLN1187 -15.436   7.772   2.938
  643   2HG   GLN1187           HG1      GLN1187 -16.205   8.155   1.398
  644   1HE2  GLN1187          1HE2      GLN1187 -16.086  10.411   4.048
  645   2HE2  GLN1187          2HE2      GLN1187 -14.974  11.514   3.319
  646    H    LYS1188           HN       LYS1188 -16.225   7.910   4.989
  647    HA   LYS1188           HA       LYS1188 -14.460   6.737   5.933
  648   1HB   LYS1188           HB2      LYS1188 -16.774   6.605   7.291
  649   2HB   LYS1188           HB1      LYS1188 -16.488   4.889   7.068
  650   1HG   LYS1188           HG2      LYS1188 -14.619   6.866   8.377
  651   2HG   LYS1188           HG1      LYS1188 -15.608   5.660   9.202
  652   1HD   LYS1188           HD2      LYS1188 -14.335   3.873   8.317
  653   2HD   LYS1188           HD1      LYS1188 -13.526   4.930   7.158
  654   1HE   LYS1188           HE2      LYS1188 -12.057   4.357   9.026
  655   2HE   LYS1188           HE1      LYS1188 -12.397   6.087   8.975
  656   1HZ   LYS1188           HZ1      LYS1188 -14.096   5.726  10.695
  657   2HZ   LYS1188           HZ3      LYS1188 -13.647   4.097  10.788
  658   3HZ   LYS1188           HZ2      LYS1188 -12.545   5.304  11.222
  659    H    LEU1189           HN       LEU1189 -14.861   5.778   3.313
  660    HA   LEU1189           HA       LEU1189 -14.657   2.864   3.537
  661   1HB   LEU1189           HB2      LEU1189 -14.610   3.306   0.886
  662   2HB   LEU1189           HB1      LEU1189 -16.082   3.086   1.815
  663    HG   LEU1189           HG       LEU1189 -16.275   5.560   2.013
  664   1HD1  LEU1189          1HD1      LEU1189 -13.854   6.002   1.713
  665   2HD1  LEU1189          3HD1      LEU1189 -14.041   5.624   0.000
  666   3HD1  LEU1189          2HD1      LEU1189 -14.898   7.000   0.696
  667   1HD2  LEU1189          1HD2      LEU1189 -17.423   4.255   0.240
  668   2HD2  LEU1189          3HD2      LEU1189 -17.083   5.926  -0.208
  669   3HD2  LEU1189          2HD2      LEU1189 -16.078   4.623  -0.840
  670    H    TYR1190           HN       TYR1190 -12.481   3.969   4.589
  671    HA   TYR1190           HA       TYR1190 -10.434   3.522   2.527
  672   1HB   TYR1190           HB2      TYR1190 -10.686   5.772   4.466
  673   2HB   TYR1190           HB1      TYR1190  -9.073   5.187   4.074
  674    HD1  TYR1190           HD1      TYR1190 -12.150   5.715   1.999
  675    HD2  TYR1190           HD2      TYR1190  -8.045   6.657   2.641
  676    HE1  TYR1190           HE1      TYR1190 -12.144   7.086  -0.045
  677    HE2  TYR1190           HE2      TYR1190  -8.032   8.025   0.600
  678    HH   TYR1190           HH       TYR1190  -9.294   8.209  -1.503
  679    H    SER1191           HN       SER1191  -9.038   1.981   3.002
  680    HA   SER1191           HA       SER1191  -8.315   1.423   5.776
  681   1HB   SER1191           HB2      SER1191  -9.518  -0.629   3.902
  682   2HB   SER1191           HB1      SER1191  -8.649  -1.047   5.377
  683    HG   SER1191           HG       SER1191 -10.959   0.605   5.256
  684    H    ARG1192           HN       ARG1192  -6.656  -0.479   5.744
  685    HA   ARG1192           HA       ARG1192  -4.639   0.211   3.752
  686   1HB   ARG1192           HB2      ARG1192  -4.108   0.078   6.227
  687   2HB   ARG1192           HB1      ARG1192  -4.367  -1.656   6.117
  688   1HG   ARG1192           HG2      ARG1192  -2.567  -1.799   4.446
  689   2HG   ARG1192           HG1      ARG1192  -2.280  -0.068   4.635
  690   1HD   ARG1192           HD2      ARG1192  -2.036  -2.151   6.802
  691   2HD   ARG1192           HD1      ARG1192  -0.697  -1.385   5.949
  692    HE   ARG1192           HE       ARG1192  -2.243   0.641   7.067
  693   1HH1  ARG1192          1HH1      ARG1192  -0.269  -2.026   8.133
  694   2HH1  ARG1192          2HH1      ARG1192   0.188  -1.262   9.619
  695   1HH2  ARG1192          1HH2      ARG1192  -1.646   1.654   9.020
  696   2HH2  ARG1192          2HH2      ARG1192  -0.595   0.830  10.123
  697    H    THR1193           HN       THR1193  -4.101  -1.143   2.100
  698    HA   THR1193           HA       THR1193  -5.747  -3.117   1.208
  699    HB   THR1193           HB       THR1193  -2.748  -3.191   0.815
  700    HG1  THR1193           HG1      THR1193  -3.430  -1.950  -1.151
  701   1HG2  THR1193          1HG2      THR1193  -5.022  -4.173  -0.911
  702   2HG2  THR1193          3HG2      THR1193  -3.311  -4.222  -1.337
  703   3HG2  THR1193          2HG2      THR1193  -3.911  -5.183   0.014
  704    H    GLY1194           HN       GLY1194  -6.489  -4.660   2.515
  705   1HA   GLY1194           HA1      GLY1194  -4.614  -6.211   4.149
  706   2HA   GLY1194           HA2      GLY1194  -5.585  -7.069   2.959
  707    H    GLU1195           HN       GLU1195  -6.695  -4.282   4.771
  708    HA   GLU1195           HA       GLU1195  -8.129  -5.850   6.714
  709   1HB   GLU1195           HB2      GLU1195  -8.273  -2.898   6.069
  710   2HB   GLU1195           HB1      GLU1195  -9.037  -3.671   7.451
  711   1HG   GLU1195           HG2      GLU1195  -6.841  -4.321   8.301
  712   2HG   GLU1195           HG1      GLU1195  -6.077  -3.536   6.919
  713    H    SER1196           HN       SER1196 -10.399  -6.013   6.904
  714    HA   SER1196           HA       SER1196 -11.761  -5.935   4.317
  715   1HB   SER1196           HB2      SER1196 -13.397  -7.444   5.344
  716   2HB   SER1196           HB1      SER1196 -11.760  -8.069   5.545
  717    HG   SER1196           HG       SER1196 -13.208  -6.609   7.502
  718    H    VAL1197           HN       VAL1197 -13.404  -4.611   3.875
  719    HA   VAL1197           HA       VAL1197 -14.369  -2.854   6.031
  720    HB   VAL1197           HB       VAL1197 -14.259  -2.407   3.046
  721   1HG1  VAL1197          3HG1      VAL1197 -16.351  -1.505   3.914
  722   2HG1  VAL1197          2HG1      VAL1197 -15.468  -0.635   5.168
  723   3HG1  VAL1197          1HG1      VAL1197 -15.243  -0.205   3.472
  724   1HG2  VAL1197          2HG2      VAL1197 -12.148  -2.073   4.215
  725   2HG2  VAL1197          1HG2      VAL1197 -12.800  -0.536   3.648
  726   3HG2  VAL1197          3HG2      VAL1197 -12.938  -0.978   5.349
  727    H    GLU1198           HN       GLU1198 -16.550  -2.598   6.383
  728    HA   GLU1198           HA       GLU1198 -18.338  -4.317   4.798
  729   1HB   GLU1198           HB2      GLU1198 -18.044  -5.491   6.828
  730   2HB   GLU1198           HB1      GLU1198 -18.138  -4.021   7.787
  731   1HG   GLU1198           HG2      GLU1198 -20.462  -3.847   7.483
  732   2HG   GLU1198           HG1      GLU1198 -20.465  -5.054   6.196
  733    H    PHE1199           HN       PHE1199 -19.434  -2.816   3.605
  734    HA   PHE1199           HA       PHE1199 -20.341  -0.349   4.802
  735   1HB   PHE1199           HB2      PHE1199 -21.077  -1.553   2.127
  736   2HB   PHE1199           HB1      PHE1199 -21.346   0.109   2.631
  737    HD1  PHE1199           HD1      PHE1199 -19.518   1.700   2.707
  738    HD2  PHE1199           HD2      PHE1199 -18.903  -2.322   1.468
  739    HE1  PHE1199           HE1      PHE1199 -17.345   2.338   1.737
  740    HE2  PHE1199           HE2      PHE1199 -16.734  -1.697   0.503
  741    HZ   PHE1199           HZ       PHE1199 -15.949   0.633   0.640
  742    H    VAL1200           HN       VAL1200 -22.724   0.247   4.423
  743    HA   VAL1200           HA       VAL1200 -24.510  -2.037   4.906
  744    HB   VAL1200           HB       VAL1200 -25.773  -0.465   6.527
  745   1HG1  VAL1200          3HG1      VAL1200 -23.189  -1.807   7.302
  746   2HG1  VAL1200          2HG1      VAL1200 -24.445  -1.303   8.434
  747   3HG1  VAL1200          1HG1      VAL1200 -24.788  -2.548   7.232
  748   1HG2  VAL1200          3HG2      VAL1200 -23.016   0.741   6.604
  749   2HG2  VAL1200          2HG2      VAL1200 -24.524   1.548   6.178
  750   3HG2  VAL1200          1HG2      VAL1200 -24.254   1.000   7.832
  751    H    CYS1201           HN       CYS1201 -26.821  -0.423   5.330
  752    HA   CYS1201           HA       CYS1201 -27.059   0.730   2.635
  753   1HB   CYS1201           HB2      CYS1201 -29.430  -0.213   4.205
  754   2HB   CYS1201           HB1      CYS1201 -29.241  -0.040   2.464
  755    H    LYS1202           HN       LYS1202 -27.663   2.754   2.402
  756    HA   LYS1202           HA       LYS1202 -27.535   4.689   4.293
  757   1HB   LYS1202           HB2      LYS1202 -27.714   4.993   1.814
  758   2HB   LYS1202           HB1      LYS1202 -29.444   4.722   1.951
  759   1HG   LYS1202           HG2      LYS1202 -29.596   6.698   3.428
  760   2HG   LYS1202           HG1      LYS1202 -27.878   6.993   3.148
  761   1HD   LYS1202           HD2      LYS1202 -30.037   6.919   1.038
  762   2HD   LYS1202           HD1      LYS1202 -29.252   8.367   1.667
  763   1HE   LYS1202           HE2      LYS1202 -27.104   7.593   0.812
  764   2HE   LYS1202           HE1      LYS1202 -27.875   6.135   0.188
  765   1HZ   LYS1202           HZ2      LYS1202 -28.487   8.913  -0.668
  766   2HZ   LYS1202           HZ1      LYS1202 -27.575   7.790  -1.545
  767   3HZ   LYS1202           HZ3      LYS1202 -29.221   7.513  -1.269
  768    H    ARG1203           HN       ARG1203 -28.499   4.328   6.231
  769    HA   ARG1203           HA       ARG1203 -30.411   3.307   7.423
  770   1HB   ARG1203           HB2      ARG1203 -30.261   6.304   7.249
  771   2HB   ARG1203           HB1      ARG1203 -31.229   5.454   8.439
  772   1HG   ARG1203           HG2      ARG1203 -29.230   4.397   9.338
  773   2HG   ARG1203           HG1      ARG1203 -28.248   5.218   8.122
  774   1HD   ARG1203           HD2      ARG1203 -28.137   6.374  10.266
  775   2HD   ARG1203           HD1      ARG1203 -28.907   7.381   9.039
  776    HE   ARG1203           HE       ARG1203 -30.894   5.980  10.435
  777   1HH1  ARG1203          1HH1      ARG1203 -28.562   8.520  10.939
  778   2HH1  ARG1203          2HH1      ARG1203 -29.502   9.318  12.155
  779   1HH2  ARG1203          1HH2      ARG1203 -32.138   7.024  12.036
  780   2HH2  ARG1203          2HH2      ARG1203 -31.534   8.467  12.778
  781    H    GLY1204           HN       GLY1204 -31.909   2.260   6.112
  782   1HA   GLY1204           HA1      GLY1204 -33.954   3.947   4.839
  783   2HA   GLY1204           HA2      GLY1204 -34.444   2.742   6.020
  784    H    TYR1205           HN       TYR1205 -32.291   2.859   3.171
  785    HA   TYR1205           HA       TYR1205 -33.835   1.111   1.612
  786   1HB   TYR1205           HB2      TYR1205 -30.864   1.590   1.410
  787   2HB   TYR1205           HB1      TYR1205 -31.898   0.945   0.147
  788    HD1  TYR1205           HD1      TYR1205 -31.095   3.977   2.096
  789    HD2  TYR1205           HD2      TYR1205 -33.170   2.388  -1.256
  790    HE1  TYR1205           HE1      TYR1205 -31.489   6.257   1.266
  791    HE2  TYR1205           HE2      TYR1205 -33.572   4.663  -2.096
  792    HH   TYR1205           HH       TYR1205 -33.690   6.955  -1.219
  793    H    ARG1206           HN       ARG1206 -33.660  -1.061   1.133
  794    HA   ARG1206           HA       ARG1206 -32.154  -2.662   3.098
  795   1HB   ARG1206           HB2      ARG1206 -33.880  -4.405   2.774
  796   2HB   ARG1206           HB1      ARG1206 -34.541  -2.909   3.418
  797   1HG   ARG1206           HG2      ARG1206 -35.734  -2.459   1.541
  798   2HG   ARG1206           HG1      ARG1206 -34.579  -3.264   0.476
  799   1HD   ARG1206           HD2      ARG1206 -36.692  -4.489   0.595
  800   2HD   ARG1206           HD1      ARG1206 -35.364  -5.438   1.261
  801    HE   ARG1206           HE       ARG1206 -36.719  -3.972   3.287
  802   1HH1  ARG1206          1HH1      ARG1206 -36.942  -6.816   1.286
  803   2HH1  ARG1206          2HH1      ARG1206 -37.938  -7.684   2.407
  804   1HH2  ARG1206          1HH2      ARG1206 -38.030  -5.107   4.769
  805   2HH2  ARG1206          2HH2      ARG1206 -38.557  -6.713   4.385
  806    H    LEU1207           HN       LEU1207 -30.751  -4.140   2.379
  807    HA   LEU1207           HA       LEU1207 -29.522  -4.214   0.014
  808   1HB   LEU1207           HB2      LEU1207 -30.053  -6.314   2.025
  809   2HB   LEU1207           HB1      LEU1207 -29.494  -6.878   0.464
  810    HG   LEU1207           HG       LEU1207 -28.042  -4.876   2.200
  811   1HD1  LEU1207          1HD1      LEU1207 -27.507  -7.800   1.693
  812   2HD1  LEU1207          3HD1      LEU1207 -26.440  -6.700   2.566
  813   3HD1  LEU1207          2HD1      LEU1207 -28.035  -7.081   3.215
  814   1HD2  LEU1207          1HD2      LEU1207 -27.244  -6.251  -0.362
  815   2HD2  LEU1207          3HD2      LEU1207 -27.582  -4.533  -0.154
  816   3HD2  LEU1207          2HD2      LEU1207 -26.182  -5.258   0.636
  817    H    SER1208           HN       SER1208 -30.097  -4.440  -2.030
  818    HA   SER1208           HA       SER1208 -32.670  -5.364  -2.801
  819   1HB   SER1208           HB2      SER1208 -30.206  -4.697  -4.421
  820   2HB   SER1208           HB1      SER1208 -31.774  -5.081  -5.127
  821    HG   SER1208           HG       SER1208 -32.056  -2.999  -4.921
  822    H    SER1209           HN       SER1209 -30.088  -7.075  -1.779
  823    HA   SER1209           HA       SER1209 -29.699  -9.322  -1.707
  824   1HB   SER1209           HB2      SER1209 -32.098  -9.731  -1.989
  825   2HB   SER1209           HB1      SER1209 -31.934  -9.552  -3.736
  826    HG   SER1209           HG       SER1209 -30.165 -11.357  -2.827
  827    H    ARG1210           HN       ARG1210 -30.278  -8.072  -4.982
  828    HA   ARG1210           HA       ARG1210 -28.288  -9.780  -6.146
  829   1HB   ARG1210           HB2      ARG1210 -29.710  -7.362  -7.275
  830   2HB   ARG1210           HB1      ARG1210 -28.698  -8.463  -8.199
  831   1HG   ARG1210           HG2      ARG1210 -30.244 -10.295  -7.698
  832   2HG   ARG1210           HG1      ARG1210 -31.268  -9.172  -6.799
  833   1HD   ARG1210           HD2      ARG1210 -30.588  -8.989  -9.732
  834   2HD   ARG1210           HD1      ARG1210 -32.120  -9.544  -9.059
  835    HE   ARG1210           HE       ARG1210 -31.600  -6.985  -8.061
  836   1HH1  ARG1210          1HH1      ARG1210 -32.344  -8.548 -11.085
  837   2HH1  ARG1210          2HH1      ARG1210 -33.136  -7.160 -11.755
  838   1HH2  ARG1210          1HH2      ARG1210 -32.642  -5.155  -8.933
  839   2HH2  ARG1210          2HH2      ARG1210 -33.306  -5.232 -10.532
  840    H    SER1211           HN       SER1211 -27.806  -7.584  -3.998
  841    HA   SER1211           HA       SER1211 -26.076  -5.657  -5.092
  842   1HB   SER1211           HB2      SER1211 -27.131  -5.530  -2.834
  843   2HB   SER1211           HB1      SER1211 -26.035  -6.800  -2.288
  844    HG   SER1211           HG       SER1211 -25.390  -4.539  -1.891
  845    H    HIS1212           HN       HIS1212 -23.717  -5.711  -3.780
  846    HA   HIS1212           HA       HIS1212 -22.419  -8.159  -4.782
  847   1HB   HIS1212           HB2      HIS1212 -21.311  -5.343  -4.727
  848   2HB   HIS1212           HB1      HIS1212 -20.435  -6.773  -5.266
  849    HD1  HIS1212           HD1      HIS1212 -22.831  -4.217  -6.394
  850    HD2  HIS1212           HD2      HIS1212 -21.412  -7.888  -7.725
  851    HE1  HIS1212           HE1      HIS1212 -23.505  -4.361  -8.812
  852    HE2  HIS1212           HE2      HIS1212 -22.710  -6.627  -9.574
  853    H    THR1213           HN       THR1213 -23.366  -8.144  -2.225
  854    HA   THR1213           HA       THR1213 -22.786  -8.593  -0.086
  855    HB   THR1213           HB       THR1213 -20.673  -9.532   0.404
  856    HG1  THR1213           HG1      THR1213 -19.287  -9.024  -1.858
  857   1HG2  THR1213          1HG2      THR1213 -22.024 -10.875  -1.122
  858   2HG2  THR1213          3HG2      THR1213 -21.276 -10.074  -2.504
  859   3HG2  THR1213          2HG2      THR1213 -20.305 -11.097  -1.445
  860    H    LEU1214           HN       LEU1214 -22.716  -7.303   1.612
  861    HA   LEU1214           HA       LEU1214 -21.885  -4.613   1.428
  862   1HB   LEU1214           HB2      LEU1214 -22.587  -6.353   3.787
  863   2HB   LEU1214           HB1      LEU1214 -22.222  -4.645   3.936
  864    HG   LEU1214           HG       LEU1214 -24.419  -5.627   2.131
  865   1HD1  LEU1214          1HD1      LEU1214 -24.632  -4.909   5.052
  866   2HD1  LEU1214          3HD1      LEU1214 -25.986  -5.201   3.959
  867   3HD1  LEU1214          2HD1      LEU1214 -24.871  -6.511   4.353
  868   1HD2  LEU1214          1HD2      LEU1214 -23.562  -3.319   1.873
  869   2HD2  LEU1214          3HD2      LEU1214 -25.252  -3.382   2.373
  870   3HD2  LEU1214          2HD2      LEU1214 -23.997  -3.003   3.552
  871    H    ARG1215           HN       ARG1215 -20.512  -7.363   3.218
  872    HA   ARG1215           HA       ARG1215 -18.116  -5.838   3.827
  873   1HB   ARG1215           HB2      ARG1215 -19.108  -7.320   5.531
  874   2HB   ARG1215           HB1      ARG1215 -18.825  -8.704   4.483
  875   1HG   ARG1215           HG2      ARG1215 -16.412  -8.299   4.614
  876   2HG   ARG1215           HG1      ARG1215 -16.711  -6.931   5.690
  877   1HD   ARG1215           HD2      ARG1215 -17.754  -8.436   7.312
  878   2HD   ARG1215           HD1      ARG1215 -17.458  -9.802   6.237
  879    HE   ARG1215           HE       ARG1215 -15.026  -8.497   6.751
  880   1HH1  ARG1215          1HH1      ARG1215 -17.414 -10.453   8.368
  881   2HH1  ARG1215          2HH1      ARG1215 -16.285 -11.132   9.492
  882   1HH2  ARG1215          1HH2      ARG1215 -13.532  -9.386   8.229
  883   2HH2  ARG1215          2HH2      ARG1215 -14.079 -10.524   9.414
  884    H    THR1216           HN       THR1216 -16.040  -6.355   3.127
  885    HA   THR1216           HA       THR1216 -15.548  -8.510   1.302
  886    HB   THR1216           HB       THR1216 -16.563  -7.125  -0.337
  887    HG1  THR1216           HG1      THR1216 -14.429  -8.016  -0.848
  888   1HG2  THR1216          2HG2      THR1216 -16.558  -5.024   0.920
  889   2HG2  THR1216          1HG2      THR1216 -14.821  -4.873   0.652
  890   3HG2  THR1216          3HG2      THR1216 -15.934  -4.793  -0.713
  891    H    THR1217           HN       THR1217 -13.306  -8.139   0.231
  892    HA   THR1217           HA       THR1217 -11.497  -7.203   2.353
  893    HB   THR1217           HB       THR1217 -11.156  -9.272   0.188
  894    HG1  THR1217           HG1      THR1217 -11.376 -10.575   1.835
  895   1HG2  THR1217          1HG2      THR1217  -9.139  -7.789   0.290
  896   2HG2  THR1217          3HG2      THR1217  -8.958  -8.240   1.986
  897   3HG2  THR1217          2HG2      THR1217  -8.820  -9.469   0.729
  898    H    CYS1218           HN       CYS1218 -10.201  -5.508   2.001
  899    HA   CYS1218           HA       CYS1218 -10.313  -4.176  -0.553
  900   1HB   CYS1218           HB2      CYS1218  -8.632  -3.398   1.831
  901   2HB   CYS1218           HB1      CYS1218  -9.149  -2.372   0.497
  902    H    TRP1219           HN       TRP1219  -8.805  -4.197  -2.105
  903    HA   TRP1219           HA       TRP1219  -6.081  -4.889  -1.642
  904   1HB   TRP1219           HB2      TRP1219  -7.678  -7.079  -1.733
  905   2HB   TRP1219           HB1      TRP1219  -7.297  -6.896  -3.442
  906    HD1  TRP1219           HD1      TRP1219  -4.698  -7.154  -4.150
  907    HE1  TRP1219           HE1      TRP1219  -2.768  -8.410  -3.004
  908    HE3  TRP1219           HE3      TRP1219  -6.728  -7.729   0.509
  909    HZ2  TRP1219           HZ2      TRP1219  -2.175  -9.496  -0.486
  910    HZ3  TRP1219           HZ3      TRP1219  -5.410  -8.892   2.232
  911    HH2  TRP1219           HH2      TRP1219  -3.179  -9.758   1.744
  912    H    ASP1220           HN       ASP1220  -4.839  -4.102  -3.243
  913    HA   ASP1220           HA       ASP1220  -4.211  -3.086  -5.175
  914   1HB   ASP1220           HB2      ASP1220  -5.015  -5.216  -6.181
  915   2HB   ASP1220           HB1      ASP1220  -6.602  -4.481  -6.395
  916    H    GLY1221           HN       GLY1221  -6.874  -2.300  -3.509
  917   1HA   GLY1221           HA1      GLY1221  -7.157   0.218  -4.947
  918   2HA   GLY1221           HA2      GLY1221  -7.757  -0.135  -3.334
  919    H    LYS1222           HN       LYS1222  -9.050  -2.648  -4.263
  920    HA   LYS1222           HA       LYS1222 -11.511  -1.408  -5.150
  921   1HB   LYS1222           HB2      LYS1222 -10.450  -1.885  -7.264
  922   2HB   LYS1222           HB1      LYS1222 -10.135  -3.539  -6.772
  923   1HG   LYS1222           HG2      LYS1222 -11.993  -3.492  -8.292
  924   2HG   LYS1222           HG1      LYS1222 -12.556  -3.957  -6.686
  925   1HD   LYS1222           HD2      LYS1222 -13.493  -1.815  -6.296
  926   2HD   LYS1222           HD1      LYS1222 -12.686  -1.128  -7.709
  927   1HE   LYS1222           HE2      LYS1222 -14.026  -2.693  -9.128
  928   2HE   LYS1222           HE1      LYS1222 -14.921  -3.150  -7.679
  929   1HZ   LYS1222           HZ3      LYS1222 -14.761  -0.410  -8.813
  930   2HZ   LYS1222           HZ2      LYS1222 -16.084  -1.454  -8.943
  931   3HZ   LYS1222           HZ1      LYS1222 -15.626  -0.856  -7.430
  932    H    LEU1223           HN       LEU1223 -13.237  -2.361  -4.352
  933    HA   LEU1223           HA       LEU1223 -13.270  -5.163  -3.654
  934   1HB   LEU1223           HB2      LEU1223 -14.086  -4.527  -1.282
  935   2HB   LEU1223           HB1      LEU1223 -12.367  -4.602  -1.616
  936    HG   LEU1223           HG       LEU1223 -13.683  -1.968  -1.950
  937   1HD1  LEU1223          2HD1      LEU1223 -13.143  -3.209   0.742
  938   2HD1  LEU1223          1HD1      LEU1223 -13.494  -1.504   0.457
  939   3HD1  LEU1223          3HD1      LEU1223 -14.713  -2.726   0.099
  940   1HD2  LEU1223          1HD2      LEU1223 -11.284  -2.399  -2.382
  941   2HD2  LEU1223          3HD2      LEU1223 -11.575  -1.166  -1.155
  942   3HD2  LEU1223          2HD2      LEU1223 -11.089  -2.792  -0.674
  943    H    GLU1224           HN       GLU1224 -15.267  -6.000  -3.686
  944    HA   GLU1224           HA       GLU1224 -17.335  -5.108  -5.062
  945   1HB   GLU1224           HB2      GLU1224 -17.453  -6.705  -2.511
  946   2HB   GLU1224           HB1      GLU1224 -18.864  -6.443  -3.526
  947   1HG   GLU1224           HG2      GLU1224 -17.923  -8.577  -4.040
  948   2HG   GLU1224           HG1      GLU1224 -17.658  -7.497  -5.408
  949    H    TYR1225           HN       TYR1225 -19.054  -3.787  -4.975
  950    HA   TYR1225           HA       TYR1225 -19.315  -2.013  -2.623
  951   1HB   TYR1225           HB2      TYR1225 -20.039  -1.575  -5.539
  952   2HB   TYR1225           HB1      TYR1225 -20.480  -0.468  -4.250
  953    HD1  TYR1225           HD1      TYR1225 -17.257  -2.219  -4.985
  954    HD2  TYR1225           HD2      TYR1225 -19.320   1.477  -4.570
  955    HE1  TYR1225           HE1      TYR1225 -15.145  -1.009  -5.327
  956    HE2  TYR1225           HE2      TYR1225 -17.212   2.698  -4.905
  957    HH   TYR1225           HH       TYR1225 -14.766   2.258  -4.635
  958    HA   PRO1226           HA       PRO1226 -23.276  -4.041  -2.031
  959   1HB   PRO1226           HB2      PRO1226 -23.852  -1.717  -0.304
  960   2HB   PRO1226           HB1      PRO1226 -23.826  -3.437   0.099
  961   1HG   PRO1226           HG2      PRO1226 -21.902  -1.791   0.953
  962   2HG   PRO1226           HG1      PRO1226 -21.536  -3.453   0.454
  963   1HD   PRO1226           HD2      PRO1226 -21.153  -0.893  -1.062
  964   2HD   PRO1226           HD1      PRO1226 -20.063  -2.289  -0.918
  965    H    THR1227           HN       THR1227 -25.653  -2.898  -1.644
  966    HA   THR1227           HA       THR1227 -26.318  -0.565  -3.006
  967    HB   THR1227           HB       THR1227 -27.426  -2.269  -4.945
  968    HG1  THR1227           HG1      THR1227 -24.746  -2.639  -5.390
  969   1HG2  THR1227          1HG2      THR1227 -25.113  -0.337  -5.128
  970   2HG2  THR1227          3HG2      THR1227 -26.030  -0.959  -6.500
  971   3HG2  THR1227          2HG2      THR1227 -26.826   0.055  -5.295
  972    H    CYS1228           HN       CYS1228 -27.776  -0.512  -1.282
  973    HA   CYS1228           HA       CYS1228 -29.875  -2.556  -1.267
  974   1HB   CYS1228           HB2      CYS1228 -29.374  -0.392   0.784
  975   2HB   CYS1228           HB1      CYS1228 -30.430  -1.791   0.947
  976    H    ALA1229           HN       ALA1229 -32.114  -1.677  -0.718
  977    HA   ALA1229           HA       ALA1229 -32.705   0.948  -1.759
  978   1HB   ALA1229           HB3      ALA1229 -33.746  -1.478  -3.196
  979   2HB   ALA1229           HB1      ALA1229 -32.492  -0.393  -3.799
  980   3HB   ALA1229           HB2      ALA1229 -34.135   0.205  -3.556
  981    H    LYS1230           HN       LYS1230 -34.364   1.780  -0.738
  982    HA   LYS1230           HA       LYS1230 -36.808   0.721  -0.222
  983   1HB   LYS1230           HB2      LYS1230 -35.225  -0.774   1.293
  984   2HB   LYS1230           HB1      LYS1230 -35.444   0.572   2.402
  985   1HG   LYS1230           HG2      LYS1230 -37.909   0.288   2.136
  986   2HG   LYS1230           HG1      LYS1230 -37.574  -1.174   1.203
  987   1HD   LYS1230           HD2      LYS1230 -36.393  -2.123   3.134
  988   2HD   LYS1230           HD1      LYS1230 -36.751  -0.666   4.063
  989   1HE   LYS1230           HE2      LYS1230 -39.147  -1.106   3.824
  990   2HE   LYS1230           HE1      LYS1230 -38.786  -2.565   2.901
  991   1HZ   LYS1230           HZ2      LYS1230 -37.661  -3.467   4.844
  992   2HZ   LYS1230           HZ1      LYS1230 -38.020  -2.070   5.728
  993   3HZ   LYS1230           HZ3      LYS1230 -39.269  -3.084   5.205
  994    H    ARG1231           HN       ARG1231 -35.496   1.927   2.643
  995    HA   ARG1231           HA       ARG1231 -36.153   3.775   3.837
  996   1HB   ARG1231           HB2      ARG1231 -33.944   4.296   2.911
  997   2HB   ARG1231           HB1      ARG1231 -34.700   5.005   1.492
  998   1HG   ARG1231           HG2      ARG1231 -35.717   6.733   2.864
  999   2HG   ARG1231           HG1      ARG1231 -35.032   6.001   4.316
 1000   1HD   ARG1231           HD2      ARG1231 -32.777   6.411   3.454
 1001   2HD   ARG1231           HD1      ARG1231 -33.467   7.148   2.008
 1002    HE   ARG1231           HE       ARG1231 -34.493   8.488   4.231
 1003   1HH1  ARG1231          1HH1      ARG1231 -31.439   8.008   2.623
 1004   2HH1  ARG1231          2HH1      ARG1231 -30.792   9.537   3.117
 1005   1HH2  ARG1231          1HH2      ARG1231 -33.650  10.503   4.886
 1006   2HH2  ARG1231          2HH2      ARG1231 -32.049  10.955   4.403

  No H/Q in entry =        1006
  Start of MODEL    9
    1    H1   GLU1103           HT3      GLU1103  37.667  -6.057  -5.300
    2    H2   GLU1103           HT2      GLU1103  37.461  -7.325  -6.401
    3    H3   GLU1103           HT1      GLU1103  38.345  -5.954  -6.848
    4    HA   GLU1103           HA       GLU1103  36.373  -4.586  -6.677
    5   1HB   GLU1103           HB2      GLU1103  35.181  -5.496  -8.634
    6   2HB   GLU1103           HB1      GLU1103  36.927  -5.551  -8.842
    7   1HG   GLU1103           HG2      GLU1103  36.920  -7.925  -8.270
    8   2HG   GLU1103           HG1      GLU1103  35.171  -7.869  -8.064
    9    H    ALA1104           HN       ALA1104  36.074  -7.746  -5.393
   10    HA   ALA1104           HA       ALA1104  33.195  -7.495  -4.975
   11   1HB   ALA1104           HB2      ALA1104  34.080  -9.659  -5.699
   12   2HB   ALA1104           HB3      ALA1104  33.307  -9.772  -4.118
   13   3HB   ALA1104           HB1      ALA1104  35.067  -9.744  -4.240
   14    H    GLU1105           HN       GLU1105  36.109  -6.806  -3.377
   15    HA   GLU1105           HA       GLU1105  34.856  -6.890  -0.728
   16   1HB   GLU1105           HB2      GLU1105  37.075  -7.926  -0.950
   17   2HB   GLU1105           HB1      GLU1105  37.736  -6.395  -1.506
   18   1HG   GLU1105           HG2      GLU1105  38.287  -6.766   0.816
   19   2HG   GLU1105           HG1      GLU1105  37.207  -5.382   0.653
   20    H    PHE1106           HN       PHE1106  34.349  -5.100   0.393
   21    HA   PHE1106           HA       PHE1106  33.956  -2.922   0.899
   22   1HB   PHE1106           HB2      PHE1106  36.406  -2.733   0.950
   23   2HB   PHE1106           HB1      PHE1106  36.420  -2.405  -0.779
   24    HD1  PHE1106           HD1      PHE1106  35.350  -1.087   2.499
   25    HD2  PHE1106           HD2      PHE1106  36.027  -0.240  -1.616
   26    HE1  PHE1106           HE1      PHE1106  35.106   1.318   2.958
   27    HE2  PHE1106           HE2      PHE1106  35.786   2.167  -1.165
   28    HZ   PHE1106           HZ       PHE1106  35.325   2.948   1.125
   29    H    GLY1107           HN       GLY1107  32.255  -1.890   0.108
   30   1HA   GLY1107           HA1      GLY1107  31.367  -2.032  -2.516
   31   2HA   GLY1107           HA2      GLY1107  32.262  -0.530  -2.363
   32    H    LYS1108           HN       LYS1108  31.597   0.869  -0.464
   33    HA   LYS1108           HA       LYS1108  29.113   0.610   0.788
   34   1HB   LYS1108           HB2      LYS1108  30.520   3.181   0.045
   35   2HB   LYS1108           HB1      LYS1108  29.265   3.001   1.261
   36   1HG   LYS1108           HG2      LYS1108  30.807   1.439   2.478
   37   2HG   LYS1108           HG1      LYS1108  32.067   1.923   1.341
   38   1HD   LYS1108           HD2      LYS1108  31.810   4.248   2.027
   39   2HD   LYS1108           HD1      LYS1108  30.519   3.787   3.138
   40   1HE   LYS1108           HE2      LYS1108  33.400   2.906   3.281
   41   2HE   LYS1108           HE1      LYS1108  32.614   4.083   4.333
   42   1HZ   LYS1108           HZ2      LYS1108  31.143   2.338   5.127
   43   2HZ   LYS1108           HZ1      LYS1108  31.898   1.209   4.119
   44   3HZ   LYS1108           HZ3      LYS1108  32.761   1.920   5.389
   45    H    CYS1109           HN       CYS1109  27.092   0.889   0.141
   46    HA   CYS1109           HA       CYS1109  26.633   1.627  -2.625
   47   1HB   CYS1109           HB2      CYS1109  24.155   1.124  -1.714
   48   2HB   CYS1109           HB1      CYS1109  25.255  -0.137  -2.258
   49    H    GLY1110           HN       GLY1110  24.731   3.030  -3.116
   50   1HA   GLY1110           HA1      GLY1110  24.421   5.393  -3.168
   51   2HA   GLY1110           HA2      GLY1110  24.936   5.468  -1.487
   52    HA   PRO1111           HA       PRO1111  20.597   5.923  -0.599
   53   1HB   PRO1111           HB2      PRO1111  19.706   7.262  -3.077
   54   2HB   PRO1111           HB1      PRO1111  19.628   7.822  -1.403
   55   1HG   PRO1111           HG2      PRO1111  21.366   8.874  -3.160
   56   2HG   PRO1111           HG1      PRO1111  21.779   8.667  -1.448
   57   1HD   PRO1111           HD2      PRO1111  22.590   7.017  -3.808
   58   2HD   PRO1111           HD1      PRO1111  23.538   7.490  -2.382
   59    HA   PRO1112           HA       PRO1112  19.375   2.088  -2.672
   60   1HB   PRO1112           HB2      PRO1112  17.154   1.820  -0.974
   61   2HB   PRO1112           HB1      PRO1112  18.746   1.097  -0.737
   62   1HG   PRO1112           HG2      PRO1112  17.594   3.576   0.443
   63   2HG   PRO1112           HG1      PRO1112  18.696   2.390   1.167
   64   1HD   PRO1112           HD2      PRO1112  19.575   4.774   0.332
   65   2HD   PRO1112           HD1      PRO1112  20.560   3.309   0.132
   66    HA   PRO1113           HA       PRO1113  16.508   4.459  -5.382
   67   1HB   PRO1113           HB2      PRO1113  16.619   1.770  -6.680
   68   2HB   PRO1113           HB1      PRO1113  16.710   3.377  -7.412
   69   1HG   PRO1113           HG2      PRO1113  18.907   1.916  -7.095
   70   2HG   PRO1113           HG1      PRO1113  18.936   3.666  -6.808
   71   1HD   PRO1113           HD2      PRO1113  18.943   1.423  -4.847
   72   2HD   PRO1113           HD1      PRO1113  19.730   3.010  -4.750
   73    HA   PRO1114           HA       PRO1114  13.101   2.447  -3.092
   74   1HB   PRO1114           HB2      PRO1114  11.858   5.079  -3.607
   75   2HB   PRO1114           HB1      PRO1114  12.089   4.221  -2.079
   76   1HG   PRO1114           HG2      PRO1114  13.567   6.348  -2.620
   77   2HG   PRO1114           HG1      PRO1114  14.307   4.907  -1.885
   78   1HD   PRO1114           HD2      PRO1114  14.287   5.724  -4.785
   79   2HD   PRO1114           HD1      PRO1114  15.676   5.270  -3.767
   80    H    ILE1115           HN       ILE1115  10.557   3.247  -3.592
   81    HA   ILE1115           HA       ILE1115  10.092   2.563  -6.420
   82    HB   ILE1115           HB       ILE1115   8.036   1.349  -5.563
   83   1HG1  ILE1115          2HG1      ILE1115   9.547   1.639  -2.953
   84   2HG1  ILE1115          1HG1      ILE1115   7.976   2.337  -3.328
   85   1HG2  ILE1115          2HG2      ILE1115  10.756   0.292  -4.803
   86   2HG2  ILE1115          1HG2      ILE1115   9.299  -0.685  -4.993
   87   3HG2  ILE1115          3HG2      ILE1115   9.982   0.158  -6.383
   88   1HD1  ILE1115          3HD1      ILE1115   8.560  -0.606  -3.154
   89   2HD1  ILE1115          2HD1      ILE1115   7.817   0.371  -1.886
   90   3HD1  ILE1115          1HD1      ILE1115   6.986   0.140  -3.426
   91    H    ASP1116           HN       ASP1116   7.403   2.745  -6.526
   92    HA   ASP1116           HA       ASP1116   6.947   5.550  -6.499
   93   1HB   ASP1116           HB2      ASP1116   5.894   4.080  -8.162
   94   2HB   ASP1116           HB1      ASP1116   4.991   3.271  -6.885
   95    H    ASN1117           HN       ASN1117   6.744   6.616  -4.637
   96    HA   ASN1117           HA       ASN1117   5.842   7.339  -2.674
   97   1HB   ASN1117           HB2      ASN1117   3.870   5.075  -3.069
   98   2HB   ASN1117           HB1      ASN1117   3.730   6.348  -1.857
   99   1HD2  ASN1117          1HD2      ASN1117   1.958   5.619  -4.069
  100   2HD2  ASN1117          2HD2      ASN1117   1.776   7.052  -5.017
  101    H    GLY1118           HN       GLY1118   7.802   4.999  -3.000
  102   1HA   GLY1118           HA1      GLY1118   8.469   3.131  -1.653
  103   2HA   GLY1118           HA2      GLY1118   7.425   3.727  -0.373
  104    H    ASP1119           HN       ASP1119   9.615   3.131   0.684
  105    HA   ASP1119           HA       ASP1119  11.846   4.828   0.424
  106   1HB   ASP1119           HB2      ASP1119  11.493   6.082   2.633
  107   2HB   ASP1119           HB1      ASP1119  10.617   6.665   1.224
  108    H    ILE1120           HN       ILE1120  13.171   4.834   2.588
  109    HA   ILE1120           HA       ILE1120  13.695   2.140   3.202
  110    HB   ILE1120           HB       ILE1120  14.658   4.123   5.142
  111   1HG1  ILE1120          2HG1      ILE1120  15.470   4.324   2.231
  112   2HG1  ILE1120          1HG1      ILE1120  14.472   5.503   3.074
  113   1HG2  ILE1120          2HG2      ILE1120  15.935   2.104   3.318
  114   2HG2  ILE1120          1HG2      ILE1120  16.802   3.052   4.526
  115   3HG2  ILE1120          3HG2      ILE1120  15.565   1.902   5.031
  116   1HD1  ILE1120          2HD1      ILE1120  17.318   4.814   3.754
  117   2HD1  ILE1120          1HD1      ILE1120  16.773   6.253   2.892
  118   3HD1  ILE1120          3HD1      ILE1120  16.315   6.007   4.577
  119    H    THR1121           HN       THR1121  11.380   4.247   4.373
  120    HA   THR1121           HA       THR1121   9.810   4.138   6.011
  121    HB   THR1121           HB       THR1121   9.057   2.062   6.771
  122    HG1  THR1121           HG1      THR1121  10.626   0.999   7.766
  123   1HG2  THR1121          3HG2      THR1121  10.543   1.539   4.193
  124   2HG2  THR1121          2HG2      THR1121   9.281   0.499   4.854
  125   3HG2  THR1121          1HG2      THR1121   8.896   2.148   4.358
  126    H    SER1122           HN       SER1122  12.858   4.514   6.549
  127    HA   SER1122           HA       SER1122  12.558   4.499   9.472
  128   1HB   SER1122           HB2      SER1122  15.061   3.745   7.945
  129   2HB   SER1122           HB1      SER1122  14.949   3.915   9.697
  130    HG   SER1122           HG       SER1122  14.290   1.815   8.153
  131    H    PHE1123           HN       PHE1123  15.575   5.486   8.163
  132    HA   PHE1123           HA       PHE1123  14.802   8.302   8.277
  133   1HB   PHE1123           HB2      PHE1123  16.927   8.717   9.467
  134   2HB   PHE1123           HB1      PHE1123  15.816   7.722  10.392
  135    HD1  PHE1123           HD1      PHE1123  19.022   7.869   8.687
  136    HD2  PHE1123           HD2      PHE1123  16.262   5.343  10.716
  137    HE1  PHE1123           HE1      PHE1123  20.779   6.168   8.955
  138    HE2  PHE1123           HE2      PHE1123  18.014   3.639  10.987
  139    HZ   PHE1123           HZ       PHE1123  20.277   4.050  10.106
  140    HA   PRO1124           HA       PRO1124  17.280   8.626   4.606
  141   1HB   PRO1124           HB2      PRO1124  17.821  11.249   4.559
  142   2HB   PRO1124           HB1      PRO1124  16.171  10.647   4.356
  143   1HG   PRO1124           HG2      PRO1124  17.484  11.807   6.781
  144   2HG   PRO1124           HG1      PRO1124  15.848  12.078   6.157
  145   1HD   PRO1124           HD2      PRO1124  16.463  10.353   8.215
  146   2HD   PRO1124           HD1      PRO1124  15.023  10.213   7.188
  147    H    LEU1125           HN       LEU1125  19.403   8.585   3.928
  148    HA   LEU1125           HA       LEU1125  21.483   9.606   5.656
  149   1HB   LEU1125           HB2      LEU1125  22.723   7.396   5.544
  150   2HB   LEU1125           HB1      LEU1125  21.353   7.477   6.634
  151    HG   LEU1125           HG       LEU1125  21.241   6.252   3.875
  152   1HD1  LEU1125          1HD1      LEU1125  22.804   5.085   5.405
  153   2HD1  LEU1125          3HD1      LEU1125  21.477   4.878   6.547
  154   3HD1  LEU1125          2HD1      LEU1125  21.404   4.112   4.962
  155   1HD2  LEU1125          3HD2      LEU1125  19.108   7.111   4.968
  156   2HD2  LEU1125          2HD2      LEU1125  19.111   5.418   4.474
  157   3HD2  LEU1125          1HD2      LEU1125  19.342   5.847   6.173
  158    H    SER1126           HN       SER1126  20.347   8.514   2.685
  159    HA   SER1126           HA       SER1126  21.035   8.732   0.533
  160   1HB   SER1126           HB2      SER1126  21.251  11.082   1.207
  161   2HB   SER1126           HB1      SER1126  22.910  10.780   1.720
  162    HG   SER1126           HG       SER1126  21.875  10.556  -0.913
  163    H    VAL1127           HN       VAL1127  22.919   7.429   2.849
  164    HA   VAL1127           HA       VAL1127  24.639   6.179   0.892
  165    HB   VAL1127           HB       VAL1127  25.969   8.120   1.569
  166   1HG1  VAL1127          3HG1      VAL1127  25.037   8.494   3.781
  167   2HG1  VAL1127          2HG1      VAL1127  25.760   6.991   4.356
  168   3HG1  VAL1127          1HG1      VAL1127  26.791   8.335   3.866
  169   1HG2  VAL1127          2HG2      VAL1127  27.123   6.062   0.984
  170   2HG2  VAL1127          1HG2      VAL1127  27.998   6.921   2.251
  171   3HG2  VAL1127          3HG2      VAL1127  27.019   5.511   2.656
  172    H    TYR1128           HN       TYR1128  24.678   4.078   1.292
  173    HA   TYR1128           HA       TYR1128  24.187   3.178   4.055
  174   1HB   TYR1128           HB2      TYR1128  22.989   2.376   1.491
  175   2HB   TYR1128           HB1      TYR1128  23.475   1.035   2.522
  176    HD1  TYR1128           HD1      TYR1128  22.602   1.016   4.928
  177    HD2  TYR1128           HD2      TYR1128  20.983   3.498   1.878
  178    HE1  TYR1128           HE1      TYR1128  20.538   1.267   6.239
  179    HE2  TYR1128           HE2      TYR1128  18.914   3.762   3.177
  180    HH   TYR1128           HH       TYR1128  18.676   2.843   6.444
  181    H    ALA1129           HN       ALA1129  25.660   1.920   4.964
  182    HA   ALA1129           HA       ALA1129  28.138   1.360   3.816
  183   1HB   ALA1129           HB2      ALA1129  27.743   1.347   6.234
  184   2HB   ALA1129           HB1      ALA1129  26.781  -0.123   6.071
  185   3HB   ALA1129           HB3      ALA1129  28.507  -0.151   5.703
  186    HA   PRO1130           HA       PRO1130  27.518  -2.087   1.136
  187   1HB   PRO1130           HB2      PRO1130  29.741  -3.612   1.688
  188   2HB   PRO1130           HB1      PRO1130  29.736  -2.198   0.630
  189   1HG   PRO1130           HG2      PRO1130  30.566  -2.428   3.494
  190   2HG   PRO1130           HG1      PRO1130  31.316  -1.503   2.180
  191   1HD   PRO1130           HD2      PRO1130  29.774  -0.330   4.050
  192   2HD   PRO1130           HD1      PRO1130  29.796   0.231   2.365
  193    H    ALA1131           HN       ALA1131  26.801  -4.208   1.078
  194    HA   ALA1131           HA       ALA1131  25.842  -6.126   1.824
  195   1HB   ALA1131           HB3      ALA1131  28.098  -6.631   2.630
  196   2HB   ALA1131           HB1      ALA1131  26.861  -7.292   3.699
  197   3HB   ALA1131           HB2      ALA1131  27.730  -5.827   4.156
  198    H    SER1132           HN       SER1132  24.815  -3.439   2.655
  199    HA   SER1132           HA       SER1132  23.477  -4.144   5.175
  200   1HB   SER1132           HB2      SER1132  24.636  -1.863   4.785
  201   2HB   SER1132           HB1      SER1132  23.233  -1.494   3.779
  202    HG   SER1132           HG       SER1132  22.444  -2.539   6.127
  203    H    SER1133           HN       SER1133  21.141  -3.454   5.322
  204    HA   SER1133           HA       SER1133  19.634  -3.426   2.864
  205   1HB   SER1133           HB2      SER1133  18.920  -5.678   4.700
  206   2HB   SER1133           HB1      SER1133  18.615  -5.499   2.973
  207    HG   SER1133           HG       SER1133  20.243  -7.040   3.376
  208    H    VAL1134           HN       VAL1134  17.251  -3.335   3.316
  209    HA   VAL1134           HA       VAL1134  16.546  -2.525   6.023
  210    HB   VAL1134           HB       VAL1134  15.352  -0.470   5.001
  211   1HG1  VAL1134          2HG1      VAL1134  17.211  -0.413   6.636
  212   2HG1  VAL1134          1HG1      VAL1134  18.349  -0.387   5.289
  213   3HG1  VAL1134          3HG1      VAL1134  17.217   0.948   5.513
  214   1HG2  VAL1134          3HG2      VAL1134  17.520  -0.927   2.961
  215   2HG2  VAL1134          2HG2      VAL1134  15.780  -0.975   2.679
  216   3HG2  VAL1134          1HG2      VAL1134  16.561   0.544   3.118
  217    H    GLU1135           HN       GLU1135  14.165  -1.754   5.994
  218    HA   GLU1135           HA       GLU1135  12.624  -3.758   4.517
  219   1HB   GLU1135           HB2      GLU1135  12.133  -2.283   7.100
  220   2HB   GLU1135           HB1      GLU1135  10.885  -3.209   6.289
  221   1HG   GLU1135           HG2      GLU1135  11.780  -4.603   7.961
  222   2HG   GLU1135           HG1      GLU1135  12.406  -5.194   6.423
  223    H    TYR1136           HN       TYR1136  12.862  -2.176   2.672
  224    HA   TYR1136           HA       TYR1136  11.677   0.355   2.699
  225   1HB   TYR1136           HB2      TYR1136  12.687  -1.498   0.689
  226   2HB   TYR1136           HB1      TYR1136  11.330  -0.536   0.108
  227    HD1  TYR1136           HD1      TYR1136  14.579  -0.153   1.899
  228    HD2  TYR1136           HD2      TYR1136  11.730   1.581  -0.732
  229    HE1  TYR1136           HE1      TYR1136  16.089   1.752   1.531
  230    HE2  TYR1136           HE2      TYR1136  13.228   3.485  -1.111
  231    HH   TYR1136           HH       TYR1136  15.085   4.623   0.027
  232    H    GLN1137           HN       GLN1137   9.682   1.114   2.302
  233    HA   GLN1137           HA       GLN1137   7.527  -0.504   1.349
  234   1HB   GLN1137           HB2      GLN1137   7.524  -1.397   3.580
  235   2HB   GLN1137           HB1      GLN1137   7.663   0.208   4.284
  236   1HG   GLN1137           HG2      GLN1137   5.417   0.746   3.418
  237   2HG   GLN1137           HG1      GLN1137   5.283  -0.907   2.820
  238   1HE2  GLN1137          1HE2      GLN1137   3.664   0.521   4.787
  239   2HE2  GLN1137          2HE2      GLN1137   3.732  -0.421   6.233
  240    H    CYS1138           HN       CYS1138   5.512   0.745   1.206
  241    HA   CYS1138           HA       CYS1138   6.099   3.531   0.697
  242   1HB   CYS1138           HB2      CYS1138   3.710   1.779   0.161
  243   2HB   CYS1138           HB1      CYS1138   3.653   3.522  -0.085
  244    H    GLN1139           HN       GLN1139   4.920   5.267   1.533
  245    HA   GLN1139           HA       GLN1139   4.650   5.477   4.227
  246   1HB   GLN1139           HB2      GLN1139   2.994   6.934   2.163
  247   2HB   GLN1139           HB1      GLN1139   3.200   7.437   3.834
  248   1HG   GLN1139           HG2      GLN1139   5.596   7.716   3.460
  249   2HG   GLN1139           HG1      GLN1139   5.391   7.208   1.783
  250   1HE2  GLN1139          1HE2      GLN1139   6.171   9.146   0.980
  251   2HE2  GLN1139          2HE2      GLN1139   5.261  10.613   1.053
  252    H    ASN1140           HN       ASN1140   2.661   5.932   5.529
  253    HA   ASN1140           HA       ASN1140   1.171   3.691   5.978
  254   1HB   ASN1140           HB2      ASN1140  -0.400   5.135   7.229
  255   2HB   ASN1140           HB1      ASN1140   1.284   5.513   7.577
  256   1HD2  ASN1140          1HD2      ASN1140  -1.640   6.586   6.052
  257   2HD2  ASN1140          2HD2      ASN1140  -1.154   8.226   5.810
  258    H    LEU1141           HN       LEU1141  -1.146   3.304   5.774
  259    HA   LEU1141           HA       LEU1141  -3.098   3.077   4.641
  260   1HB   LEU1141           HB2      LEU1141  -2.137   5.524   3.171
  261   2HB   LEU1141           HB1      LEU1141  -3.669   4.743   2.837
  262    HG   LEU1141           HG       LEU1141  -2.851   6.052   5.432
  263   1HD1  LEU1141          2HD1      LEU1141  -3.424   7.616   3.645
  264   2HD1  LEU1141          1HD1      LEU1141  -4.958   6.779   3.403
  265   3HD1  LEU1141          3HD1      LEU1141  -4.642   7.621   4.920
  266   1HD2  LEU1141          3HD2      LEU1141  -4.213   4.071   5.857
  267   2HD2  LEU1141          2HD2      LEU1141  -5.110   5.550   6.204
  268   3HD2  LEU1141          1HD2      LEU1141  -5.426   4.657   4.717
  269    H    TYR1142           HN       TYR1142  -0.061   3.187   3.003
  270    HA   TYR1142           HA       TYR1142  -1.148   1.703   0.723
  271   1HB   TYR1142           HB2      TYR1142   1.595   2.885   1.206
  272   2HB   TYR1142           HB1      TYR1142   1.142   1.983  -0.236
  273    HD1  TYR1142           HD1      TYR1142   0.812   5.146   1.556
  274    HD2  TYR1142           HD2      TYR1142  -0.382   2.946  -1.884
  275    HE1  TYR1142           HE1      TYR1142  -0.004   7.222   0.521
  276    HE2  TYR1142           HE2      TYR1142  -1.202   5.016  -2.929
  277    HH   TYR1142           HH       TYR1142  -0.461   8.100  -1.730
  278    H    GLN1143           HN       GLN1143  -0.964  -0.442   0.567
  279    HA   GLN1143           HA       GLN1143   0.876  -1.799   2.433
  280   1HB   GLN1143           HB2      GLN1143  -1.759  -2.091   2.496
  281   2HB   GLN1143           HB1      GLN1143  -1.433  -3.235   1.201
  282   1HG   GLN1143           HG2      GLN1143  -0.230  -3.313   3.960
  283   2HG   GLN1143           HG1      GLN1143  -1.548  -4.329   3.375
  284   1HE2  GLN1143          1HE2      GLN1143  -1.110  -5.975   1.919
  285   2HE2  GLN1143          2HE2      GLN1143   0.492  -6.552   1.635
  286    H    LEU1144           HN       LEU1144   2.653  -2.366   1.355
  287    HA   LEU1144           HA       LEU1144   2.768  -2.770  -1.436
  288   1HB   LEU1144           HB2      LEU1144   5.049  -3.393  -1.115
  289   2HB   LEU1144           HB1      LEU1144   4.684  -2.072  -0.023
  290    HG   LEU1144           HG       LEU1144   4.206  -4.249   1.563
  291   1HD1  LEU1144          1HD1      LEU1144   6.573  -4.904  -0.180
  292   2HD1  LEU1144          3HD1      LEU1144   6.117  -5.747   1.300
  293   3HD1  LEU1144          2HD1      LEU1144   5.055  -5.799  -0.107
  294   1HD2  LEU1144          2HD2      LEU1144   6.801  -2.765   1.183
  295   2HD2  LEU1144          1HD2      LEU1144   5.441  -2.243   2.179
  296   3HD2  LEU1144          3HD2      LEU1144   6.345  -3.693   2.613
  297    H    GLU1145           HN       GLU1145   4.326  -4.969  -1.807
  298    HA   GLU1145           HA       GLU1145   3.256  -7.378  -0.792
  299   1HB   GLU1145           HB2      GLU1145   1.315  -6.640  -2.170
  300   2HB   GLU1145           HB1      GLU1145   2.356  -6.641  -3.586
  301   1HG   GLU1145           HG2      GLU1145   2.725  -9.040  -3.315
  302   2HG   GLU1145           HG1      GLU1145   1.675  -9.038  -1.898
  303    H    GLY1146           HN       GLY1146   4.888  -8.765  -0.965
  304   1HA   GLY1146           HA1      GLY1146   6.802  -8.395  -3.186
  305   2HA   GLY1146           HA2      GLY1146   6.263  -9.992  -2.686
  306    H    ASN1147           HN       ASN1147   8.871  -8.178  -2.599
  307    HA   ASN1147           HA       ASN1147   9.635  -9.069   0.105
  308   1HB   ASN1147           HB2      ASN1147  10.752 -10.042  -2.087
  309   2HB   ASN1147           HB1      ASN1147  11.682  -8.547  -2.002
  310   1HD2  ASN1147          1HD2      ASN1147  13.136  -8.231  -0.356
  311   2HD2  ASN1147          2HD2      ASN1147  13.653  -9.507   0.689
  312    H    LYS1148           HN       LYS1148   9.030  -7.129   1.091
  313    HA   LYS1148           HA       LYS1148   9.861  -4.567   0.227
  314   1HB   LYS1148           HB2      LYS1148   9.291  -3.925   2.617
  315   2HB   LYS1148           HB1      LYS1148   8.003  -4.669   1.678
  316   1HG   LYS1148           HG2      LYS1148   7.802  -5.777   3.669
  317   2HG   LYS1148           HG1      LYS1148   8.864  -6.872   2.782
  318   1HD   LYS1148           HD2      LYS1148  10.079  -6.738   4.689
  319   2HD   LYS1148           HD1      LYS1148  10.710  -5.293   3.894
  320   1HE   LYS1148           HE2      LYS1148   8.444  -5.366   5.884
  321   2HE   LYS1148           HE1      LYS1148  10.094  -4.847   6.223
  322   1HZ   LYS1148           HZ3      LYS1148   9.821  -3.055   4.625
  323   2HZ   LYS1148           HZ2      LYS1148   8.238  -3.552   4.300
  324   3HZ   LYS1148           HZ1      LYS1148   8.640  -2.961   5.833
  325    H    ARG1149           HN       ARG1149  11.775  -7.025   1.125
  326    HA   ARG1149           HA       ARG1149  13.670  -5.372   2.639
  327   1HB   ARG1149           HB2      ARG1149  13.106  -7.634   3.505
  328   2HB   ARG1149           HB1      ARG1149  13.782  -8.335   2.043
  329   1HG   ARG1149           HG2      ARG1149  15.501  -8.540   3.580
  330   2HG   ARG1149           HG1      ARG1149  15.929  -7.076   2.690
  331   1HD   ARG1149           HD2      ARG1149  16.244  -6.721   5.062
  332   2HD   ARG1149           HD1      ARG1149  14.923  -5.715   4.467
  333    HE   ARG1149           HE       ARG1149  13.445  -7.566   5.384
  334   1HH1  ARG1149          1HH1      ARG1149  16.556  -6.759   6.732
  335   2HH1  ARG1149          2HH1      ARG1149  16.151  -7.306   8.325
  336   1HH2  ARG1149          1HH2      ARG1149  12.904  -8.288   7.478
  337   2HH2  ARG1149          2HH2      ARG1149  14.076  -8.176   8.748
  338    H    ILE1150           HN       ILE1150  15.165  -4.323   1.505
  339    HA   ILE1150           HA       ILE1150  16.102  -5.553  -1.008
  340    HB   ILE1150           HB       ILE1150  16.436  -3.400  -1.963
  341   1HG1  ILE1150          2HG1      ILE1150  15.431  -2.126   0.585
  342   2HG1  ILE1150          1HG1      ILE1150  17.145  -2.333   0.238
  343   1HG2  ILE1150          1HG2      ILE1150  13.763  -3.542  -0.575
  344   2HG2  ILE1150          3HG2      ILE1150  14.136  -2.497  -1.947
  345   3HG2  ILE1150          2HG2      ILE1150  14.184  -4.250  -2.135
  346   1HD1  ILE1150          3HD1      ILE1150  16.906  -0.961  -1.763
  347   2HD1  ILE1150          2HD1      ILE1150  15.189  -0.754  -1.414
  348   3HD1  ILE1150          1HD1      ILE1150  16.398  -0.094  -0.314
  349    H    THR1151           HN       THR1151  18.288  -5.538  -1.462
  350    HA   THR1151           HA       THR1151  20.096  -4.520   0.622
  351    HB   THR1151           HB       THR1151  20.337  -7.259  -0.636
  352    HG1  THR1151           HG1      THR1151  19.785  -7.989   1.478
  353   1HG2  THR1151          1HG2      THR1151  22.490  -6.236  -0.061
  354   2HG2  THR1151          3HG2      THR1151  21.915  -5.952   1.583
  355   3HG2  THR1151          2HG2      THR1151  22.126  -7.601   0.995
  356    H    CYS1152           HN       CYS1152  21.817  -3.450  -0.176
  357    HA   CYS1152           HA       CYS1152  22.102  -3.140  -3.006
  358   1HB   CYS1152           HB2      CYS1152  23.755  -1.504  -2.517
  359   2HB   CYS1152           HB1      CYS1152  22.505  -1.331  -1.293
  360    H    ARG1153           HN       ARG1153  24.013  -3.523  -4.214
  361    HA   ARG1153           HA       ARG1153  25.908  -5.449  -3.104
  362   1HB   ARG1153           HB2      ARG1153  25.682  -6.831  -5.209
  363   2HB   ARG1153           HB1      ARG1153  24.351  -6.944  -4.067
  364   1HG   ARG1153           HG2      ARG1153  24.267  -5.071  -6.408
  365   2HG   ARG1153           HG1      ARG1153  23.776  -6.760  -6.542
  366   1HD   ARG1153           HD2      ARG1153  22.605  -4.700  -4.671
  367   2HD   ARG1153           HD1      ARG1153  21.848  -5.332  -6.133
  368    HE   ARG1153           HE       ARG1153  22.467  -7.038  -3.809
  369   1HH1  ARG1153          1HH1      ARG1153  20.317  -5.950  -6.326
  370   2HH1  ARG1153          2HH1      ARG1153  19.072  -7.088  -5.932
  371   1HH2  ARG1153          1HH2      ARG1153  20.835  -8.541  -3.285
  372   2HH2  ARG1153          2HH2      ARG1153  19.366  -8.560  -4.203
  373    H    ASN1154           HN       ASN1154  27.817  -4.558  -3.418
  374    HA   ASN1154           HA       ASN1154  29.546  -3.395  -4.337
  375   1HB   ASN1154           HB2      ASN1154  28.348  -4.480  -6.897
  376   2HB   ASN1154           HB1      ASN1154  29.969  -3.810  -6.738
  377   1HD2  ASN1154          1HD2      ASN1154  27.883  -6.481  -5.992
  378   2HD2  ASN1154          2HD2      ASN1154  29.126  -7.581  -5.510
  379    H    GLY1155           HN       GLY1155  27.570  -1.715  -3.654
  380   1HA   GLY1155           HA1      GLY1155  28.038   0.548  -5.237
  381   2HA   GLY1155           HA2      GLY1155  26.801   0.416  -3.998
  382    H    GLN1156           HN       GLN1156  25.374  -1.754  -5.232
  383    HA   GLN1156           HA       GLN1156  23.951  -0.207  -7.254
  384   1HB   GLN1156           HB2      GLN1156  25.562  -1.631  -8.493
  385   2HB   GLN1156           HB1      GLN1156  24.847  -3.053  -7.746
  386   1HG   GLN1156           HG2      GLN1156  22.706  -2.525  -8.818
  387   2HG   GLN1156           HG1      GLN1156  23.450  -1.127  -9.590
  388   1HE2  GLN1156          1HE2      GLN1156  24.934  -1.438 -11.251
  389   2HE2  GLN1156          2HE2      GLN1156  25.073  -2.944 -12.086
  390    H    TRP1157           HN       TRP1157  22.603  -0.109  -5.278
  391    HA   TRP1157           HA       TRP1157  21.348  -2.139  -3.958
  392   1HB   TRP1157           HB2      TRP1157  20.437   0.575  -4.804
  393   2HB   TRP1157           HB1      TRP1157  19.298  -0.513  -4.025
  394    HD1  TRP1157           HD1      TRP1157  22.222   1.734  -3.328
  395    HE1  TRP1157           HE1      TRP1157  22.530   1.930  -0.790
  396    HE3  TRP1157           HE3      TRP1157  19.030  -1.958  -1.835
  397    HZ2  TRP1157           HZ2      TRP1157  21.581   0.670   1.543
  398    HZ3  TRP1157           HZ3      TRP1157  18.790  -2.408   0.573
  399    HH2  TRP1157           HH2      TRP1157  20.041  -1.120   2.227
  400    H    SER1158           HN       SER1158  18.948  -2.504  -4.057
  401    HA   SER1158           HA       SER1158  18.127  -3.322  -6.762
  402   1HB   SER1158           HB2      SER1158  18.458  -5.182  -5.117
  403   2HB   SER1158           HB1      SER1158  17.217  -4.454  -4.098
  404    HG   SER1158           HG       SER1158  16.791  -5.254  -6.784
  405    H    GLU1159           HN       GLU1159  15.430  -3.701  -6.286
  406    HA   GLU1159           HA       GLU1159  14.504  -1.068  -5.378
  407   1HB   GLU1159           HB2      GLU1159  14.605  -1.438  -7.901
  408   2HB   GLU1159           HB1      GLU1159  13.300  -2.591  -7.676
  409   1HG   GLU1159           HG2      GLU1159  11.895  -0.835  -6.734
  410   2HG   GLU1159           HG1      GLU1159  13.201   0.329  -6.951
  411    HA   PRO1160           HA       PRO1160  11.860  -3.371  -2.634
  412   1HB   PRO1160           HB2      PRO1160   9.981  -1.114  -3.171
  413   2HB   PRO1160           HB1      PRO1160  10.496  -1.805  -1.628
  414   1HG   PRO1160           HG2      PRO1160  11.492   0.510  -2.439
  415   2HG   PRO1160           HG1      PRO1160  12.542  -0.696  -1.667
  416   1HD   PRO1160           HD2      PRO1160  12.280   0.029  -4.555
  417   2HD   PRO1160           HD1      PRO1160  13.737  -0.375  -3.624
  418    HA   PRO1161           HA       PRO1161   8.916  -5.535  -5.098
  419   1HB   PRO1161           HB2      PRO1161   6.751  -5.826  -3.472
  420   2HB   PRO1161           HB1      PRO1161   8.251  -6.734  -3.262
  421   1HG   PRO1161           HG2      PRO1161   7.305  -4.279  -1.836
  422   2HG   PRO1161           HG1      PRO1161   8.086  -5.727  -1.174
  423   1HD   PRO1161           HD2      PRO1161   9.442  -3.439  -1.622
  424   2HD   PRO1161           HD1      PRO1161  10.193  -5.036  -1.813
  425    H    LYS1162           HN       LYS1162   5.939  -4.806  -4.022
  426    HA   LYS1162           HA       LYS1162   5.612  -2.383  -5.636
  427   1HB   LYS1162           HB2      LYS1162   3.694  -3.384  -6.837
  428   2HB   LYS1162           HB1      LYS1162   5.218  -4.179  -7.208
  429   1HG   LYS1162           HG2      LYS1162   4.650  -5.991  -5.672
  430   2HG   LYS1162           HG1      LYS1162   3.120  -5.194  -5.302
  431   1HD   LYS1162           HD2      LYS1162   2.443  -5.396  -7.640
  432   2HD   LYS1162           HD1      LYS1162   3.979  -6.175  -8.023
  433   1HE   LYS1162           HE2      LYS1162   3.429  -8.011  -6.507
  434   2HE   LYS1162           HE1      LYS1162   1.895  -7.232  -6.118
  435   1HZ   LYS1162           HZ1      LYS1162   2.706  -8.205  -8.805
  436   2HZ   LYS1162           HZ3      LYS1162   1.608  -8.969  -7.767
  437   3HZ   LYS1162           HZ2      LYS1162   1.235  -7.458  -8.431
  438    H    CYS1163           HN       CYS1163   4.218  -0.972  -4.763
  439    HA   CYS1163           HA       CYS1163   2.827  -1.767  -2.341
  440   1HB   CYS1163           HB2      CYS1163   3.076   0.961  -3.613
  441   2HB   CYS1163           HB1      CYS1163   2.450   0.616  -2.004
  442    H    LEU1164           HN       LEU1164   0.667  -1.741  -2.025
  443    HA   LEU1164           HA       LEU1164  -1.007  -1.429  -4.426
  444   1HB   LEU1164           HB2      LEU1164  -1.335  -3.155  -1.976
  445   2HB   LEU1164           HB1      LEU1164  -2.642  -2.864  -3.106
  446    HG   LEU1164           HG       LEU1164  -1.598  -5.010  -3.551
  447   1HD1  LEU1164          3HD1      LEU1164  -2.494  -3.774  -5.444
  448   2HD1  LEU1164          2HD1      LEU1164  -0.939  -2.972  -5.672
  449   3HD1  LEU1164          1HD1      LEU1164  -1.079  -4.713  -5.922
  450   1HD2  LEU1164          3HD2      LEU1164   0.617  -4.549  -2.653
  451   2HD2  LEU1164          2HD2      LEU1164   0.718  -5.173  -4.300
  452   3HD2  LEU1164          1HD2      LEU1164   0.942  -3.451  -3.995
  453    H    HIS1165           HN       HIS1165  -1.889   0.529  -4.417
  454    HA   HIS1165           HA       HIS1165  -2.273   2.246  -2.312
  455   1HB   HIS1165           HB2      HIS1165  -4.029   1.960  -4.761
  456   2HB   HIS1165           HB1      HIS1165  -3.978   3.367  -3.705
  457    HD1  HIS1165           HD1      HIS1165  -2.321   5.133  -4.285
  458    HD2  HIS1165           HD2      HIS1165  -1.489   1.517  -6.157
  459    HE1  HIS1165           HE1      HIS1165  -0.423   5.614  -5.863
  460    HE2  HIS1165           HE2      HIS1165   0.122   3.392  -6.919
  461    HA   PRO1166           HA       PRO1166  -5.343   0.530   0.348
  462   1HB   PRO1166           HB2      PRO1166  -6.701   2.891   0.946
  463   2HB   PRO1166           HB1      PRO1166  -5.274   2.287   1.793
  464   1HG   PRO1166           HG2      PRO1166  -5.474   4.338  -0.368
  465   2HG   PRO1166           HG1      PRO1166  -4.419   4.306   1.057
  466   1HD   PRO1166           HD2      PRO1166  -3.480   3.699  -1.371
  467   2HD   PRO1166           HD1      PRO1166  -2.930   2.820   0.070
  468    H    CYS1167           HN       CYS1167  -7.748   0.480   0.635
  469    HA   CYS1167           HA       CYS1167  -8.959   0.120  -1.923
  470   1HB   CYS1167           HB2      CYS1167 -11.019  -0.252  -0.311
  471   2HB   CYS1167           HB1      CYS1167  -9.752  -1.461  -0.480
  472    H    VAL1168           HN       VAL1168  -8.535   2.527  -2.374
  473    HA   VAL1168           HA       VAL1168 -10.330   4.421  -1.231
  474    HB   VAL1168           HB       VAL1168  -8.293   5.256  -2.173
  475   1HG1  VAL1168          3HG1      VAL1168  -9.196   4.080  -4.799
  476   2HG1  VAL1168          2HG1      VAL1168  -7.771   5.092  -4.565
  477   3HG1  VAL1168          1HG1      VAL1168  -7.862   3.505  -3.799
  478   1HG2  VAL1168          1HG2      VAL1168 -10.633   6.048  -3.900
  479   2HG2  VAL1168          3HG2      VAL1168 -10.189   6.752  -2.346
  480   3HG2  VAL1168          2HG2      VAL1168  -9.130   6.957  -3.742
  481    H    ILE1169           HN       ILE1169 -12.356   3.354  -1.416
  482    HA   ILE1169           HA       ILE1169 -13.400   2.763  -4.046
  483    HB   ILE1169           HB       ILE1169 -13.915   1.553  -1.786
  484   1HG1  ILE1169          2HG1      ILE1169 -16.117   2.188  -3.758
  485   2HG1  ILE1169          1HG1      ILE1169 -14.877   0.955  -3.970
  486   1HG2  ILE1169          2HG2      ILE1169 -15.949   3.769  -1.745
  487   2HG2  ILE1169          1HG2      ILE1169 -16.003   2.317  -0.743
  488   3HG2  ILE1169          3HG2      ILE1169 -14.682   3.470  -0.554
  489   1HD1  ILE1169          1HD1      ILE1169 -16.954   0.989  -1.792
  490   2HD1  ILE1169          3HD1      ILE1169 -17.000  -0.003  -3.251
  491   3HD1  ILE1169          2HD1      ILE1169 -15.734  -0.258  -2.050
  492    H    SER1170           HN       SER1170 -15.968   3.615  -4.066
  493    HA   SER1170           HA       SER1170 -15.621   6.526  -4.192
  494   1HB   SER1170           HB2      SER1170 -17.644   4.743  -5.564
  495   2HB   SER1170           HB1      SER1170 -17.525   6.492  -5.764
  496    HG   SER1170           HG       SER1170 -15.215   5.922  -6.354
  497    H    ARG1171           HN       ARG1171 -16.387   7.620  -2.522
  498    HA   ARG1171           HA       ARG1171 -18.358   6.649  -0.709
  499   1HB   ARG1171           HB2      ARG1171 -18.284   8.932   0.231
  500   2HB   ARG1171           HB1      ARG1171 -16.674   8.261   0.003
  501   1HG   ARG1171           HG2      ARG1171 -16.415   9.561  -2.045
  502   2HG   ARG1171           HG1      ARG1171 -18.033  10.231  -1.825
  503   1HD   ARG1171           HD2      ARG1171 -17.328  11.230   0.296
  504   2HD   ARG1171           HD1      ARG1171 -15.710  10.564   0.071
  505    HE   ARG1171           HE       ARG1171 -16.382  12.116  -2.170
  506   1HH1  ARG1171          1HH1      ARG1171 -15.623  12.478   1.211
  507   2HH1  ARG1171          2HH1      ARG1171 -14.961  14.068   1.024
  508   1HH2  ARG1171          1HH2      ARG1171 -15.513  14.207  -2.425
  509   2HH2  ARG1171          2HH2      ARG1171 -14.899  15.051  -1.043
  510    H    GLU1172           HN       GLU1172 -18.409   8.635  -3.583
  511    HA   GLU1172           HA       GLU1172 -21.093   9.563  -3.275
  512   1HB   GLU1172           HB2      GLU1172 -19.307  10.680  -4.661
  513   2HB   GLU1172           HB1      GLU1172 -19.484   9.375  -5.827
  514   1HG   GLU1172           HG2      GLU1172 -21.818   9.996  -6.173
  515   2HG   GLU1172           HG1      GLU1172 -21.644  11.302  -5.001
  516    H    ILE1173           HN       ILE1173 -20.070   6.557  -3.546
  517    HA   ILE1173           HA       ILE1173 -22.356   5.715  -5.197
  518    HB   ILE1173           HB       ILE1173 -19.671   4.355  -4.962
  519   1HG1  ILE1173          2HG1      ILE1173 -19.848   6.428  -6.395
  520   2HG1  ILE1173          1HG1      ILE1173 -19.310   4.976  -7.236
  521   1HG2  ILE1173          3HG2      ILE1173 -21.526   2.752  -5.091
  522   2HG2  ILE1173          2HG2      ILE1173 -22.089   3.538  -6.567
  523   3HG2  ILE1173          1HG2      ILE1173 -20.525   2.725  -6.543
  524   1HD1  ILE1173          2HD1      ILE1173 -22.087   6.135  -7.295
  525   2HD1  ILE1173          1HD1      ILE1173 -20.882   6.242  -8.578
  526   3HD1  ILE1173          3HD1      ILE1173 -21.561   4.676  -8.135
  527    H    MET1174           HN       MET1174 -20.351   5.138  -2.366
  528    HA   MET1174           HA       MET1174 -22.137   3.006  -1.492
  529   1HB   MET1174           HB2      MET1174 -20.539   2.776   0.414
  530   2HB   MET1174           HB1      MET1174 -19.818   2.518  -1.168
  531   1HG   MET1174           HG2      MET1174 -18.476   4.313  -1.006
  532   2HG   MET1174           HG1      MET1174 -19.671   5.262  -0.123
  533   1HE   MET1174           HE3      MET1174 -20.101   5.071   2.471
  534   2HE   MET1174           HE2      MET1174 -20.425   3.348   2.283
  535   3HE   MET1174           HE1      MET1174 -19.293   3.903   3.516
  536    H    GLU1175           HN       GLU1175 -20.771   5.956   0.008
  537    HA   GLU1175           HA       GLU1175 -22.896   6.015   1.945
  538   1HB   GLU1175           HB2      GLU1175 -21.703   7.687   3.010
  539   2HB   GLU1175           HB1      GLU1175 -20.410   6.825   2.182
  540   1HG   GLU1175           HG2      GLU1175 -20.268   8.480   0.493
  541   2HG   GLU1175           HG1      GLU1175 -21.748   9.263   1.043
  542    H    ASN1176           HN       ASN1176 -23.172   6.484  -1.141
  543    HA   ASN1176           HA       ASN1176 -24.667   9.006  -0.990
  544   1HB   ASN1176           HB2      ASN1176 -22.800   8.763  -2.664
  545   2HB   ASN1176           HB1      ASN1176 -23.812   7.573  -3.472
  546   1HD2  ASN1176          1HD2      ASN1176 -25.677   8.226  -4.527
  547   2HD2  ASN1176          2HD2      ASN1176 -25.980   9.880  -4.921
  548    H    TYR1177           HN       TYR1177 -24.901   5.977  -2.890
  549    HA   TYR1177           HA       TYR1177 -27.617   6.274  -3.476
  550   1HB   TYR1177           HB2      TYR1177 -25.996   3.729  -3.291
  551   2HB   TYR1177           HB1      TYR1177 -27.578   3.870  -4.049
  552    HD1  TYR1177           HD1      TYR1177 -27.336   6.367  -5.568
  553    HD2  TYR1177           HD2      TYR1177 -24.519   3.235  -4.993
  554    HE1  TYR1177           HE1      TYR1177 -26.260   6.952  -7.700
  555    HE2  TYR1177           HE2      TYR1177 -23.431   3.809  -7.115
  556    HH   TYR1177           HH       TYR1177 -24.070   6.692  -8.790
  557    H    ASN1178           HN       ASN1178 -26.400   3.658  -1.416
  558    HA   ASN1178           HA       ASN1178 -28.161   4.288   0.724
  559   1HB   ASN1178           HB2      ASN1178 -28.794   1.704  -0.693
  560   2HB   ASN1178           HB1      ASN1178 -29.715   2.505   0.574
  561   1HD2  ASN1178          1HD2      ASN1178 -29.074   2.294  -2.792
  562   2HD2  ASN1178          2HD2      ASN1178 -30.300   3.391  -3.316
  563    H    ILE1179           HN       ILE1179 -25.313   3.411  -0.030
  564    HA   ILE1179           HA       ILE1179 -25.103   1.000   1.617
  565    HB   ILE1179           HB       ILE1179 -22.724   2.328   0.378
  566   1HG1  ILE1179          2HG1      ILE1179 -24.680   0.523  -1.067
  567   2HG1  ILE1179          1HG1      ILE1179 -24.327   2.204  -1.458
  568   1HG2  ILE1179          3HG2      ILE1179 -23.468  -0.532   0.960
  569   2HG2  ILE1179          2HG2      ILE1179 -21.947  -0.001   0.239
  570   3HG2  ILE1179          1HG2      ILE1179 -22.356   0.478   1.886
  571   1HD1  ILE1179          2HD1      ILE1179 -21.980   1.530  -1.937
  572   2HD1  ILE1179          1HD1      ILE1179 -22.466  -0.148  -1.700
  573   3HD1  ILE1179          3HD1      ILE1179 -23.173   0.797  -3.011
  574    H    ALA1180           HN       ALA1180 -23.217   0.933   3.161
  575    HA   ALA1180           HA       ALA1180 -22.422   3.447   4.350
  576   1HB   ALA1180           HB1      ALA1180 -24.682   2.961   5.319
  577   2HB   ALA1180           HB3      ALA1180 -23.995   1.497   6.028
  578   3HB   ALA1180           HB2      ALA1180 -23.383   3.080   6.506
  579    H    LEU1181           HN       LEU1181 -21.528   2.487   6.794
  580    HA   LEU1181           HA       LEU1181 -19.635   0.368   6.007
  581   1HB   LEU1181           HB2      LEU1181 -19.138   3.038   6.954
  582   2HB   LEU1181           HB1      LEU1181 -18.499   1.877   8.101
  583    HG   LEU1181           HG       LEU1181 -16.781   2.531   6.516
  584   1HD1  LEU1181          1HD1      LEU1181 -16.722   0.252   7.367
  585   2HD1  LEU1181          3HD1      LEU1181 -17.742  -0.284   6.031
  586   3HD1  LEU1181          2HD1      LEU1181 -16.117   0.322   5.713
  587   1HD2  LEU1181          1HD2      LEU1181 -18.664   1.497   4.402
  588   2HD2  LEU1181          3HD2      LEU1181 -18.176   3.175   4.646
  589   3HD2  LEU1181          2HD2      LEU1181 -16.988   1.977   4.133
  590    H    ARG1182           HN       ARG1182 -18.902  -1.039   7.722
  591    HA   ARG1182           HA       ARG1182 -20.970  -1.905   9.406
  592   1HB   ARG1182           HB2      ARG1182 -19.346  -3.431  10.379
  593   2HB   ARG1182           HB1      ARG1182 -19.156  -3.376   8.633
  594   1HG   ARG1182           HG2      ARG1182 -17.262  -1.818   8.928
  595   2HG   ARG1182           HG1      ARG1182 -17.421  -2.011  10.674
  596   1HD   ARG1182           HD2      ARG1182 -17.050  -4.434  10.411
  597   2HD   ARG1182           HD1      ARG1182 -16.813  -4.190   8.681
  598    HE   ARG1182           HE       ARG1182 -15.000  -3.353  10.822
  599   1HH1  ARG1182          1HH1      ARG1182 -15.724  -3.612   7.426
  600   2HH1  ARG1182          2HH1      ARG1182 -14.094  -3.318   6.924
  601   1HH2  ARG1182          1HH2      ARG1182 -12.848  -2.968  10.171
  602   2HH2  ARG1182          2HH2      ARG1182 -12.459  -2.954   8.483
  603    H    TRP1183           HN       TRP1183 -19.008   0.748   9.702
  604    HA   TRP1183           HA       TRP1183 -19.205   0.817  12.634
  605   1HB   TRP1183           HB2      TRP1183 -17.674   2.803  10.969
  606   2HB   TRP1183           HB1      TRP1183 -17.420   2.346  12.651
  607    HD1  TRP1183           HD1      TRP1183 -16.959   0.871   9.106
  608    HE1  TRP1183           HE1      TRP1183 -15.020  -0.818   9.187
  609    HE3  TRP1183           HE3      TRP1183 -15.975   0.995  14.124
  610    HZ2  TRP1183           HZ2      TRP1183 -13.295  -1.930  11.105
  611    HZ3  TRP1183           HZ3      TRP1183 -14.156  -0.412  15.000
  612    HH2  TRP1183           HH2      TRP1183 -12.843  -1.846  13.521
  613    H    THR1184           HN       THR1184 -20.568   1.975   9.779
  614    HA   THR1184           HA       THR1184 -22.047   3.616   9.235
  615    HB   THR1184           HB       THR1184 -23.868   3.994  10.843
  616    HG1  THR1184           HG1      THR1184 -23.731   3.138  12.917
  617   1HG2  THR1184          1HG2      THR1184 -22.951   1.116  10.723
  618   2HG2  THR1184          3HG2      THR1184 -24.590   1.658  11.087
  619   3HG2  THR1184          2HG2      THR1184 -23.896   1.954   9.493
  620    H    ALA1185           HN       ALA1185 -19.597   4.678   9.841
  621    HA   ALA1185           HA       ALA1185 -20.132   7.014  11.531
  622   1HB   ALA1185           HB1      ALA1185 -17.516   6.025  10.403
  623   2HB   ALA1185           HB2      ALA1185 -18.110   5.732  12.038
  624   3HB   ALA1185           HB3      ALA1185 -17.726   7.374  11.521
  625    H    LYS1186           HN       LYS1186 -20.799   6.348   8.517
  626    HA   LYS1186           HA       LYS1186 -21.232   7.606   6.689
  627   1HB   LYS1186           HB2      LYS1186 -20.222   9.824   8.460
  628   2HB   LYS1186           HB1      LYS1186 -20.812  10.096   6.826
  629   1HG   LYS1186           HG2      LYS1186 -22.993   9.199   7.465
  630   2HG   LYS1186           HG1      LYS1186 -22.397   8.923   9.104
  631   1HD   LYS1186           HD2      LYS1186 -23.663  10.973   9.060
  632   2HD   LYS1186           HD1      LYS1186 -21.956  11.353   9.305
  633   1HE   LYS1186           HE2      LYS1186 -21.734  11.885   6.926
  634   2HE   LYS1186           HE1      LYS1186 -23.438  11.503   6.682
  635   1HZ   LYS1186           HZ3      LYS1186 -24.020  13.306   8.183
  636   2HZ   LYS1186           HZ2      LYS1186 -22.384  13.673   8.415
  637   3HZ   LYS1186           HZ1      LYS1186 -23.089  13.881   6.892
  638    H    GLN1187           HN       GLN1187 -20.037   7.022   5.071
  639    HA   GLN1187           HA       GLN1187 -18.419   7.196   3.461
  640   1HB   GLN1187           HB2      GLN1187 -17.993   9.530   4.329
  641   2HB   GLN1187           HB1      GLN1187 -16.770   8.837   5.386
  642   1HG   GLN1187           HG2      GLN1187 -15.653   7.932   3.333
  643   2HG   GLN1187           HG1      GLN1187 -16.783   8.897   2.385
  644   1HE2  GLN1187          1HE2      GLN1187 -16.623  11.138   2.409
  645   2HE2  GLN1187          2HE2      GLN1187 -15.205  11.950   2.970
  646    H    LYS1188           HN       LYS1188 -16.023   7.480   5.989
  647    HA   LYS1188           HA       LYS1188 -14.225   6.040   6.343
  648   1HB   LYS1188           HB2      LYS1188 -16.126   5.702   8.057
  649   2HB   LYS1188           HB1      LYS1188 -16.429   4.189   7.214
  650   1HG   LYS1188           HG2      LYS1188 -14.214   3.399   7.722
  651   2HG   LYS1188           HG1      LYS1188 -13.787   4.953   8.440
  652   1HD   LYS1188           HD2      LYS1188 -15.530   4.615  10.149
  653   2HD   LYS1188           HD1      LYS1188 -15.885   3.035   9.448
  654   1HE   LYS1188           HE2      LYS1188 -14.433   2.824  11.396
  655   2HE   LYS1188           HE1      LYS1188 -13.608   2.302   9.928
  656   1HZ   LYS1188           HZ3      LYS1188 -12.491   4.443   9.840
  657   2HZ   LYS1188           HZ2      LYS1188 -13.281   4.942  11.249
  658   3HZ   LYS1188           HZ1      LYS1188 -12.175   3.665  11.308
  659    H    LEU1189           HN       LEU1189 -14.550   5.848   3.730
  660    HA   LEU1189           HA       LEU1189 -14.962   3.051   2.995
  661   1HB   LEU1189           HB2      LEU1189 -15.257   3.789   0.798
  662   2HB   LEU1189           HB1      LEU1189 -16.087   4.961   1.797
  663    HG   LEU1189           HG       LEU1189 -13.360   5.337   0.560
  664   1HD1  LEU1189          1HD1      LEU1189 -16.041   6.516  -0.147
  665   2HD1  LEU1189          3HD1      LEU1189 -14.495   7.016  -0.834
  666   3HD1  LEU1189          2HD1      LEU1189 -15.099   5.384  -1.119
  667   1HD2  LEU1189          2HD2      LEU1189 -13.682   6.487   2.726
  668   2HD2  LEU1189          1HD2      LEU1189 -13.455   7.587   1.365
  669   3HD2  LEU1189          3HD2      LEU1189 -15.068   7.324   2.028
  670    H    TYR1190           HN       TYR1190 -12.429   4.419   4.252
  671    HA   TYR1190           HA       TYR1190 -10.559   3.370   2.233
  672   1HB   TYR1190           HB2      TYR1190 -10.239   5.655   4.168
  673   2HB   TYR1190           HB1      TYR1190  -8.868   4.908   3.357
  674    HD1  TYR1190           HD1      TYR1190 -11.453   4.670   1.059
  675    HD2  TYR1190           HD2      TYR1190  -8.885   7.572   2.838
  676    HE1  TYR1190           HE1      TYR1190 -11.782   6.154  -0.876
  677    HE2  TYR1190           HE2      TYR1190  -9.216   9.057   0.909
  678    HH   TYR1190           HH       TYR1190  -9.860   8.886  -1.457
  679    H    SER1191           HN       SER1191  -9.014   1.972   2.795
  680    HA   SER1191           HA       SER1191  -8.361   1.404   5.549
  681   1HB   SER1191           HB2      SER1191  -9.941  -0.485   3.871
  682   2HB   SER1191           HB1      SER1191  -8.802  -1.120   5.049
  683    HG   SER1191           HG       SER1191 -10.969  -0.831   5.862
  684    H    ARG1192           HN       ARG1192  -6.653  -0.319   5.680
  685    HA   ARG1192           HA       ARG1192  -4.672   0.197   3.666
  686   1HB   ARG1192           HB2      ARG1192  -4.046  -0.018   6.035
  687   2HB   ARG1192           HB1      ARG1192  -4.620  -1.680   6.041
  688   1HG   ARG1192           HG2      ARG1192  -2.911  -2.259   4.371
  689   2HG   ARG1192           HG1      ARG1192  -2.315  -0.599   4.431
  690   1HD   ARG1192           HD2      ARG1192  -0.980  -2.133   5.819
  691   2HD   ARG1192           HD1      ARG1192  -1.737  -0.850   6.763
  692    HE   ARG1192           HE       ARG1192  -3.422  -3.088   6.775
  693   1HH1  ARG1192          1HH1      ARG1192  -0.323  -2.075   8.005
  694   2HH1  ARG1192          2HH1      ARG1192  -0.389  -3.113   9.390
  695   1HH2  ARG1192          1HH2      ARG1192  -3.517  -4.458   8.595
  696   2HH2  ARG1192          2HH2      ARG1192  -2.205  -4.468   9.725
  697    H    THR1193           HN       THR1193  -4.419  -0.933   1.852
  698    HA   THR1193           HA       THR1193  -6.040  -2.890   0.923
  699    HB   THR1193           HB       THR1193  -3.090  -2.569   0.330
  700    HG1  THR1193           HG1      THR1193  -5.472  -1.474  -0.696
  701   1HG2  THR1193          1HG2      THR1193  -3.833  -4.812  -0.307
  702   2HG2  THR1193          3HG2      THR1193  -5.175  -4.113  -1.213
  703   3HG2  THR1193          2HG2      THR1193  -3.516  -3.820  -1.730
  704    H    GLY1194           HN       GLY1194  -6.611  -4.694   1.891
  705   1HA   GLY1194           HA1      GLY1194  -4.617  -6.221   3.411
  706   2HA   GLY1194           HA2      GLY1194  -5.522  -7.034   2.139
  707    H    GLU1195           HN       GLU1195  -6.734  -4.553   4.309
  708    HA   GLU1195           HA       GLU1195  -8.110  -6.435   6.002
  709   1HB   GLU1195           HB2      GLU1195  -8.190  -3.415   5.843
  710   2HB   GLU1195           HB1      GLU1195  -9.068  -4.362   7.038
  711   1HG   GLU1195           HG2      GLU1195  -6.956  -5.240   7.894
  712   2HG   GLU1195           HG1      GLU1195  -6.078  -4.292   6.696
  713    H    SER1196           HN       SER1196 -10.373  -6.657   6.182
  714    HA   SER1196           HA       SER1196 -11.753  -6.328   3.649
  715   1HB   SER1196           HB2      SER1196 -13.514  -7.717   4.687
  716   2HB   SER1196           HB1      SER1196 -11.928  -8.479   4.796
  717    HG   SER1196           HG       SER1196 -12.774  -8.653   6.803
  718    H    VAL1197           HN       VAL1197 -13.287  -4.863   3.222
  719    HA   VAL1197           HA       VAL1197 -14.167  -3.132   5.436
  720    HB   VAL1197           HB       VAL1197 -13.997  -2.484   2.488
  721   1HG1  VAL1197          2HG1      VAL1197 -14.854  -0.772   4.820
  722   2HG1  VAL1197          1HG1      VAL1197 -14.610  -0.202   3.169
  723   3HG1  VAL1197          3HG1      VAL1197 -15.890  -1.364   3.522
  724   1HG2  VAL1197          1HG2      VAL1197 -11.815  -2.573   3.584
  725   2HG2  VAL1197          3HG2      VAL1197 -12.245  -0.918   3.149
  726   3HG2  VAL1197          2HG2      VAL1197 -12.388  -1.456   4.823
  727    H    GLU1198           HN       GLU1198 -16.088  -3.806   6.110
  728    HA   GLU1198           HA       GLU1198 -18.010  -4.943   4.266
  729   1HB   GLU1198           HB2      GLU1198 -18.145  -6.153   6.194
  730   2HB   GLU1198           HB1      GLU1198 -17.687  -4.792   7.208
  731   1HG   GLU1198           HG2      GLU1198 -19.878  -3.911   7.179
  732   2HG   GLU1198           HG1      GLU1198 -20.380  -5.017   5.896
  733    H    PHE1199           HN       PHE1199 -19.342  -3.693   3.147
  734    HA   PHE1199           HA       PHE1199 -20.049  -1.047   4.182
  735   1HB   PHE1199           HB2      PHE1199 -20.623  -2.235   1.459
  736   2HB   PHE1199           HB1      PHE1199 -20.860  -0.562   1.940
  737    HD1  PHE1199           HD1      PHE1199 -19.112   1.008   1.806
  738    HD2  PHE1199           HD2      PHE1199 -18.312  -3.137   1.301
  739    HE1  PHE1199           HE1      PHE1199 -16.851   1.551   0.985
  740    HE2  PHE1199           HE2      PHE1199 -16.061  -2.611   0.490
  741    HZ   PHE1199           HZ       PHE1199 -15.320  -0.266   0.332
  742    H    VAL1200           HN       VAL1200 -21.876  -0.927   5.352
  743    HA   VAL1200           HA       VAL1200 -23.891  -2.961   5.254
  744    HB   VAL1200           HB       VAL1200 -24.406  -0.263   6.450
  745   1HG1  VAL1200          2HG1      VAL1200 -25.063  -3.070   7.332
  746   2HG1  VAL1200          1HG1      VAL1200 -25.522  -1.593   8.182
  747   3HG1  VAL1200          3HG1      VAL1200 -26.169  -1.924   6.574
  748   1HG2  VAL1200          3HG2      VAL1200 -22.562  -2.352   7.593
  749   2HG2  VAL1200          2HG2      VAL1200 -22.148  -0.701   7.128
  750   3HG2  VAL1200          1HG2      VAL1200 -23.218  -0.987   8.499
  751    H    CYS1201           HN       CYS1201 -26.309  -1.846   5.206
  752    HA   CYS1201           HA       CYS1201 -26.446  -0.631   2.532
  753   1HB   CYS1201           HB2      CYS1201 -28.623  -2.099   4.032
  754   2HB   CYS1201           HB1      CYS1201 -28.706  -1.503   2.380
  755    H    LYS1202           HN       LYS1202 -25.787   1.155   4.321
  756    HA   LYS1202           HA       LYS1202 -26.366   2.999   5.533
  757   1HB   LYS1202           HB2      LYS1202 -26.764   3.776   3.281
  758   2HB   LYS1202           HB1      LYS1202 -28.390   3.105   3.301
  759   1HG   LYS1202           HG2      LYS1202 -29.061   4.670   5.009
  760   2HG   LYS1202           HG1      LYS1202 -27.412   5.291   5.127
  761   1HD   LYS1202           HD2      LYS1202 -27.521   6.083   2.848
  762   2HD   LYS1202           HD1      LYS1202 -29.144   5.403   2.663
  763   1HE   LYS1202           HE2      LYS1202 -29.341   7.764   3.074
  764   2HE   LYS1202           HE1      LYS1202 -29.902   6.892   4.501
  765   1HZ   LYS1202           HZ1      LYS1202 -27.770   7.304   5.554
  766   2HZ   LYS1202           HZ3      LYS1202 -27.227   8.138   4.186
  767   3HZ   LYS1202           HZ2      LYS1202 -28.503   8.760   5.106
  768    H    ARG1203           HN       ARG1203 -27.079   2.598   7.470
  769    HA   ARG1203           HA       ARG1203 -28.590   1.438   8.967
  770   1HB   ARG1203           HB2      ARG1203 -29.525   4.252   8.664
  771   2HB   ARG1203           HB1      ARG1203 -29.299   3.334  10.145
  772   1HG   ARG1203           HG2      ARG1203 -26.851   3.378   9.709
  773   2HG   ARG1203           HG1      ARG1203 -27.165   4.428   8.319
  774   1HD   ARG1203           HD2      ARG1203 -26.511   5.723  10.286
  775   2HD   ARG1203           HD1      ARG1203 -28.162   6.092   9.794
  776    HE   ARG1203           HE       ARG1203 -28.186   4.069  11.754
  777   1HH1  ARG1203          1HH1      ARG1203 -27.585   7.481  11.392
  778   2HH1  ARG1203          2HH1      ARG1203 -28.048   7.866  13.015
  779   1HH2  ARG1203          1HH2      ARG1203 -28.798   4.566  13.893
  780   2HH2  ARG1203          2HH2      ARG1203 -28.738   6.209  14.437
  781    H    GLY1204           HN       GLY1204 -29.927   0.072   7.370
  782   1HA   GLY1204           HA1      GLY1204 -32.549   1.327   6.912
  783   2HA   GLY1204           HA2      GLY1204 -32.461  -0.154   7.842
  784    H    TYR1205           HN       TYR1205 -31.330   1.078   4.668
  785    HA   TYR1205           HA       TYR1205 -32.887  -0.461   3.057
  786   1HB   TYR1205           HB2      TYR1205 -30.006   0.206   2.497
  787   2HB   TYR1205           HB1      TYR1205 -31.200  -0.255   1.302
  788    HD1  TYR1205           HD1      TYR1205 -32.975   1.303   0.664
  789    HD2  TYR1205           HD2      TYR1205 -29.956   2.425   3.437
  790    HE1  TYR1205           HE1      TYR1205 -33.586   3.664   0.359
  791    HE2  TYR1205           HE2      TYR1205 -30.559   4.791   3.142
  792    HH   TYR1205           HH       TYR1205 -31.651   6.220   1.465
  793    H    ARG1206           HN       ARG1206 -32.546  -2.322   1.791
  794    HA   ARG1206           HA       ARG1206 -30.924  -4.394   3.112
  795   1HB   ARG1206           HB2      ARG1206 -32.788  -5.972   2.335
  796   2HB   ARG1206           HB1      ARG1206 -33.130  -4.935   3.715
  797   1HG   ARG1206           HG2      ARG1206 -34.565  -3.584   2.512
  798   2HG   ARG1206           HG1      ARG1206 -33.868  -4.046   0.957
  799   1HD   ARG1206           HD2      ARG1206 -34.829  -6.292   1.215
  800   2HD   ARG1206           HD1      ARG1206 -35.533  -5.809   2.758
  801    HE   ARG1206           HE       ARG1206 -36.441  -3.996   0.877
  802   1HH1  ARG1206          1HH1      ARG1206 -36.657  -7.427   1.445
  803   2HH1  ARG1206          2HH1      ARG1206 -38.208  -7.583   0.690
  804   1HH2  ARG1206          1HH2      ARG1206 -38.483  -4.193  -0.118
  805   2HH2  ARG1206          2HH2      ARG1206 -39.246  -5.746  -0.199
  806    H    LEU1207           HN       LEU1207 -29.702  -5.639   1.828
  807    HA   LEU1207           HA       LEU1207 -28.831  -5.000  -0.640
  808   1HB   LEU1207           HB2      LEU1207 -29.091  -7.649   0.716
  809   2HB   LEU1207           HB1      LEU1207 -28.540  -7.598  -0.947
  810    HG   LEU1207           HG       LEU1207 -27.206  -6.095   1.307
  811   1HD1  LEU1207          1HD1      LEU1207 -27.067  -8.509   1.682
  812   2HD1  LEU1207          3HD1      LEU1207 -26.437  -8.725   0.049
  813   3HD1  LEU1207          2HD1      LEU1207 -25.498  -7.832   1.245
  814   1HD2  LEU1207          2HD2      LEU1207 -26.327  -6.719  -1.510
  815   2HD2  LEU1207          1HD2      LEU1207 -26.824  -5.139  -0.899
  816   3HD2  LEU1207          3HD2      LEU1207 -25.355  -5.901  -0.285
  817    H    SER1208           HN       SER1208 -29.421  -5.201  -2.735
  818    HA   SER1208           HA       SER1208 -32.183  -5.914  -3.262
  819   1HB   SER1208           HB2      SER1208 -31.276  -3.850  -4.234
  820   2HB   SER1208           HB1      SER1208 -30.057  -4.785  -5.099
  821    HG   SER1208           HG       SER1208 -32.861  -5.085  -5.424
  822    H    SER1209           HN       SER1209 -29.490  -7.664  -2.983
  823    HA   SER1209           HA       SER1209 -28.994  -9.819  -3.527
  824   1HB   SER1209           HB2      SER1209 -31.392 -10.305  -3.618
  825   2HB   SER1209           HB1      SER1209 -31.464  -9.699  -5.273
  826    HG   SER1209           HG       SER1209 -29.926 -11.914  -4.383
  827    H    ARG1210           HN       ARG1210 -30.033  -7.873  -6.317
  828    HA   ARG1210           HA       ARG1210 -28.340  -9.141  -8.189
  829   1HB   ARG1210           HB2      ARG1210 -29.501  -6.349  -8.227
  830   2HB   ARG1210           HB1      ARG1210 -28.773  -7.164  -9.603
  831   1HG   ARG1210           HG2      ARG1210 -30.516  -8.874  -9.515
  832   2HG   ARG1210           HG1      ARG1210 -31.248  -8.052  -8.134
  833   1HD   ARG1210           HD2      ARG1210 -32.408  -7.492 -10.205
  834   2HD   ARG1210           HD1      ARG1210 -31.632  -6.072  -9.506
  835    HE   ARG1210           HE       ARG1210 -29.873  -7.230 -11.353
  836   1HH1  ARG1210          1HH1      ARG1210 -32.929  -5.556 -11.278
  837   2HH1  ARG1210          2HH1      ARG1210 -32.738  -4.871 -12.858
  838   1HH2  ARG1210          1HH2      ARG1210 -29.614  -6.332 -13.432
  839   2HH2  ARG1210          2HH2      ARG1210 -30.855  -5.313 -14.083
  840    H    SER1211           HN       SER1211 -27.666  -7.101  -5.607
  841    HA   SER1211           HA       SER1211 -25.504  -5.592  -6.611
  842   1HB   SER1211           HB2      SER1211 -26.203  -6.494  -3.812
  843   2HB   SER1211           HB1      SER1211 -24.865  -5.402  -4.172
  844    HG   SER1211           HG       SER1211 -27.623  -4.971  -4.347
  845    H    HIS1212           HN       HIS1212 -23.275  -5.949  -5.293
  846    HA   HIS1212           HA       HIS1212 -22.324  -8.546  -6.230
  847   1HB   HIS1212           HB2      HIS1212 -20.749  -6.152  -5.255
  848   2HB   HIS1212           HB1      HIS1212 -20.080  -7.598  -6.005
  849    HD1  HIS1212           HD1      HIS1212 -20.507  -7.899  -8.575
  850    HD2  HIS1212           HD2      HIS1212 -21.749  -4.257  -7.005
  851    HE1  HIS1212           HE1      HIS1212 -20.894  -6.407 -10.563
  852    HE2  HIS1212           HE2      HIS1212 -21.731  -4.238  -9.592
  853    H    THR1213           HN       THR1213 -21.200  -6.570  -3.506
  854    HA   THR1213           HA       THR1213 -22.038  -8.425  -1.515
  855    HB   THR1213           HB       THR1213 -20.341  -9.890  -1.993
  856    HG1  THR1213           HG1      THR1213 -18.448  -8.866  -0.541
  857   1HG2  THR1213          3HG2      THR1213 -19.328  -8.603  -3.811
  858   2HG2  THR1213          2HG2      THR1213 -18.533  -7.558  -2.633
  859   3HG2  THR1213          1HG2      THR1213 -18.090  -9.262  -2.741
  860    H    LEU1214           HN       LEU1214 -21.354  -7.836   0.624
  861    HA   LEU1214           HA       LEU1214 -20.988  -4.956   0.858
  862   1HB   LEU1214           HB2      LEU1214 -21.528  -6.965   3.037
  863   2HB   LEU1214           HB1      LEU1214 -21.733  -5.225   3.123
  864    HG   LEU1214           HG       LEU1214 -23.322  -6.966   1.246
  865   1HD1  LEU1214          2HD1      LEU1214 -24.042  -6.036   4.018
  866   2HD1  LEU1214          1HD1      LEU1214 -25.145  -6.803   2.876
  867   3HD1  LEU1214          3HD1      LEU1214 -23.764  -7.701   3.506
  868   1HD2  LEU1214          1HD2      LEU1214 -23.099  -4.529   0.765
  869   2HD2  LEU1214          3HD2      LEU1214 -24.755  -5.072   1.042
  870   3HD2  LEU1214          2HD2      LEU1214 -23.885  -4.208   2.312
  871    H    ARG1215           HN       ARG1215 -19.694  -7.824   2.533
  872    HA   ARG1215           HA       ARG1215 -17.378  -6.332   3.406
  873   1HB   ARG1215           HB2      ARG1215 -18.563  -8.135   4.759
  874   2HB   ARG1215           HB1      ARG1215 -17.817  -9.303   3.676
  875   1HG   ARG1215           HG2      ARG1215 -15.598  -8.443   4.334
  876   2HG   ARG1215           HG1      ARG1215 -16.392  -7.364   5.485
  877   1HD   ARG1215           HD2      ARG1215 -17.343  -9.299   6.640
  878   2HD   ARG1215           HD1      ARG1215 -16.551 -10.377   5.491
  879    HE   ARG1215           HE       ARG1215 -14.644  -8.692   6.714
  880   1HH1  ARG1215          1HH1      ARG1215 -16.680 -11.440   7.383
  881   2HH1  ARG1215          2HH1      ARG1215 -15.628 -12.085   8.599
  882   1HH2  ARG1215          1HH2      ARG1215 -13.254  -9.535   8.312
  883   2HH2  ARG1215          2HH2      ARG1215 -13.681 -11.002   9.127
  884    H    THR1216           HN       THR1216 -16.099  -5.811   1.691
  885    HA   THR1216           HA       THR1216 -15.199  -8.006  -0.049
  886    HB   THR1216           HB       THR1216 -16.201  -6.175  -1.285
  887    HG1  THR1216           HG1      THR1216 -14.552  -5.930  -2.737
  888   1HG2  THR1216          3HG2      THR1216 -14.102  -4.436   0.007
  889   2HG2  THR1216          2HG2      THR1216 -15.199  -3.932  -1.279
  890   3HG2  THR1216          1HG2      THR1216 -15.839  -4.368   0.306
  891    H    THR1217           HN       THR1217 -12.886  -7.168  -1.020
  892    HA   THR1217           HA       THR1217 -11.162  -6.894   1.356
  893    HB   THR1217           HB       THR1217 -10.822  -8.498  -1.159
  894    HG1  THR1217           HG1      THR1217 -10.483  -9.061   1.616
  895   1HG2  THR1217          3HG2      THR1217  -8.772  -7.138  -0.888
  896   2HG2  THR1217          2HG2      THR1217  -8.596  -7.768   0.751
  897   3HG2  THR1217          1HG2      THR1217  -8.478  -8.859  -0.630
  898    H    CYS1218           HN       CYS1218  -9.607  -5.377   1.397
  899    HA   CYS1218           HA       CYS1218  -9.622  -3.302  -0.585
  900   1HB   CYS1218           HB2      CYS1218  -7.859  -3.768   1.831
  901   2HB   CYS1218           HB1      CYS1218  -7.796  -2.327   0.823
  902    H    TRP1219           HN       TRP1219  -8.658  -3.639  -2.511
  903    HA   TRP1219           HA       TRP1219  -5.893  -4.530  -2.509
  904   1HB   TRP1219           HB2      TRP1219  -7.683  -6.490  -2.800
  905   2HB   TRP1219           HB1      TRP1219  -7.626  -5.941  -4.472
  906    HD1  TRP1219           HD1      TRP1219  -4.943  -5.782  -5.463
  907    HE1  TRP1219           HE1      TRP1219  -3.105  -7.558  -5.177
  908    HE3  TRP1219           HE3      TRP1219  -6.839  -8.294  -1.433
  909    HZ2  TRP1219           HZ2      TRP1219  -2.529  -9.724  -3.488
  910    HZ3  TRP1219           HZ3      TRP1219  -5.579 -10.211  -0.542
  911    HH2  TRP1219           HH2      TRP1219  -3.467 -10.913  -1.551
  912    H    ASP1220           HN       ASP1220  -4.850  -3.105  -3.697
  913    HA   ASP1220           HA       ASP1220  -4.301  -1.637  -5.346
  914   1HB   ASP1220           HB2      ASP1220  -4.704  -3.636  -6.775
  915   2HB   ASP1220           HB1      ASP1220  -6.373  -3.113  -6.983
  916    H    GLY1221           HN       GLY1221  -7.047  -1.518  -3.719
  917   1HA   GLY1221           HA1      GLY1221  -7.744   1.098  -4.801
  918   2HA   GLY1221           HA2      GLY1221  -8.252   0.444  -3.253
  919    H    LYS1222           HN       LYS1222  -8.765  -1.938  -5.496
  920    HA   LYS1222           HA       LYS1222 -11.309  -0.946  -6.453
  921   1HB   LYS1222           HB2      LYS1222 -11.387  -2.950  -7.770
  922   2HB   LYS1222           HB1      LYS1222  -9.795  -2.236  -7.923
  923   1HG   LYS1222           HG2      LYS1222  -9.142  -4.367  -7.618
  924   2HG   LYS1222           HG1      LYS1222  -9.320  -3.936  -5.916
  925   1HD   LYS1222           HD2      LYS1222 -10.404  -6.051  -6.308
  926   2HD   LYS1222           HD1      LYS1222 -11.631  -4.827  -5.975
  927   1HE   LYS1222           HE2      LYS1222 -12.049  -4.597  -8.376
  928   2HE   LYS1222           HE1      LYS1222 -10.826  -5.823  -8.706
  929   1HZ   LYS1222           HZ3      LYS1222 -13.329  -6.252  -7.167
  930   2HZ   LYS1222           HZ2      LYS1222 -13.049  -6.757  -8.757
  931   3HZ   LYS1222           HZ1      LYS1222 -12.157  -7.428  -7.487
  932    H    LEU1223           HN       LEU1223 -13.272  -1.533  -5.740
  933    HA   LEU1223           HA       LEU1223 -13.573  -3.822  -3.967
  934   1HB   LEU1223           HB2      LEU1223 -14.560  -1.100  -3.131
  935   2HB   LEU1223           HB1      LEU1223 -14.679  -2.597  -2.227
  936    HG   LEU1223           HG       LEU1223 -11.989  -2.409  -2.523
  937   1HD1  LEU1223          1HD1      LEU1223 -12.278  -0.190  -3.619
  938   2HD1  LEU1223          3HD1      LEU1223 -12.962   0.412  -2.108
  939   3HD1  LEU1223          2HD1      LEU1223 -11.291  -0.153  -2.158
  940   1HD2  LEU1223          2HD2      LEU1223 -13.273  -2.866  -0.476
  941   2HD2  LEU1223          1HD2      LEU1223 -11.972  -1.707  -0.205
  942   3HD2  LEU1223          3HD2      LEU1223 -13.638  -1.146  -0.338
  943    H    GLU1224           HN       GLU1224 -15.907  -4.226  -3.479
  944    HA   GLU1224           HA       GLU1224 -17.541  -3.479  -5.809
  945   1HB   GLU1224           HB2      GLU1224 -17.894  -5.864  -3.986
  946   2HB   GLU1224           HB1      GLU1224 -18.766  -5.543  -5.478
  947   1HG   GLU1224           HG2      GLU1224 -15.825  -6.128  -5.228
  948   2HG   GLU1224           HG1      GLU1224 -17.067  -7.235  -5.812
  949    H    TYR1225           HN       TYR1225 -18.589  -1.652  -5.114
  950    HA   TYR1225           HA       TYR1225 -19.800  -1.553  -2.495
  951   1HB   TYR1225           HB2      TYR1225 -20.846   0.617  -3.657
  952   2HB   TYR1225           HB1      TYR1225 -19.206   0.590  -3.018
  953    HD1  TYR1225           HD1      TYR1225 -20.967  -0.281  -6.200
  954    HD2  TYR1225           HD2      TYR1225 -17.587   1.500  -4.343
  955    HE1  TYR1225           HE1      TYR1225 -20.098   0.362  -8.414
  956    HE2  TYR1225           HE2      TYR1225 -16.705   2.152  -6.540
  957    HH   TYR1225           HH       TYR1225 -16.922   1.453  -8.895
  958    HA   PRO1226           HA       PRO1226 -23.517  -3.640  -3.814
  959   1HB   PRO1226           HB2      PRO1226 -24.955  -2.986  -1.553
  960   2HB   PRO1226           HB1      PRO1226 -23.855  -4.363  -1.680
  961   1HG   PRO1226           HG2      PRO1226 -23.375  -1.657  -0.503
  962   2HG   PRO1226           HG1      PRO1226 -22.863  -3.244   0.093
  963   1HD   PRO1226           HD2      PRO1226 -21.166  -1.604  -1.175
  964   2HD   PRO1226           HD1      PRO1226 -21.091  -3.366  -1.393
  965    H    THR1227           HN       THR1227 -26.014  -2.756  -2.997
  966    HA   THR1227           HA       THR1227 -26.480   0.005  -3.526
  967    HB   THR1227           HB       THR1227 -27.379  -1.837  -5.754
  968    HG1  THR1227           HG1      THR1227 -25.652  -0.417  -6.875
  969   1HG2  THR1227          2HG2      THR1227 -27.228   1.172  -5.524
  970   2HG2  THR1227          1HG2      THR1227 -27.779   0.276  -6.940
  971   3HG2  THR1227          3HG2      THR1227 -28.696   0.197  -5.435
  972    H    CYS1228           HN       CYS1228 -27.232  -1.638  -1.506
  973    HA   CYS1228           HA       CYS1228 -29.572  -3.077  -1.679
  974   1HB   CYS1228           HB2      CYS1228 -28.816  -1.313   0.656
  975   2HB   CYS1228           HB1      CYS1228 -29.775  -2.790   0.689
  976    H    ALA1229           HN       ALA1229 -31.670  -2.256  -0.388
  977    HA   ALA1229           HA       ALA1229 -32.424   0.421  -1.162
  978   1HB   ALA1229           HB2      ALA1229 -33.927  -1.896  -2.333
  979   2HB   ALA1229           HB3      ALA1229 -32.711  -0.970  -3.216
  980   3HB   ALA1229           HB1      ALA1229 -34.183  -0.180  -2.645
  981    H    LYS1230           HN       LYS1230 -34.483   1.062  -0.433
  982    HA   LYS1230           HA       LYS1230 -36.149   1.240   1.054
  983   1HB   LYS1230           HB2      LYS1230 -37.247  -0.589   0.119
  984   2HB   LYS1230           HB1      LYS1230 -36.034  -1.727   0.682
  985   1HG   LYS1230           HG2      LYS1230 -36.835  -1.603   2.904
  986   2HG   LYS1230           HG1      LYS1230 -37.921  -0.269   2.509
  987   1HD   LYS1230           HD2      LYS1230 -39.174  -1.753   1.007
  988   2HD   LYS1230           HD1      LYS1230 -38.094  -3.083   1.427
  989   1HE   LYS1230           HE2      LYS1230 -40.175  -3.218   2.687
  990   2HE   LYS1230           HE1      LYS1230 -38.803  -2.934   3.758
  991   1HZ   LYS1230           HZ2      LYS1230 -40.707  -0.864   2.803
  992   2HZ   LYS1230           HZ1      LYS1230 -40.687  -1.549   4.350
  993   3HZ   LYS1230           HZ3      LYS1230 -39.391  -0.592   3.832
  994    H    ARG1231           HN       ARG1231 -34.779   2.255   2.502
  995    HA   ARG1231           HA       ARG1231 -33.394   0.934   4.550
  996   1HB   ARG1231           HB2      ARG1231 -32.980   3.103   5.441
  997   2HB   ARG1231           HB1      ARG1231 -32.956   3.255   3.703
  998   1HG   ARG1231           HG2      ARG1231 -35.220   4.153   3.729
  999   2HG   ARG1231           HG1      ARG1231 -35.261   3.996   5.487
 1000   1HD   ARG1231           HD2      ARG1231 -33.344   5.707   3.909
 1001   2HD   ARG1231           HD1      ARG1231 -34.751   6.288   4.801
 1002    HE   ARG1231           HE       ARG1231 -33.122   4.851   6.563
 1003   1HH1  ARG1231          1HH1      ARG1231 -33.068   7.806   4.716
 1004   2HH1  ARG1231          2HH1      ARG1231 -32.025   8.631   5.826
 1005   1HH2  ARG1231          1HH2      ARG1231 -31.749   5.930   8.028
 1006   2HH2  ARG1231          2HH2      ARG1231 -31.275   7.564   7.707

  No H/Q in entry =        1006
  Start of MODEL   10
    1    H1   GLU1103           HT3      GLU1103  38.421  -6.620   5.614
    2    H2   GLU1103           HT2      GLU1103  39.567  -7.342   4.602
    3    H3   GLU1103           HT1      GLU1103  40.006  -6.854   6.160
    4    HA   GLU1103           HA       GLU1103  39.626  -4.550   5.585
    5   1HB   GLU1103           HB2      GLU1103  41.869  -5.523   5.305
    6   2HB   GLU1103           HB1      GLU1103  41.459  -5.998   3.662
    7   1HG   GLU1103           HG2      GLU1103  41.198  -3.650   3.045
    8   2HG   GLU1103           HG1      GLU1103  41.611  -3.174   4.693
    9    H    ALA1104           HN       ALA1104  38.091  -3.423   4.607
   10    HA   ALA1104           HA       ALA1104  37.801  -3.561   1.731
   11   1HB   ALA1104           HB3      ALA1104  36.281  -5.329   2.478
   12   2HB   ALA1104           HB2      ALA1104  35.440  -4.169   3.507
   13   3HB   ALA1104           HB1      ALA1104  35.402  -3.981   1.754
   14    H    GLU1105           HN       GLU1105  36.809  -1.733   0.840
   15    HA   GLU1105           HA       GLU1105  35.908   0.353   2.679
   16   1HB   GLU1105           HB2      GLU1105  38.307   0.757   2.331
   17   2HB   GLU1105           HB1      GLU1105  38.054   0.774   0.592
   18   1HG   GLU1105           HG2      GLU1105  36.639   2.748   0.810
   19   2HG   GLU1105           HG1      GLU1105  36.881   2.729   2.556
   20    H    PHE1106           HN       PHE1106  36.637  -0.131  -0.783
   21    HA   PHE1106           HA       PHE1106  34.430   1.469  -1.628
   22   1HB   PHE1106           HB2      PHE1106  36.139  -0.484  -3.184
   23   2HB   PHE1106           HB1      PHE1106  35.009   0.665  -3.894
   24    HD1  PHE1106           HD1      PHE1106  38.256   0.234  -2.297
   25    HD2  PHE1106           HD2      PHE1106  35.499   3.042  -3.920
   26    HE1  PHE1106           HE1      PHE1106  40.032   1.936  -2.361
   27    HE2  PHE1106           HE2      PHE1106  37.270   4.748  -3.988
   28    HZ   PHE1106           HZ       PHE1106  39.540   4.196  -3.208
   29    H    GLY1107           HN       GLY1107  32.386   0.850  -1.385
   30   1HA   GLY1107           HA1      GLY1107  31.614  -1.872  -1.086
   31   2HA   GLY1107           HA2      GLY1107  31.189  -1.251  -2.672
   32    H    LYS1108           HN       LYS1108  31.185   1.216  -0.413
   33    HA   LYS1108           HA       LYS1108  28.752   0.900   0.917
   34   1HB   LYS1108           HB2      LYS1108  30.103   3.445   0.002
   35   2HB   LYS1108           HB1      LYS1108  28.773   3.373   1.150
   36   1HG   LYS1108           HG2      LYS1108  30.194   1.995   2.638
   37   2HG   LYS1108           HG1      LYS1108  31.532   2.226   1.511
   38   1HD   LYS1108           HD2      LYS1108  30.041   4.459   2.883
   39   2HD   LYS1108           HD1      LYS1108  31.577   3.790   3.439
   40   1HE   LYS1108           HE2      LYS1108  31.083   5.114   0.774
   41   2HE   LYS1108           HE1      LYS1108  31.911   5.840   2.152
   42   1HZ   LYS1108           HZ1      LYS1108  33.610   4.130   1.985
   43   2HZ   LYS1108           HZ3      LYS1108  32.816   3.436   0.662
   44   3HZ   LYS1108           HZ2      LYS1108  33.480   4.985   0.533
   45    H    CYS1109           HN       CYS1109  26.681   1.217   0.405
   46    HA   CYS1109           HA       CYS1109  25.985   1.354  -2.368
   47   1HB   CYS1109           HB2      CYS1109  23.770   1.672  -0.501
   48   2HB   CYS1109           HB1      CYS1109  24.055   0.426  -1.712
   49    H    GLY1110           HN       GLY1110  24.528   2.849  -3.314
   50   1HA   GLY1110           HA1      GLY1110  24.639   5.198  -3.891
   51   2HA   GLY1110           HA2      GLY1110  24.776   5.558  -2.175
   52    HA   PRO1111           HA       PRO1111  20.482   6.731  -2.251
   53   1HB   PRO1111           HB2      PRO1111  20.502   7.333  -5.186
   54   2HB   PRO1111           HB1      PRO1111  19.825   8.276  -3.852
   55   1HG   PRO1111           HG2      PRO1111  22.145   8.976  -4.935
   56   2HG   PRO1111           HG1      PRO1111  21.912   9.062  -3.180
   57   1HD   PRO1111           HD2      PRO1111  23.451   7.086  -4.795
   58   2HD   PRO1111           HD1      PRO1111  23.768   7.703  -3.160
   59    HA   PRO1112           HA       PRO1112  19.014   2.775  -3.895
   60   1HB   PRO1112           HB2      PRO1112  17.389   2.161  -1.875
   61   2HB   PRO1112           HB1      PRO1112  19.146   2.069  -1.695
   62   1HG   PRO1112           HG2      PRO1112  17.253   4.196  -0.777
   63   2HG   PRO1112           HG1      PRO1112  18.645   3.497   0.068
   64   1HD   PRO1112           HD2      PRO1112  18.678   5.897  -1.304
   65   2HD   PRO1112           HD1      PRO1112  20.114   4.917  -0.947
   66    HA   PRO1113           HA       PRO1113  15.449   4.766  -5.895
   67   1HB   PRO1113           HB2      PRO1113  15.302   2.019  -7.034
   68   2HB   PRO1113           HB1      PRO1113  15.240   3.581  -7.858
   69   1HG   PRO1113           HG2      PRO1113  17.435   2.070  -7.959
   70   2HG   PRO1113           HG1      PRO1113  17.546   3.835  -7.828
   71   1HD   PRO1113           HD2      PRO1113  17.974   1.746  -5.740
   72   2HD   PRO1113           HD1      PRO1113  18.806   3.295  -5.976
   73    HA   PRO1114           HA       PRO1114  12.654   2.632  -3.058
   74   1HB   PRO1114           HB2      PRO1114  11.147   4.708  -2.393
   75   2HB   PRO1114           HB1      PRO1114  12.834   4.625  -1.866
   76   1HG   PRO1114           HG2      PRO1114  11.614   6.203  -4.090
   77   2HG   PRO1114           HG1      PRO1114  12.885   6.675  -2.950
   78   1HD   PRO1114           HD2      PRO1114  13.281   5.735  -5.560
   79   2HD   PRO1114           HD1      PRO1114  14.519   5.836  -4.291
   80    H    ILE1115           HN       ILE1115  10.275   2.392  -2.896
   81    HA   ILE1115           HA       ILE1115   9.112   2.068  -5.533
   82    HB   ILE1115           HB       ILE1115   7.163   1.126  -4.097
   83   1HG1  ILE1115          2HG1      ILE1115   9.414   1.066  -2.074
   84   2HG1  ILE1115          1HG1      ILE1115   7.995   2.101  -1.971
   85   1HG2  ILE1115          1HG2      ILE1115   9.854  -0.211  -4.274
   86   2HG2  ILE1115          3HG2      ILE1115   8.352  -1.043  -3.874
   87   3HG2  ILE1115          2HG2      ILE1115   8.545  -0.283  -5.454
   88   1HD1  ILE1115          1HD1      ILE1115   7.980  -0.906  -1.918
   89   2HD1  ILE1115          3HD1      ILE1115   7.797   0.160  -0.525
   90   3HD1  ILE1115          2HD1      ILE1115   6.567   0.142  -1.790
   91    H    ASP1116           HN       ASP1116   6.763   2.628  -5.820
   92    HA   ASP1116           HA       ASP1116   6.389   5.412  -5.398
   93   1HB   ASP1116           HB2      ASP1116   5.489   4.250  -7.373
   94   2HB   ASP1116           HB1      ASP1116   4.413   3.318  -6.337
   95    H    ASN1117           HN       ASN1117   5.586   6.414  -3.678
   96    HA   ASN1117           HA       ASN1117   4.479   6.842  -1.737
   97   1HB   ASN1117           HB2      ASN1117   2.837   4.417  -2.504
   98   2HB   ASN1117           HB1      ASN1117   2.425   5.565  -1.233
   99   1HD2  ASN1117          1HD2      ASN1117   0.984   4.826  -3.668
  100   2HD2  ASN1117          2HD2      ASN1117   0.733   6.300  -4.533
  101    H    GLY1118           HN       GLY1118   6.627   4.594  -2.117
  102   1HA   GLY1118           HA1      GLY1118   7.370   2.741  -0.815
  103   2HA   GLY1118           HA2      GLY1118   6.203   3.181   0.423
  104    H    ASP1119           HN       ASP1119   8.709   2.601   1.224
  105    HA   ASP1119           HA       ASP1119  10.636   4.576   1.309
  106   1HB   ASP1119           HB2      ASP1119   8.724   5.940   2.302
  107   2HB   ASP1119           HB1      ASP1119   8.823   4.878   3.703
  108    H    ILE1120           HN       ILE1120  12.128   4.346   3.175
  109    HA   ILE1120           HA       ILE1120  12.575   1.601   3.690
  110    HB   ILE1120           HB       ILE1120  13.936   3.672   5.305
  111   1HG1  ILE1120          2HG1      ILE1120  14.248   3.346   2.312
  112   2HG1  ILE1120          1HG1      ILE1120  13.747   4.801   3.164
  113   1HG2  ILE1120          3HG2      ILE1120  14.701   1.197   3.795
  114   2HG2  ILE1120          2HG2      ILE1120  15.883   2.242   4.586
  115   3HG2  ILE1120          1HG2      ILE1120  14.647   1.421   5.542
  116   1HD1  ILE1120          3HD1      ILE1120  16.460   3.520   3.342
  117   2HD1  ILE1120          2HD1      ILE1120  16.047   4.962   2.413
  118   3HD1  ILE1120          1HD1      ILE1120  15.949   4.989   4.173
  119    H    THR1121           HN       THR1121  10.349   3.512   4.998
  120    HA   THR1121           HA       THR1121   8.952   3.282   6.780
  121    HB   THR1121           HB       THR1121   8.831   1.324   8.002
  122    HG1  THR1121           HG1      THR1121  10.642   1.079   9.128
  123   1HG2  THR1121          1HG2      THR1121   8.754   0.802   5.588
  124   2HG2  THR1121          3HG2      THR1121  10.487   0.475   5.618
  125   3HG2  THR1121          2HG2      THR1121   9.382  -0.545   6.539
  126    H    SER1122           HN       SER1122  11.984   4.327   6.817
  127    HA   SER1122           HA       SER1122  11.742   5.300   9.573
  128   1HB   SER1122           HB2      SER1122  14.288   4.182   8.375
  129   2HB   SER1122           HB1      SER1122  14.165   4.982   9.942
  130    HG   SER1122           HG       SER1122  12.337   3.017   9.748
  131    H    PHE1123           HN       PHE1123  14.437   5.682   7.336
  132    HA   PHE1123           HA       PHE1123  13.578   8.275   6.434
  133   1HB   PHE1123           HB2      PHE1123  14.462   8.735   8.716
  134   2HB   PHE1123           HB1      PHE1123  16.014   8.076   8.216
  135    HD1  PHE1123           HD1      PHE1123  13.611  10.816   7.640
  136    HD2  PHE1123           HD2      PHE1123  17.562   9.370   7.001
  137    HE1  PHE1123           HE1      PHE1123  14.287  13.035   6.816
  138    HE2  PHE1123           HE2      PHE1123  18.245  11.586   6.177
  139    HZ   PHE1123           HZ       PHE1123  16.605  13.422   6.083
  140    HA   PRO1124           HA       PRO1124  16.088   6.800   3.073
  141   1HB   PRO1124           HB2      PRO1124  16.240   9.125   1.652
  142   2HB   PRO1124           HB1      PRO1124  14.812   8.084   1.665
  143   1HG   PRO1124           HG2      PRO1124  15.352  10.580   3.226
  144   2HG   PRO1124           HG1      PRO1124  13.867  10.078   2.399
  145   1HD   PRO1124           HD2      PRO1124  14.176   9.827   5.066
  146   2HD   PRO1124           HD1      PRO1124  13.244   8.656   4.110
  147    H    LEU1125           HN       LEU1125  18.228   6.523   2.945
  148    HA   LEU1125           HA       LEU1125  19.965   8.617   4.060
  149   1HB   LEU1125           HB2      LEU1125  20.721   5.714   3.664
  150   2HB   LEU1125           HB1      LEU1125  21.575   6.936   4.588
  151    HG   LEU1125           HG       LEU1125  19.462   7.006   6.076
  152   1HD1  LEU1125          1HD1      LEU1125  19.073   4.378   4.652
  153   2HD1  LEU1125          3HD1      LEU1125  18.274   4.830   6.157
  154   3HD1  LEU1125          2HD1      LEU1125  17.955   5.744   4.682
  155   1HD2  LEU1125          2HD2      LEU1125  21.264   4.588   6.049
  156   2HD2  LEU1125          1HD2      LEU1125  21.620   6.143   6.800
  157   3HD2  LEU1125          3HD2      LEU1125  20.306   5.146   7.422
  158    H    SER1126           HN       SER1126  21.998   9.028   2.997
  159    HA   SER1126           HA       SER1126  21.768   8.733   0.096
  160   1HB   SER1126           HB2      SER1126  23.661  10.445   1.732
  161   2HB   SER1126           HB1      SER1126  23.499  10.475  -0.024
  162    HG   SER1126           HG       SER1126  21.493  11.145   1.870
  163    H    VAL1127           HN       VAL1127  24.019   8.133   2.750
  164    HA   VAL1127           HA       VAL1127  25.571   6.371   0.969
  165    HB   VAL1127           HB       VAL1127  26.486   7.697   3.529
  166   1HG1  VAL1127          2HG1      VAL1127  27.548   5.532   3.141
  167   2HG1  VAL1127          1HG1      VAL1127  28.007   6.040   1.517
  168   3HG1  VAL1127          3HG1      VAL1127  28.699   6.850   2.923
  169   1HG2  VAL1127          2HG2      VAL1127  27.186   8.307   0.658
  170   2HG2  VAL1127          1HG2      VAL1127  26.218   9.317   1.732
  171   3HG2  VAL1127          3HG2      VAL1127  27.927   9.049   2.076
  172    H    TYR1128           HN       TYR1128  25.319   4.272   1.323
  173    HA   TYR1128           HA       TYR1128  24.314   3.405   3.950
  174   1HB   TYR1128           HB2      TYR1128  24.001   2.206   1.203
  175   2HB   TYR1128           HB1      TYR1128  23.611   1.323   2.674
  176    HD1  TYR1128           HD1      TYR1128  21.516   1.540   3.661
  177    HD2  TYR1128           HD2      TYR1128  22.787   4.422   0.803
  178    HE1  TYR1128           HE1      TYR1128  19.260   2.522   3.656
  179    HE2  TYR1128           HE2      TYR1128  20.540   5.410   0.792
  180    HH   TYR1128           HH       TYR1128  18.254   4.791   1.315
  181    H    ALA1129           HN       ALA1129  24.809   0.949   4.220
  182    HA   ALA1129           HA       ALA1129  27.730   0.688   4.100
  183   1HB   ALA1129           HB1      ALA1129  26.691   0.492   6.307
  184   2HB   ALA1129           HB2      ALA1129  27.474  -1.015   5.831
  185   3HB   ALA1129           HB3      ALA1129  25.720  -0.863   5.730
  186    HA   PRO1130           HA       PRO1130  27.432  -2.227   0.760
  187   1HB   PRO1130           HB2      PRO1130  29.771  -3.599   1.312
  188   2HB   PRO1130           HB1      PRO1130  29.667  -2.109   0.372
  189   1HG   PRO1130           HG2      PRO1130  30.394  -2.500   3.243
  190   2HG   PRO1130           HG1      PRO1130  31.080  -1.377   2.054
  191   1HD   PRO1130           HD2      PRO1130  29.353  -0.555   3.939
  192   2HD   PRO1130           HD1      PRO1130  29.349   0.142   2.306
  193    H    ALA1131           HN       ALA1131  26.802  -4.321   0.417
  194    HA   ALA1131           HA       ALA1131  25.919  -6.363   0.873
  195   1HB   ALA1131           HB1      ALA1131  28.242  -6.885   1.441
  196   2HB   ALA1131           HB2      ALA1131  27.107  -7.790   2.441
  197   3HB   ALA1131           HB3      ALA1131  27.944  -6.388   3.107
  198    H    SER1132           HN       SER1132  24.963  -3.871   2.362
  199    HA   SER1132           HA       SER1132  23.942  -4.915   4.853
  200   1HB   SER1132           HB2      SER1132  24.532  -2.470   4.395
  201   2HB   SER1132           HB1      SER1132  23.028  -2.391   3.477
  202    HG   SER1132           HG       SER1132  23.083  -1.847   5.875
  203    H    SER1133           HN       SER1133  21.388  -3.929   4.950
  204    HA   SER1133           HA       SER1133  19.823  -4.942   2.758
  205   1HB   SER1133           HB2      SER1133  18.568  -6.554   4.254
  206   2HB   SER1133           HB1      SER1133  20.198  -7.059   3.814
  207    HG   SER1133           HG       SER1133  19.363  -7.065   6.171
  208    H    VAL1134           HN       VAL1134  18.318  -3.437   2.552
  209    HA   VAL1134           HA       VAL1134  17.491  -1.906   4.892
  210    HB   VAL1134           HB       VAL1134  17.545  -1.416   2.015
  211   1HG1  VAL1134          2HG1      VAL1134  15.226  -0.364   3.597
  212   2HG1  VAL1134          1HG1      VAL1134  15.700   0.182   1.989
  213   3HG1  VAL1134          3HG1      VAL1134  15.146  -1.475   2.230
  214   1HG2  VAL1134          2HG2      VAL1134  18.963  -0.243   3.622
  215   2HG2  VAL1134          1HG2      VAL1134  17.929   0.874   2.728
  216   3HG2  VAL1134          3HG2      VAL1134  17.523   0.431   4.387
  217    H    GLU1135           HN       GLU1135  15.201  -1.328   5.071
  218    HA   GLU1135           HA       GLU1135  13.416  -3.569   4.406
  219   1HB   GLU1135           HB2      GLU1135  14.063  -3.778   6.751
  220   2HB   GLU1135           HB1      GLU1135  13.591  -2.112   7.052
  221   1HG   GLU1135           HG2      GLU1135  11.268  -2.680   6.536
  222   2HG   GLU1135           HG1      GLU1135  11.747  -4.353   6.254
  223    H    TYR1136           HN       TYR1136  12.305  -2.576   2.808
  224    HA   TYR1136           HA       TYR1136  11.318   0.126   3.145
  225   1HB   TYR1136           HB2      TYR1136  11.562  -1.801   0.921
  226   2HB   TYR1136           HB1      TYR1136  10.166  -0.732   0.844
  227    HD1  TYR1136           HD1      TYR1136  13.807  -0.937   0.663
  228    HD2  TYR1136           HD2      TYR1136  10.452   1.674   0.586
  229    HE1  TYR1136           HE1      TYR1136  15.224   0.847  -0.262
  230    HE2  TYR1136           HE2      TYR1136  11.858   3.465  -0.338
  231    HH   TYR1136           HH       TYR1136  14.238   4.088  -0.408
  232    H    GLN1137           HN       GLN1137   9.014   0.503   2.395
  233    HA   GLN1137           HA       GLN1137   6.959  -1.341   2.605
  234   1HB   GLN1137           HB2      GLN1137   7.738  -1.562   4.967
  235   2HB   GLN1137           HB1      GLN1137   7.359   0.137   5.212
  236   1HG   GLN1137           HG2      GLN1137   5.012  -0.312   4.722
  237   2HG   GLN1137           HG1      GLN1137   5.390  -2.016   4.472
  238   1HE2  GLN1137          1HE2      GLN1137   6.902  -0.070   6.939
  239   2HE2  GLN1137          2HE2      GLN1137   6.152  -0.846   8.288
  240    H    CYS1138           HN       CYS1138   4.830  -0.331   2.702
  241    HA   CYS1138           HA       CYS1138   4.911   2.299   1.494
  242   1HB   CYS1138           HB2      CYS1138   2.605   0.413   2.015
  243   2HB   CYS1138           HB1      CYS1138   2.485   1.928   1.126
  244    H    GLN1139           HN       GLN1139   3.929   4.138   2.279
  245    HA   GLN1139           HA       GLN1139   4.024   4.635   5.006
  246   1HB   GLN1139           HB2      GLN1139   2.386   6.081   2.917
  247   2HB   GLN1139           HB1      GLN1139   2.783   6.708   4.511
  248   1HG   GLN1139           HG2      GLN1139   5.158   6.660   3.939
  249   2HG   GLN1139           HG1      GLN1139   4.754   6.043   2.336
  250   1HE2  GLN1139          1HE2      GLN1139   2.358   7.709   2.144
  251   2HE2  GLN1139          2HE2      GLN1139   2.920   9.311   1.823
  252    H    ASN1140           HN       ASN1140   2.080   5.521   6.281
  253    HA   ASN1140           HA       ASN1140   0.436   3.484   7.070
  254   1HB   ASN1140           HB2      ASN1140   0.794   5.655   8.271
  255   2HB   ASN1140           HB1      ASN1140  -0.334   6.407   7.147
  256   1HD2  ASN1140          1HD2      ASN1140  -2.485   6.056   7.338
  257   2HD2  ASN1140          2HD2      ASN1140  -3.194   5.245   8.684
  258    H    LEU1141           HN       LEU1141  -1.728   2.920   6.733
  259    HA   LEU1141           HA       LEU1141  -3.694   2.628   5.622
  260   1HB   LEU1141           HB2      LEU1141  -2.829   5.057   4.055
  261   2HB   LEU1141           HB1      LEU1141  -4.360   4.236   3.826
  262    HG   LEU1141           HG       LEU1141  -3.469   5.583   6.378
  263   1HD1  LEU1141          3HD1      LEU1141  -3.931   7.185   4.602
  264   2HD1  LEU1141          2HD1      LEU1141  -5.497   6.427   4.314
  265   3HD1  LEU1141          1HD1      LEU1141  -5.179   7.242   5.845
  266   1HD2  LEU1141          2HD2      LEU1141  -4.940   3.687   6.797
  267   2HD2  LEU1141          1HD2      LEU1141  -5.769   5.211   7.116
  268   3HD2  LEU1141          3HD2      LEU1141  -6.102   4.319   5.631
  269    H    TYR1142           HN       TYR1142  -0.831   3.235   3.638
  270    HA   TYR1142           HA       TYR1142  -1.785   1.615   1.461
  271   1HB   TYR1142           HB2      TYR1142   0.920   2.822   2.061
  272   2HB   TYR1142           HB1      TYR1142   0.569   1.898   0.604
  273    HD1  TYR1142           HD1      TYR1142  -0.771   4.827   2.506
  274    HD2  TYR1142           HD2      TYR1142  -0.041   3.056  -1.292
  275    HE1  TYR1142           HE1      TYR1142  -1.569   6.876   1.405
  276    HE2  TYR1142           HE2      TYR1142  -0.838   5.099  -2.404
  277    HH   TYR1142           HH       TYR1142  -1.316   8.024  -0.754
  278    H    GLN1143           HN       GLN1143  -0.469  -0.261   0.661
  279    HA   GLN1143           HA       GLN1143   0.715  -1.817   2.855
  280   1HB   GLN1143           HB2      GLN1143  -1.644  -2.509   2.581
  281   2HB   GLN1143           HB1      GLN1143  -1.324  -2.884   0.893
  282   1HG   GLN1143           HG2      GLN1143  -1.324  -4.909   2.174
  283   2HG   GLN1143           HG1      GLN1143   0.314  -4.579   1.609
  284   1HE2  GLN1143          1HE2      GLN1143   1.227  -5.850   3.214
  285   2HE2  GLN1143          2HE2      GLN1143   1.285  -5.348   4.866
  286    H    LEU1144           HN       LEU1144   2.613  -2.697   2.313
  287    HA   LEU1144           HA       LEU1144   3.538  -2.485  -0.417
  288   1HB   LEU1144           HB2      LEU1144   5.068  -1.887   1.352
  289   2HB   LEU1144           HB1      LEU1144   4.885  -3.461   2.102
  290    HG   LEU1144           HG       LEU1144   5.897  -3.436  -0.689
  291   1HD1  LEU1144          3HD1      LEU1144   7.113  -1.560   0.286
  292   2HD1  LEU1144          2HD1      LEU1144   7.593  -2.574   1.648
  293   3HD1  LEU1144          1HD1      LEU1144   8.175  -2.943   0.025
  294   1HD2  LEU1144          2HD2      LEU1144   6.636  -4.947   1.814
  295   2HD2  LEU1144          1HD2      LEU1144   5.605  -5.526   0.505
  296   3HD2  LEU1144          3HD2      LEU1144   7.319  -5.227   0.211
  297    H    GLU1145           HN       GLU1145   4.504  -4.251  -1.579
  298    HA   GLU1145           HA       GLU1145   3.707  -6.941  -0.789
  299   1HB   GLU1145           HB2      GLU1145   1.804  -6.145  -2.085
  300   2HB   GLU1145           HB1      GLU1145   2.870  -5.651  -3.392
  301   1HG   GLU1145           HG2      GLU1145   1.723  -7.732  -3.904
  302   2HG   GLU1145           HG1      GLU1145   3.469  -7.961  -3.812
  303    H    GLY1146           HN       GLY1146   5.300  -8.331  -1.184
  304   1HA   GLY1146           HA1      GLY1146   7.316  -7.589  -3.215
  305   2HA   GLY1146           HA2      GLY1146   6.806  -9.245  -2.937
  306    H    ASN1147           HN       ASN1147   9.449  -7.740  -2.704
  307    HA   ASN1147           HA       ASN1147  10.097  -8.689   0.007
  308   1HB   ASN1147           HB2      ASN1147  12.417  -9.040  -0.882
  309   2HB   ASN1147           HB1      ASN1147  11.195 -10.076  -1.610
  310   1HD2  ASN1147          1HD2      ASN1147  13.471  -7.548  -2.117
  311   2HD2  ASN1147          2HD2      ASN1147  13.303  -7.446  -3.833
  312    H    LYS1148           HN       LYS1148   9.582  -6.623   0.886
  313    HA   LYS1148           HA       LYS1148  10.631  -4.164   0.125
  314   1HB   LYS1148           HB2      LYS1148  10.305  -3.532   2.530
  315   2HB   LYS1148           HB1      LYS1148   8.900  -4.247   1.752
  316   1HG   LYS1148           HG2      LYS1148   8.931  -5.276   3.820
  317   2HG   LYS1148           HG1      LYS1148   9.733  -6.459   2.785
  318   1HD   LYS1148           HD2      LYS1148  11.914  -5.632   3.539
  319   2HD   LYS1148           HD1      LYS1148  11.108  -4.460   4.582
  320   1HE   LYS1148           HE2      LYS1148  11.824  -6.413   5.852
  321   2HE   LYS1148           HE1      LYS1148  10.066  -6.279   5.833
  322   1HZ   LYS1148           HZ1      LYS1148  11.680  -8.079   4.108
  323   2HZ   LYS1148           HZ3      LYS1148  10.781  -8.553   5.461
  324   3HZ   LYS1148           HZ2      LYS1148   9.994  -7.952   4.091
  325    H    ARG1149           HN       ARG1149  12.196  -6.857   1.587
  326    HA   ARG1149           HA       ARG1149  14.406  -5.387   2.691
  327   1HB   ARG1149           HB2      ARG1149  13.666  -7.566   3.612
  328   2HB   ARG1149           HB1      ARG1149  14.149  -8.345   2.113
  329   1HG   ARG1149           HG2      ARG1149  15.894  -8.752   3.617
  330   2HG   ARG1149           HG1      ARG1149  16.479  -7.461   2.565
  331   1HD   ARG1149           HD2      ARG1149  17.028  -7.005   4.893
  332   2HD   ARG1149           HD1      ARG1149  15.899  -5.807   4.263
  333    HE   ARG1149           HE       ARG1149  14.390  -7.799   5.472
  334   1HH1  ARG1149          1HH1      ARG1149  16.760  -5.417   6.393
  335   2HH1  ARG1149          2HH1      ARG1149  16.140  -5.234   8.000
  336   1HH2  ARG1149          1HH2      ARG1149  13.567  -7.565   7.585
  337   2HH2  ARG1149          2HH2      ARG1149  14.325  -6.454   8.677
  338    H    ILE1150           HN       ILE1150  15.738  -4.342   1.337
  339    HA   ILE1150           HA       ILE1150  16.495  -5.663  -1.177
  340    HB   ILE1150           HB       ILE1150  17.356  -3.444  -1.879
  341   1HG1  ILE1150          2HG1      ILE1150  15.979  -2.442   0.621
  342   2HG1  ILE1150          1HG1      ILE1150  17.724  -2.561   0.422
  343   1HG2  ILE1150          1HG2      ILE1150  14.457  -3.529  -1.055
  344   2HG2  ILE1150          3HG2      ILE1150  15.148  -2.437  -2.255
  345   3HG2  ILE1150          2HG2      ILE1150  15.141  -4.176  -2.546
  346   1HD1  ILE1150          2HD1      ILE1150  15.878  -0.840  -1.215
  347   2HD1  ILE1150          1HD1      ILE1150  16.949  -0.290   0.075
  348   3HD1  ILE1150          3HD1      ILE1150  17.628  -0.957  -1.410
  349    H    THR1151           HN       THR1151  18.853  -4.751  -1.846
  350    HA   THR1151           HA       THR1151  20.760  -4.699   0.280
  351    HB   THR1151           HB       THR1151  20.494  -7.252  -1.317
  352    HG1  THR1151           HG1      THR1151  20.284  -8.172   0.746
  353   1HG2  THR1151          2HG2      THR1151  22.842  -6.573  -1.227
  354   2HG2  THR1151          1HG2      THR1151  22.730  -6.397   0.525
  355   3HG2  THR1151          3HG2      THR1151  22.554  -7.989  -0.215
  356    H    CYS1152           HN       CYS1152  22.515  -3.650  -0.429
  357    HA   CYS1152           HA       CYS1152  22.699  -3.068  -3.257
  358   1HB   CYS1152           HB2      CYS1152  24.208  -1.341  -2.685
  359   2HB   CYS1152           HB1      CYS1152  22.950  -1.327  -1.455
  360    H    ARG1153           HN       ARG1153  23.982  -3.980  -4.644
  361    HA   ARG1153           HA       ARG1153  26.113  -5.732  -3.651
  362   1HB   ARG1153           HB2      ARG1153  24.792  -5.585  -6.363
  363   2HB   ARG1153           HB1      ARG1153  26.099  -6.684  -5.943
  364   1HG   ARG1153           HG2      ARG1153  24.199  -7.996  -5.749
  365   2HG   ARG1153           HG1      ARG1153  24.535  -7.511  -4.085
  366   1HD   ARG1153           HD2      ARG1153  22.866  -5.740  -4.255
  367   2HD   ARG1153           HD1      ARG1153  22.542  -6.195  -5.927
  368    HE   ARG1153           HE       ARG1153  22.187  -8.363  -4.087
  369   1HH1  ARG1153          1HH1      ARG1153  20.674  -5.557  -5.494
  370   2HH1  ARG1153          2HH1      ARG1153  19.064  -6.139  -5.242
  371   1HH2  ARG1153          1HH2      ARG1153  20.068  -9.138  -3.751
  372   2HH2  ARG1153          2HH2      ARG1153  18.719  -8.174  -4.251
  373    H    ASN1154           HN       ASN1154  28.049  -4.827  -3.567
  374    HA   ASN1154           HA       ASN1154  29.928  -3.672  -4.119
  375   1HB   ASN1154           HB2      ASN1154  28.720  -3.664  -6.893
  376   2HB   ASN1154           HB1      ASN1154  30.386  -3.243  -6.505
  377   1HD2  ASN1154          1HD2      ASN1154  28.061  -5.807  -6.765
  378   2HD2  ASN1154          2HD2      ASN1154  29.191  -7.112  -6.710
  379    H    GLY1155           HN       GLY1155  27.526  -2.277  -3.207
  380   1HA   GLY1155           HA1      GLY1155  28.411   0.409  -3.827
  381   2HA   GLY1155           HA2      GLY1155  27.210  -0.045  -2.629
  382    H    GLN1156           HN       GLN1156  25.788  -1.659  -4.756
  383    HA   GLN1156           HA       GLN1156  24.115   0.499  -5.697
  384   1HB   GLN1156           HB2      GLN1156  25.738  -1.211  -7.566
  385   2HB   GLN1156           HB1      GLN1156  24.219  -0.494  -8.076
  386   1HG   GLN1156           HG2      GLN1156  25.103   1.731  -7.585
  387   2HG   GLN1156           HG1      GLN1156  26.630   1.006  -7.079
  388   1HE2  GLN1156          1HE2      GLN1156  24.750  -0.189  -9.762
  389   2HE2  GLN1156          2HE2      GLN1156  25.850   0.294 -11.004
  390    H    TRP1157           HN       TRP1157  22.096  -0.166  -5.321
  391    HA   TRP1157           HA       TRP1157  21.506  -3.018  -5.702
  392   1HB   TRP1157           HB2      TRP1157  19.650  -2.527  -3.911
  393   2HB   TRP1157           HB1      TRP1157  21.277  -2.981  -3.445
  394    HD1  TRP1157           HD1      TRP1157  21.354   0.595  -4.415
  395    HE1  TRP1157           HE1      TRP1157  21.305   2.071  -2.302
  396    HE3  TRP1157           HE3      TRP1157  19.992  -2.941  -1.009
  397    HZ2  TRP1157           HZ2      TRP1157  20.740   1.757   0.457
  398    HZ3  TRP1157           HZ3      TRP1157  19.714  -2.287   1.339
  399    HH2  TRP1157           HH2      TRP1157  20.078   0.004   2.052
  400    H    SER1158           HN       SER1158  18.915  -3.161  -5.360
  401    HA   SER1158           HA       SER1158  17.863  -1.560  -7.586
  402   1HB   SER1158           HB2      SER1158  17.917  -3.999  -7.941
  403   2HB   SER1158           HB1      SER1158  16.886  -4.214  -6.526
  404    HG   SER1158           HG       SER1158  16.045  -3.929  -8.921
  405    H    GLU1159           HN       GLU1159  15.421  -1.363  -7.533
  406    HA   GLU1159           HA       GLU1159  14.658   0.054  -5.160
  407   1HB   GLU1159           HB2      GLU1159  14.118   1.020  -7.297
  408   2HB   GLU1159           HB1      GLU1159  13.316  -0.451  -7.820
  409   1HG   GLU1159           HG2      GLU1159  11.617  -0.076  -6.041
  410   2HG   GLU1159           HG1      GLU1159  12.378   1.481  -5.719
  411    HA   PRO1160           HA       PRO1160  12.428  -3.105  -3.016
  412   1HB   PRO1160           HB2      PRO1160  10.100  -1.571  -2.507
  413   2HB   PRO1160           HB1      PRO1160  11.472  -1.816  -1.427
  414   1HG   PRO1160           HG2      PRO1160  10.826   0.481  -3.164
  415   2HG   PRO1160           HG1      PRO1160  11.779   0.425  -1.671
  416   1HD   PRO1160           HD2      PRO1160  12.892   0.748  -4.117
  417   2HD   PRO1160           HD1      PRO1160  13.722  -0.078  -2.784
  418    HA   PRO1161           HA       PRO1161   9.614  -5.129  -5.701
  419   1HB   PRO1161           HB2      PRO1161   7.416  -5.663  -4.109
  420   2HB   PRO1161           HB1      PRO1161   8.891  -6.632  -4.162
  421   1HG   PRO1161           HG2      PRO1161   8.090  -4.500  -2.219
  422   2HG   PRO1161           HG1      PRO1161   8.883  -6.057  -1.911
  423   1HD   PRO1161           HD2      PRO1161  10.283  -3.783  -1.927
  424   2HD   PRO1161           HD1      PRO1161  10.960  -5.275  -2.617
  425    H    LYS1162           HN       LYS1162   6.808  -4.079  -3.944
  426    HA   LYS1162           HA       LYS1162   6.325  -1.779  -5.620
  427   1HB   LYS1162           HB2      LYS1162   5.775  -3.802  -7.047
  428   2HB   LYS1162           HB1      LYS1162   4.465  -4.134  -5.923
  429   1HG   LYS1162           HG2      LYS1162   3.461  -1.971  -6.445
  430   2HG   LYS1162           HG1      LYS1162   4.777  -1.634  -7.571
  431   1HD   LYS1162           HD2      LYS1162   2.865  -2.412  -8.812
  432   2HD   LYS1162           HD1      LYS1162   4.125  -3.648  -8.863
  433   1HE   LYS1162           HE2      LYS1162   2.992  -4.880  -7.082
  434   2HE   LYS1162           HE1      LYS1162   1.735  -3.644  -7.022
  435   1HZ   LYS1162           HZ3      LYS1162   2.352  -5.365  -9.362
  436   2HZ   LYS1162           HZ2      LYS1162   1.036  -5.556  -8.318
  437   3HZ   LYS1162           HZ1      LYS1162   1.143  -4.183  -9.299
  438    H    CYS1163           HN       CYS1163   4.048  -0.915  -5.241
  439    HA   CYS1163           HA       CYS1163   3.311  -1.371  -2.427
  440   1HB   CYS1163           HB2      CYS1163   4.285   0.906  -3.152
  441   2HB   CYS1163           HB1      CYS1163   2.737   1.159  -3.954
  442    H    LEU1164           HN       LEU1164   1.030  -0.963  -1.904
  443    HA   LEU1164           HA       LEU1164  -0.776  -1.515  -4.160
  444   1HB   LEU1164           HB2      LEU1164  -0.416  -2.996  -1.619
  445   2HB   LEU1164           HB1      LEU1164  -2.067  -2.756  -2.153
  446    HG   LEU1164           HG       LEU1164  -1.216  -4.916  -2.887
  447   1HD1  LEU1164          1HD1      LEU1164  -2.851  -3.785  -4.290
  448   2HD1  LEU1164          3HD1      LEU1164  -1.553  -2.976  -5.168
  449   3HD1  LEU1164          2HD1      LEU1164  -1.726  -4.728  -5.267
  450   1HD2  LEU1164          2HD2      LEU1164   1.158  -4.351  -2.995
  451   2HD2  LEU1164          1HD2      LEU1164   0.599  -5.083  -4.499
  452   3HD2  LEU1164          3HD2      LEU1164   0.854  -3.340  -4.407
  453    H    HIS1165           HN       HIS1165  -2.188   0.075  -4.374
  454    HA   HIS1165           HA       HIS1165  -2.599   2.170  -2.619
  455   1HB   HIS1165           HB2      HIS1165  -4.560   1.050  -4.636
  456   2HB   HIS1165           HB1      HIS1165  -4.661   2.645  -3.897
  457    HD1  HIS1165           HD1      HIS1165  -3.091   0.806  -6.663
  458    HD2  HIS1165           HD2      HIS1165  -2.572   4.447  -4.730
  459    HE1  HIS1165           HE1      HIS1165  -1.640   2.178  -8.191
  460    HE2  HIS1165           HE2      HIS1165  -1.274   4.348  -6.964
  461    HA   PRO1166           HA       PRO1166  -4.781   0.397   0.796
  462   1HB   PRO1166           HB2      PRO1166  -5.994   3.101   1.015
  463   2HB   PRO1166           HB1      PRO1166  -5.118   2.157   2.224
  464   1HG   PRO1166           HG2      PRO1166  -3.976   4.245   1.022
  465   2HG   PRO1166           HG1      PRO1166  -3.045   2.785   1.405
  466   1HD   PRO1166           HD2      PRO1166  -4.133   3.709  -1.220
  467   2HD   PRO1166           HD1      PRO1166  -2.603   2.885  -0.857
  468    H    CYS1167           HN       CYS1167  -7.143   0.947   1.785
  469    HA   CYS1167           HA       CYS1167  -8.961  -0.176  -0.140
  470   1HB   CYS1167           HB2      CYS1167  -8.822  -0.867   2.267
  471   2HB   CYS1167           HB1      CYS1167  -9.482   0.704   2.703
  472    H    VAL1168           HN       VAL1168  -8.034   2.579  -0.529
  473    HA   VAL1168           HA       VAL1168 -10.061   4.413   0.161
  474    HB   VAL1168           HB       VAL1168  -8.039   4.549  -2.078
  475   1HG1  VAL1168          2HG1      VAL1168  -9.932   6.014  -2.542
  476   2HG1  VAL1168          1HG1      VAL1168  -9.795   6.721  -0.932
  477   3HG1  VAL1168          3HG1      VAL1168  -8.505   6.956  -2.113
  478   1HG2  VAL1168          3HG2      VAL1168  -8.059   5.753   0.691
  479   2HG2  VAL1168          2HG2      VAL1168  -7.034   4.428   0.135
  480   3HG2  VAL1168          1HG2      VAL1168  -6.833   6.043  -0.544
  481    H    ILE1169           HN       ILE1169 -12.040   3.488  -0.329
  482    HA   ILE1169           HA       ILE1169 -12.684   2.796  -3.069
  483    HB   ILE1169           HB       ILE1169 -13.593   1.665  -0.916
  484   1HG1  ILE1169          2HG1      ILE1169 -15.536   2.435  -3.102
  485   2HG1  ILE1169          1HG1      ILE1169 -14.337   1.151  -3.225
  486   1HG2  ILE1169          2HG2      ILE1169 -15.402   4.059  -1.091
  487   2HG2  ILE1169          1HG2      ILE1169 -15.766   2.600  -0.169
  488   3HG2  ILE1169          3HG2      ILE1169 -14.368   3.587   0.257
  489   1HD1  ILE1169          1HD1      ILE1169 -16.631   1.240  -1.276
  490   2HD1  ILE1169          3HD1      ILE1169 -16.541   0.256  -2.737
  491   3HD1  ILE1169          2HD1      ILE1169 -15.431  -0.046  -1.400
  492    H    SER1170           HN       SER1170 -15.196   3.752  -3.475
  493    HA   SER1170           HA       SER1170 -14.676   6.628  -3.703
  494   1HB   SER1170           HB2      SER1170 -15.202   5.327  -5.761
  495   2HB   SER1170           HB1      SER1170 -16.802   4.991  -5.098
  496    HG   SER1170           HG       SER1170 -16.093   7.650  -5.088
  497    H    ARG1171           HN       ARG1171 -15.416   7.759  -2.026
  498    HA   ARG1171           HA       ARG1171 -17.407   7.091  -0.220
  499   1HB   ARG1171           HB2      ARG1171 -17.509   9.523   0.296
  500   2HB   ARG1171           HB1      ARG1171 -15.874   8.880   0.248
  501   1HG   ARG1171           HG2      ARG1171 -15.582   9.801  -2.001
  502   2HG   ARG1171           HG1      ARG1171 -17.217  10.462  -1.934
  503   1HD   ARG1171           HD2      ARG1171 -16.590  11.830  -0.011
  504   2HD   ARG1171           HD1      ARG1171 -14.959  11.162  -0.062
  505    HE   ARG1171           HE       ARG1171 -15.589  12.298  -2.559
  506   1HH1  ARG1171          1HH1      ARG1171 -14.871  13.219   0.724
  507   2HH1  ARG1171          2HH1      ARG1171 -14.201  14.754   0.283
  508   1HH2  ARG1171          1HH2      ARG1171 -14.706  14.316  -3.149
  509   2HH2  ARG1171          2HH2      ARG1171 -14.107  15.377  -1.919
  510    H    GLU1172           HN       GLU1172 -17.696   9.039  -3.180
  511    HA   GLU1172           HA       GLU1172 -20.482   9.536  -2.850
  512   1HB   GLU1172           HB2      GLU1172 -18.848  10.928  -4.191
  513   2HB   GLU1172           HB1      GLU1172 -18.911   9.676  -5.423
  514   1HG   GLU1172           HG2      GLU1172 -21.313  10.042  -5.676
  515   2HG   GLU1172           HG1      GLU1172 -21.248  11.300  -4.440
  516    H    ILE1173           HN       ILE1173 -19.212   6.659  -3.142
  517    HA   ILE1173           HA       ILE1173 -21.368   5.687  -4.886
  518    HB   ILE1173           HB       ILE1173 -18.586   4.521  -4.774
  519   1HG1  ILE1173          2HG1      ILE1173 -18.708   6.703  -5.949
  520   2HG1  ILE1173          1HG1      ILE1173 -18.305   5.374  -7.031
  521   1HG2  ILE1173          3HG2      ILE1173 -20.303   2.842  -5.157
  522   2HG2  ILE1173          2HG2      ILE1173 -20.971   3.805  -6.474
  523   3HG2  ILE1173          1HG2      ILE1173 -19.357   3.108  -6.621
  524   1HD1  ILE1173          2HD1      ILE1173 -21.011   6.655  -6.736
  525   2HD1  ILE1173          1HD1      ILE1173 -19.874   6.906  -8.062
  526   3HD1  ILE1173          3HD1      ILE1173 -20.612   5.323  -7.821
  527    H    MET1174           HN       MET1174 -19.465   5.280  -1.998
  528    HA   MET1174           HA       MET1174 -20.923   2.825  -1.330
  529   1HB   MET1174           HB2      MET1174 -19.310   2.801   0.640
  530   2HB   MET1174           HB1      MET1174 -18.632   2.495  -0.950
  531   1HG   MET1174           HG2      MET1174 -17.173   3.934   0.297
  532   2HG   MET1174           HG1      MET1174 -17.874   4.825  -1.049
  533   1HE   MET1174           HE3      MET1174 -18.172   4.121   2.818
  534   2HE   MET1174           HE2      MET1174 -19.433   5.269   3.268
  535   3HE   MET1174           HE1      MET1174 -19.816   3.902   2.220
  536    H    GLU1175           HN       GLU1175 -20.954   6.122  -0.820
  537    HA   GLU1175           HA       GLU1175 -22.682   5.801   1.542
  538   1HB   GLU1175           HB2      GLU1175 -21.715   7.568   2.603
  539   2HB   GLU1175           HB1      GLU1175 -20.337   7.121   1.605
  540   1HG   GLU1175           HG2      GLU1175 -20.985   8.807  -0.046
  541   2HG   GLU1175           HG1      GLU1175 -22.355   9.264   0.964
  542    H    ASN1176           HN       ASN1176 -22.603   6.521  -1.677
  543    HA   ASN1176           HA       ASN1176 -24.925   8.315  -1.512
  544   1HB   ASN1176           HB2      ASN1176 -22.835   9.103  -2.716
  545   2HB   ASN1176           HB1      ASN1176 -23.210   7.890  -3.930
  546   1HD2  ASN1176          1HD2      ASN1176 -23.511   9.418  -5.534
  547   2HD2  ASN1176          2HD2      ASN1176 -24.904  10.439  -5.582
  548    H    TYR1177           HN       TYR1177 -23.715   5.302  -2.812
  549    HA   TYR1177           HA       TYR1177 -26.019   4.814  -4.471
  550   1HB   TYR1177           HB2      TYR1177 -23.585   3.247  -3.694
  551   2HB   TYR1177           HB1      TYR1177 -24.955   2.414  -4.416
  552    HD1  TYR1177           HD1      TYR1177 -24.497   5.799  -5.564
  553    HD2  TYR1177           HD2      TYR1177 -23.287   1.766  -6.180
  554    HE1  TYR1177           HE1      TYR1177 -23.681   6.390  -7.807
  555    HE2  TYR1177           HE2      TYR1177 -22.466   2.346  -8.419
  556    HH   TYR1177           HH       TYR1177 -22.855   4.066 -10.137
  557    H    ASN1178           HN       ASN1178 -26.532   5.375  -1.669
  558    HA   ASN1178           HA       ASN1178 -27.979   4.697  -0.063
  559   1HB   ASN1178           HB2      ASN1178 -28.513   2.173  -1.618
  560   2HB   ASN1178           HB1      ASN1178 -29.588   3.027  -0.517
  561   1HD2  ASN1178          1HD2      ASN1178 -29.952   2.171  -3.293
  562   2HD2  ASN1178          2HD2      ASN1178 -30.377   3.595  -4.169
  563    H    ILE1179           HN       ILE1179 -25.109   3.540  -0.581
  564    HA   ILE1179           HA       ILE1179 -25.235   1.189   1.135
  565    HB   ILE1179           HB       ILE1179 -22.636   2.350   0.245
  566   1HG1  ILE1179          2HG1      ILE1179 -24.459   0.746  -1.559
  567   2HG1  ILE1179          1HG1      ILE1179 -24.050   2.447  -1.773
  568   1HG2  ILE1179          1HG2      ILE1179 -23.688  -0.453   0.553
  569   2HG2  ILE1179          3HG2      ILE1179 -22.046  -0.032   0.064
  570   3HG2  ILE1179          2HG2      ILE1179 -22.625   0.403   1.672
  571   1HD1  ILE1179          1HD1      ILE1179 -22.111   0.147  -1.867
  572   2HD1  ILE1179          3HD1      ILE1179 -22.746   1.026  -3.258
  573   3HD1  ILE1179          2HD1      ILE1179 -21.708   1.847  -2.092
  574    H    ALA1180           HN       ALA1180 -23.400   1.098   2.841
  575    HA   ALA1180           HA       ALA1180 -22.803   3.620   4.128
  576   1HB   ALA1180           HB1      ALA1180 -25.064   3.173   4.942
  577   2HB   ALA1180           HB3      ALA1180 -24.553   1.583   5.507
  578   3HB   ALA1180           HB2      ALA1180 -23.884   3.038   6.246
  579    H    LEU1181           HN       LEU1181 -22.415   2.190   6.719
  580    HA   LEU1181           HA       LEU1181 -20.393   0.202   6.070
  581   1HB   LEU1181           HB2      LEU1181 -19.789   2.934   6.891
  582   2HB   LEU1181           HB1      LEU1181 -19.061   1.732   7.941
  583    HG   LEU1181           HG       LEU1181 -18.611   0.928   5.246
  584   1HD1  LEU1181          1HD1      LEU1181 -17.832   3.788   5.807
  585   2HD1  LEU1181          3HD1      LEU1181 -17.283   2.819   4.437
  586   3HD1  LEU1181          2HD1      LEU1181 -18.989   3.236   4.596
  587   1HD2  LEU1181          2HD2      LEU1181 -17.239   0.350   7.184
  588   2HD2  LEU1181          1HD2      LEU1181 -16.277   1.101   5.910
  589   3HD2  LEU1181          3HD2      LEU1181 -16.739   2.035   7.332
  590    H    ARG1182           HN       ARG1182 -19.538  -0.876   8.030
  591    HA   ARG1182           HA       ARG1182 -21.626  -1.665   9.738
  592   1HB   ARG1182           HB2      ARG1182 -19.741  -2.766  11.053
  593   2HB   ARG1182           HB1      ARG1182 -19.910  -3.238   9.368
  594   1HG   ARG1182           HG2      ARG1182 -18.095  -1.701   8.767
  595   2HG   ARG1182           HG1      ARG1182 -17.913  -1.272  10.469
  596   1HD   ARG1182           HD2      ARG1182 -17.349  -3.572  11.008
  597   2HD   ARG1182           HD1      ARG1182 -17.585  -4.043   9.326
  598    HE   ARG1182           HE       ARG1182 -15.684  -1.998   9.399
  599   1HH1  ARG1182          1HH1      ARG1182 -16.040  -5.306  10.432
  600   2HH1  ARG1182          2HH1      ARG1182 -14.348  -5.661  10.312
  601   1HH2  ARG1182          1HH2      ARG1182 -13.457  -2.456   9.237
  602   2HH2  ARG1182          2HH2      ARG1182 -12.880  -4.041   9.632
  603    H    TRP1183           HN       TRP1183 -19.964   1.169   9.749
  604    HA   TRP1183           HA       TRP1183 -20.197   1.530  12.661
  605   1HB   TRP1183           HB2      TRP1183 -18.743   3.425  10.832
  606   2HB   TRP1183           HB1      TRP1183 -18.499   3.144  12.554
  607    HD1  TRP1183           HD1      TRP1183 -17.878   1.371   9.173
  608    HE1  TRP1183           HE1      TRP1183 -15.848  -0.189   9.444
  609    HE3  TRP1183           HE3      TRP1183 -17.014   2.015  14.173
  610    HZ2  TRP1183           HZ2      TRP1183 -14.111  -1.020  11.487
  611    HZ3  TRP1183           HZ3      TRP1183 -15.141   0.800  15.208
  612    HH2  TRP1183           HH2      TRP1183 -13.719  -0.687  13.892
  613    H    THR1184           HN       THR1184 -21.696   2.146   9.773
  614    HA   THR1184           HA       THR1184 -23.307   3.549   9.022
  615    HB   THR1184           HB       THR1184 -25.027   4.223  10.681
  616    HG1  THR1184           HG1      THR1184 -23.464   2.852  12.615
  617   1HG2  THR1184          3HG2      THR1184 -25.100   2.003   9.640
  618   2HG2  THR1184          2HG2      THR1184 -24.077   1.364  10.928
  619   3HG2  THR1184          1HG2      THR1184 -25.699   1.948  11.299
  620    H    ALA1185           HN       ALA1185 -21.868   5.147   8.300
  621    HA   ALA1185           HA       ALA1185 -22.213   7.691   9.680
  622   1HB   ALA1185           HB3      ALA1185 -20.075   6.836  10.513
  623   2HB   ALA1185           HB1      ALA1185 -19.851   8.271   9.513
  624   3HB   ALA1185           HB2      ALA1185 -19.495   6.674   8.856
  625    H    LYS1186           HN       LYS1186 -21.837   5.817   6.864
  626    HA   LYS1186           HA       LYS1186 -21.961   6.248   4.641
  627   1HB   LYS1186           HB2      LYS1186 -23.319   8.735   5.679
  628   2HB   LYS1186           HB1      LYS1186 -23.310   8.251   3.989
  629   1HG   LYS1186           HG2      LYS1186 -25.366   7.508   4.764
  630   2HG   LYS1186           HG1      LYS1186 -24.358   6.061   4.825
  631   1HD   LYS1186           HD2      LYS1186 -24.024   6.329   7.195
  632   2HD   LYS1186           HD1      LYS1186 -24.872   7.877   7.176
  633   1HE   LYS1186           HE2      LYS1186 -26.319   6.126   8.032
  634   2HE   LYS1186           HE1      LYS1186 -26.929   6.737   6.495
  635   1HZ   LYS1186           HZ2      LYS1186 -25.948   4.822   5.391
  636   2HZ   LYS1186           HZ1      LYS1186 -25.378   4.234   6.870
  637   3HZ   LYS1186           HZ3      LYS1186 -27.042   4.334   6.584
  638    H    GLN1187           HN       GLN1187 -19.740   6.405   4.291
  639    HA   GLN1187           HA       GLN1187 -18.693   8.454   2.910
  640   1HB   GLN1187           HB2      GLN1187 -18.956  10.022   4.701
  641   2HB   GLN1187           HB1      GLN1187 -18.164   8.938   5.840
  642   1HG   GLN1187           HG2      GLN1187 -16.116   9.117   4.369
  643   2HG   GLN1187           HG1      GLN1187 -16.942  10.442   3.555
  644   1HE2  GLN1187          1HE2      GLN1187 -17.284   9.807   6.965
  645   2HE2  GLN1187          2HE2      GLN1187 -16.438  11.210   7.512
  646    H    LYS1188           HN       LYS1188 -17.192   7.169   5.873
  647    HA   LYS1188           HA       LYS1188 -14.732   6.645   5.406
  648   1HB   LYS1188           HB2      LYS1188 -15.964   5.581   7.258
  649   2HB   LYS1188           HB1      LYS1188 -16.542   4.347   6.150
  650   1HG   LYS1188           HG2      LYS1188 -14.336   3.500   5.823
  651   2HG   LYS1188           HG1      LYS1188 -13.633   4.848   6.719
  652   1HD   LYS1188           HD2      LYS1188 -15.517   2.809   7.896
  653   2HD   LYS1188           HD1      LYS1188 -13.759   2.740   8.028
  654   1HE   LYS1188           HE2      LYS1188 -13.772   4.914   9.168
  655   2HE   LYS1188           HE1      LYS1188 -15.531   4.951   9.060
  656   1HZ   LYS1188           HZ1      LYS1188 -13.934   2.918  10.522
  657   2HZ   LYS1188           HZ3      LYS1188 -14.792   4.193  11.229
  658   3HZ   LYS1188           HZ2      LYS1188 -15.622   2.959  10.424
  659    H    LEU1189           HN       LEU1189 -13.960   6.635   3.383
  660    HA   LEU1189           HA       LEU1189 -14.621   4.335   1.685
  661   1HB   LEU1189           HB2      LEU1189 -14.027   5.744  -0.221
  662   2HB   LEU1189           HB1      LEU1189 -15.347   6.423   0.706
  663    HG   LEU1189           HG       LEU1189 -12.514   7.335   1.130
  664   1HD1  LEU1189          3HD1      LEU1189 -14.492   8.407  -0.876
  665   2HD1  LEU1189          2HD1      LEU1189 -12.976   9.184  -0.420
  666   3HD1  LEU1189          1HD1      LEU1189 -12.955   7.621  -1.236
  667   1HD2  LEU1189          3HD2      LEU1189 -14.293   7.867   2.789
  668   2HD2  LEU1189          2HD2      LEU1189 -13.544   9.285   2.050
  669   3HD2  LEU1189          1HD2      LEU1189 -15.140   8.752   1.521
  670    H    TYR1190           HN       TYR1190 -12.715   3.774   3.519
  671    HA   TYR1190           HA       TYR1190 -10.493   3.090   1.947
  672   1HB   TYR1190           HB2      TYR1190  -8.762   4.538   2.942
  673   2HB   TYR1190           HB1      TYR1190  -9.937   5.439   1.992
  674    HD1  TYR1190           HD1      TYR1190 -12.121   5.316   4.253
  675    HD2  TYR1190           HD2      TYR1190  -8.017   6.458   4.163
  676    HE1  TYR1190           HE1      TYR1190 -12.501   6.834   6.151
  677    HE2  TYR1190           HE2      TYR1190  -8.388   7.971   6.061
  678    HH   TYR1190           HH       TYR1190 -10.252   9.185   7.115
  679    H    SER1191           HN       SER1191  -8.598   2.366   3.242
  680    HA   SER1191           HA       SER1191  -8.685   1.799   5.983
  681   1HB   SER1191           HB2      SER1191  -9.876  -0.285   4.169
  682   2HB   SER1191           HB1      SER1191  -8.985  -0.781   5.606
  683    HG   SER1191           HG       SER1191 -10.465   0.249   6.878
  684    H    ARG1192           HN       ARG1192  -7.345  -0.645   6.034
  685    HA   ARG1192           HA       ARG1192  -4.878   0.051   4.610
  686   1HB   ARG1192           HB2      ARG1192  -4.695  -0.173   7.054
  687   2HB   ARG1192           HB1      ARG1192  -5.329  -1.810   6.956
  688   1HG   ARG1192           HG2      ARG1192  -3.376  -2.497   5.664
  689   2HG   ARG1192           HG1      ARG1192  -2.741  -0.853   5.750
  690   1HD   ARG1192           HD2      ARG1192  -1.690  -2.298   7.413
  691   2HD   ARG1192           HD1      ARG1192  -2.622  -1.011   8.178
  692    HE   ARG1192           HE       ARG1192  -4.251  -3.279   7.932
  693   1HH1  ARG1192          1HH1      ARG1192  -1.443  -2.187   9.683
  694   2HH1  ARG1192          2HH1      ARG1192  -1.747  -3.198  11.056
  695   1HH2  ARG1192          1HH2      ARG1192  -4.658  -4.613   9.734
  696   2HH2  ARG1192          2HH2      ARG1192  -3.574  -4.578  11.085
  697    H    THR1193           HN       THR1193  -4.764  -0.936   2.687
  698    HA   THR1193           HA       THR1193  -6.185  -2.929   1.627
  699    HB   THR1193           HB       THR1193  -3.219  -2.485   1.267
  700    HG1  THR1193           HG1      THR1193  -5.502  -1.787  -0.287
  701   1HG2  THR1193          3HG2      THR1193  -5.058  -4.236  -0.367
  702   2HG2  THR1193          2HG2      THR1193  -3.408  -3.797  -0.812
  703   3HG2  THR1193          1HG2      THR1193  -3.704  -4.781   0.622
  704    H    GLY1194           HN       GLY1194  -6.709  -4.893   2.220
  705   1HA   GLY1194           HA1      GLY1194  -4.775  -6.439   3.825
  706   2HA   GLY1194           HA2      GLY1194  -5.779  -7.180   2.584
  707    H    GLU1195           HN       GLU1195  -7.354  -4.709   4.263
  708    HA   GLU1195           HA       GLU1195  -8.481  -6.552   6.246
  709   1HB   GLU1195           HB2      GLU1195  -8.725  -3.547   6.008
  710   2HB   GLU1195           HB1      GLU1195  -9.414  -4.524   7.298
  711   1HG   GLU1195           HG2      GLU1195  -6.481  -4.222   6.691
  712   2HG   GLU1195           HG1      GLU1195  -7.357  -3.426   7.998
  713    H    SER1196           HN       SER1196 -10.733  -6.805   6.476
  714    HA   SER1196           HA       SER1196 -12.170  -6.529   3.961
  715   1HB   SER1196           HB2      SER1196 -13.847  -8.004   5.008
  716   2HB   SER1196           HB1      SER1196 -12.229  -8.702   5.083
  717    HG   SER1196           HG       SER1196 -13.892  -8.153   7.090
  718    H    VAL1197           HN       VAL1197 -13.450  -4.864   3.581
  719    HA   VAL1197           HA       VAL1197 -14.484  -3.315   5.849
  720    HB   VAL1197           HB       VAL1197 -14.231  -2.577   2.929
  721   1HG1  VAL1197          2HG1      VAL1197 -16.233  -1.563   3.885
  722   2HG1  VAL1197          1HG1      VAL1197 -15.288  -0.939   5.236
  723   3HG1  VAL1197          3HG1      VAL1197 -14.992  -0.342   3.603
  724   1HG2  VAL1197          1HG2      VAL1197 -12.802  -1.573   5.391
  725   2HG2  VAL1197          3HG2      VAL1197 -12.113  -2.587   4.124
  726   3HG2  VAL1197          2HG2      VAL1197 -12.604  -0.933   3.760
  727    H    GLU1198           HN       GLU1198 -16.504  -3.624   6.431
  728    HA   GLU1198           HA       GLU1198 -18.364  -4.841   4.524
  729   1HB   GLU1198           HB2      GLU1198 -18.515  -6.196   6.345
  730   2HB   GLU1198           HB1      GLU1198 -18.028  -4.929   7.463
  731   1HG   GLU1198           HG2      GLU1198 -20.227  -3.988   7.451
  732   2HG   GLU1198           HG1      GLU1198 -20.747  -5.107   6.186
  733    H    PHE1199           HN       PHE1199 -19.616  -3.460   3.460
  734    HA   PHE1199           HA       PHE1199 -20.381  -0.932   4.700
  735   1HB   PHE1199           HB2      PHE1199 -20.901  -1.965   1.901
  736   2HB   PHE1199           HB1      PHE1199 -21.256  -0.342   2.477
  737    HD1  PHE1199           HD1      PHE1199 -19.306   1.133   3.191
  738    HD2  PHE1199           HD2      PHE1199 -18.819  -2.498   1.025
  739    HE1  PHE1199           HE1      PHE1199 -17.065   1.877   2.464
  740    HE2  PHE1199           HE2      PHE1199 -16.589  -1.770   0.300
  741    HZ   PHE1199           HZ       PHE1199 -15.707   0.415   1.019
  742    H    VAL1200           HN       VAL1200 -22.701  -0.231   4.354
  743    HA   VAL1200           HA       VAL1200 -24.552  -2.500   4.742
  744    HB   VAL1200           HB       VAL1200 -25.004   0.194   6.003
  745   1HG1  VAL1200          1HG1      VAL1200 -25.937  -2.584   6.706
  746   2HG1  VAL1200          3HG1      VAL1200 -26.321  -1.118   7.609
  747   3HG1  VAL1200          2HG1      VAL1200 -26.900  -1.313   5.954
  748   1HG2  VAL1200          3HG2      VAL1200 -22.807  -0.525   6.759
  749   2HG2  VAL1200          2HG2      VAL1200 -23.983  -0.635   8.067
  750   3HG2  VAL1200          1HG2      VAL1200 -23.466  -2.094   7.222
  751    H    CYS1201           HN       CYS1201 -26.956  -1.224   4.637
  752    HA   CYS1201           HA       CYS1201 -26.888   0.032   1.976
  753   1HB   CYS1201           HB2      CYS1201 -29.298  -1.321   3.168
  754   2HB   CYS1201           HB1      CYS1201 -28.992  -0.909   1.486
  755    H    LYS1202           HN       LYS1202 -26.381   1.932   3.487
  756    HA   LYS1202           HA       LYS1202 -27.046   3.730   4.790
  757   1HB   LYS1202           HB2      LYS1202 -27.349   4.343   2.401
  758   2HB   LYS1202           HB1      LYS1202 -29.037   3.866   2.524
  759   1HG   LYS1202           HG2      LYS1202 -29.281   5.570   4.351
  760   2HG   LYS1202           HG1      LYS1202 -27.660   6.133   3.935
  761   1HD   LYS1202           HD2      LYS1202 -28.396   6.598   1.657
  762   2HD   LYS1202           HD1      LYS1202 -30.012   6.007   2.055
  763   1HE   LYS1202           HE2      LYS1202 -30.258   7.786   3.712
  764   2HE   LYS1202           HE1      LYS1202 -28.635   8.367   3.336
  765   1HZ   LYS1202           HZ3      LYS1202 -29.367   8.840   1.081
  766   2HZ   LYS1202           HZ2      LYS1202 -30.924   8.287   1.444
  767   3HZ   LYS1202           HZ1      LYS1202 -30.320   9.671   2.206
  768    H    ARG1203           HN       ARG1203 -27.847   2.604   6.605
  769    HA   ARG1203           HA       ARG1203 -29.532   1.502   7.847
  770   1HB   ARG1203           HB2      ARG1203 -29.788   4.482   7.808
  771   2HB   ARG1203           HB1      ARG1203 -30.696   3.491   8.939
  772   1HG   ARG1203           HG2      ARG1203 -28.598   2.597   9.833
  773   2HG   ARG1203           HG1      ARG1203 -27.699   3.619   8.708
  774   1HD   ARG1203           HD2      ARG1203 -28.663   5.612   9.740
  775   2HD   ARG1203           HD1      ARG1203 -29.577   4.598  10.855
  776    HE   ARG1203           HE       ARG1203 -26.886   3.934  11.122
  777   1HH1  ARG1203          1HH1      ARG1203 -28.977   6.664  11.675
  778   2HH1  ARG1203          2HH1      ARG1203 -28.026   7.293  12.978
  779   1HH2  ARG1203          1HH2      ARG1203 -25.627   4.754  12.838
  780   2HH2  ARG1203          2HH2      ARG1203 -26.122   6.208  13.640
  781    H    GLY1204           HN       GLY1204 -30.868   0.316   6.335
  782   1HA   GLY1204           HA1      GLY1204 -33.303   1.766   5.534
  783   2HA   GLY1204           HA2      GLY1204 -33.437   0.291   6.471
  784    H    TYR1205           HN       TYR1205 -31.747   1.378   3.502
  785    HA   TYR1205           HA       TYR1205 -33.165  -0.062   1.672
  786   1HB   TYR1205           HB2      TYR1205 -30.208   0.503   1.642
  787   2HB   TYR1205           HB1      TYR1205 -31.104  -0.090   0.258
  788    HD1  TYR1205           HD1      TYR1205 -30.503   2.786   2.453
  789    HD2  TYR1205           HD2      TYR1205 -32.568   1.373  -0.984
  790    HE1  TYR1205           HE1      TYR1205 -31.030   5.103   1.823
  791    HE2  TYR1205           HE2      TYR1205 -33.104   3.685  -1.623
  792    HH   TYR1205           HH       TYR1205 -31.612   6.376  -0.196
  793    H    ARG1206           HN       ARG1206 -32.941  -2.031   0.618
  794    HA   ARG1206           HA       ARG1206 -31.670  -4.133   2.245
  795   1HB   ARG1206           HB2      ARG1206 -33.367  -5.657   1.177
  796   2HB   ARG1206           HB1      ARG1206 -34.032  -4.450   2.269
  797   1HG   ARG1206           HG2      ARG1206 -34.951  -3.206   0.543
  798   2HG   ARG1206           HG1      ARG1206 -33.893  -3.924  -0.675
  799   1HD   ARG1206           HD2      ARG1206 -36.163  -4.772  -0.897
  800   2HD   ARG1206           HD1      ARG1206 -35.062  -6.062  -0.414
  801    HE   ARG1206           HE       ARG1206 -36.205  -4.941   1.888
  802   1HH1  ARG1206          1HH1      ARG1206 -37.107  -6.856  -0.879
  803   2HH1  ARG1206          2HH1      ARG1206 -38.395  -7.672  -0.056
  804   1HH2  ARG1206          1HH2      ARG1206 -37.897  -6.011   2.980
  805   2HH2  ARG1206          2HH2      ARG1206 -38.843  -7.191   2.137
  806    H    LEU1207           HN       LEU1207 -30.163  -5.381   1.337
  807    HA   LEU1207           HA       LEU1207 -28.866  -4.792  -1.008
  808   1HB   LEU1207           HB2      LEU1207 -28.059  -6.322   0.806
  809   2HB   LEU1207           HB1      LEU1207 -29.109  -7.567   0.157
  810    HG   LEU1207           HG       LEU1207 -27.821  -7.306  -2.033
  811   1HD1  LEU1207          2HD1      LEU1207 -25.913  -5.866  -0.193
  812   2HD1  LEU1207          1HD1      LEU1207 -25.554  -6.398  -1.837
  813   3HD1  LEU1207          3HD1      LEU1207 -26.778  -5.157  -1.558
  814   1HD2  LEU1207          3HD2      LEU1207 -26.375  -8.313   0.412
  815   2HD2  LEU1207          2HD2      LEU1207 -27.540  -9.217  -0.555
  816   3HD2  LEU1207          1HD2      LEU1207 -25.995  -8.738  -1.257
  817    H    SER1208           HN       SER1208 -29.470  -4.848  -3.058
  818    HA   SER1208           HA       SER1208 -31.862  -6.150  -3.900
  819   1HB   SER1208           HB2      SER1208 -29.690  -4.708  -5.425
  820   2HB   SER1208           HB1      SER1208 -31.160  -5.329  -6.171
  821    HG   SER1208           HG       SER1208 -30.904  -3.304  -4.216
  822    H    SER1209           HN       SER1209 -29.201  -7.617  -3.049
  823    HA   SER1209           HA       SER1209 -28.366  -9.701  -3.416
  824   1HB   SER1209           HB2      SER1209 -30.649 -10.432  -3.917
  825   2HB   SER1209           HB1      SER1209 -30.474  -9.880  -5.583
  826    HG   SER1209           HG       SER1209 -28.487 -11.414  -5.375
  827    H    ARG1210           HN       ARG1210 -29.254  -8.630  -6.706
  828    HA   ARG1210           HA       ARG1210 -26.904  -9.501  -7.930
  829   1HB   ARG1210           HB2      ARG1210 -28.727  -7.230  -8.748
  830   2HB   ARG1210           HB1      ARG1210 -27.524  -7.986  -9.783
  831   1HG   ARG1210           HG2      ARG1210 -29.884  -9.406  -8.566
  832   2HG   ARG1210           HG1      ARG1210 -29.812  -8.785 -10.215
  833   1HD   ARG1210           HD2      ARG1210 -27.995 -10.882  -9.034
  834   2HD   ARG1210           HD1      ARG1210 -29.334 -11.181 -10.142
  835    HE   ARG1210           HE       ARG1210 -27.605  -9.348 -11.346
  836   1HH1  ARG1210          1HH1      ARG1210 -27.627 -12.682 -10.333
  837   2HH1  ARG1210          2HH1      ARG1210 -26.497 -13.191 -11.542
  838   1HH2  ARG1210          1HH2      ARG1210 -26.117 -10.010 -12.942
  839   2HH2  ARG1210          2HH2      ARG1210 -25.639 -11.671 -13.025
  840    H    SER1211           HN       SER1211 -27.363  -6.955  -5.780
  841    HA   SER1211           HA       SER1211 -25.531  -5.036  -6.706
  842   1HB   SER1211           HB2      SER1211 -26.266  -5.699  -3.844
  843   2HB   SER1211           HB1      SER1211 -25.533  -4.197  -4.406
  844    HG   SER1211           HG       SER1211 -27.464  -3.992  -5.763
  845    H    HIS1212           HN       HIS1212 -23.626  -4.544  -4.927
  846    HA   HIS1212           HA       HIS1212 -21.796  -6.780  -5.304
  847   1HB   HIS1212           HB2      HIS1212 -21.310  -3.926  -4.431
  848   2HB   HIS1212           HB1      HIS1212 -20.047  -5.137  -4.627
  849    HD1  HIS1212           HD1      HIS1212 -19.058  -5.356  -6.903
  850    HD2  HIS1212           HD2      HIS1212 -22.671  -3.305  -6.946
  851    HE1  HIS1212           HE1      HIS1212 -19.324  -4.513  -9.257
  852    HE2  HIS1212           HE2      HIS1212 -21.560  -3.352  -9.282
  853    H    THR1213           HN       THR1213 -20.556  -7.663  -3.640
  854    HA   THR1213           HA       THR1213 -21.864  -8.268  -1.284
  855    HB   THR1213           HB       THR1213 -19.711  -9.148  -0.460
  856    HG1  THR1213           HG1      THR1213 -18.758  -7.536  -2.542
  857   1HG2  THR1213          3HG2      THR1213 -20.252  -9.734  -3.373
  858   2HG2  THR1213          2HG2      THR1213 -19.323 -10.755  -2.274
  859   3HG2  THR1213          1HG2      THR1213 -21.046 -10.499  -1.996
  860    H    LEU1214           HN       LEU1214 -21.981  -7.419   0.710
  861    HA   LEU1214           HA       LEU1214 -21.281  -4.722   1.161
  862   1HB   LEU1214           HB2      LEU1214 -22.030  -6.883   3.133
  863   2HB   LEU1214           HB1      LEU1214 -21.972  -5.168   3.492
  864    HG   LEU1214           HG       LEU1214 -23.775  -6.309   1.365
  865   1HD1  LEU1214          3HD1      LEU1214 -24.400  -5.813   4.272
  866   2HD1  LEU1214          2HD1      LEU1214 -25.578  -6.209   3.021
  867   3HD1  LEU1214          1HD1      LEU1214 -24.338  -7.382   3.468
  868   1HD2  LEU1214          3HD2      LEU1214 -23.255  -3.894   1.296
  869   2HD2  LEU1214          2HD2      LEU1214 -24.959  -4.224   1.609
  870   3HD2  LEU1214          1HD2      LEU1214 -23.897  -3.736   2.930
  871    H    ARG1215           HN       ARG1215 -20.084  -7.642   2.815
  872    HA   ARG1215           HA       ARG1215 -17.704  -6.194   3.662
  873   1HB   ARG1215           HB2      ARG1215 -18.939  -7.683   5.239
  874   2HB   ARG1215           HB1      ARG1215 -18.502  -9.055   4.230
  875   1HG   ARG1215           HG2      ARG1215 -16.124  -8.576   4.649
  876   2HG   ARG1215           HG1      ARG1215 -16.601  -7.253   5.716
  877   1HD   ARG1215           HD2      ARG1215 -16.075  -9.249   7.002
  878   2HD   ARG1215           HD1      ARG1215 -17.783  -8.837   7.154
  879    HE   ARG1215           HE       ARG1215 -17.550 -10.661   5.068
  880   1HH1  ARG1215          1HH1      ARG1215 -17.029 -10.557   8.511
  881   2HH1  ARG1215          2HH1      ARG1215 -17.370 -12.240   8.744
  882   1HH2  ARG1215          1HH2      ARG1215 -18.001 -12.876   5.364
  883   2HH2  ARG1215          2HH2      ARG1215 -17.922 -13.557   6.953
  884    H    THR1216           HN       THR1216 -16.201  -6.003   2.118
  885    HA   THR1216           HA       THR1216 -15.426  -8.439   0.649
  886    HB   THR1216           HB       THR1216 -16.512  -6.968  -0.917
  887    HG1  THR1216           HG1      THR1216 -14.425  -8.004  -1.483
  888   1HG2  THR1216          1HG2      THR1216 -14.594  -4.852   0.061
  889   2HG2  THR1216          3HG2      THR1216 -15.650  -4.684  -1.343
  890   3HG2  THR1216          2HG2      THR1216 -16.345  -4.865   0.268
  891    H    THR1217           HN       THR1217 -13.192  -7.883  -0.497
  892    HA   THR1217           HA       THR1217 -11.383  -7.027   1.662
  893    HB   THR1217           HB       THR1217 -11.002  -8.986  -0.598
  894    HG1  THR1217           HG1      THR1217 -10.063  -9.874   1.690
  895   1HG2  THR1217          2HG2      THR1217  -9.034  -7.444  -0.455
  896   2HG2  THR1217          1HG2      THR1217  -8.820  -7.952   1.220
  897   3HG2  THR1217          3HG2      THR1217  -8.650  -9.127  -0.084
  898    H    CYS1218           HN       CYS1218 -10.041  -5.352   1.346
  899    HA   CYS1218           HA       CYS1218 -10.241  -3.942  -1.187
  900   1HB   CYS1218           HB2      CYS1218  -8.577  -2.972   1.101
  901   2HB   CYS1218           HB1      CYS1218  -9.486  -2.051  -0.097
  902    H    TRP1219           HN       TRP1219  -8.453  -3.352  -2.443
  903    HA   TRP1219           HA       TRP1219  -5.802  -4.092  -1.843
  904   1HB   TRP1219           HB2      TRP1219  -7.300  -6.303  -2.458
  905   2HB   TRP1219           HB1      TRP1219  -6.639  -5.871  -4.033
  906    HD1  TRP1219           HD1      TRP1219  -3.843  -5.586  -4.050
  907    HE1  TRP1219           HE1      TRP1219  -2.113  -7.056  -2.850
  908    HE3  TRP1219           HE3      TRP1219  -6.869  -7.728  -0.528
  909    HZ2  TRP1219           HZ2      TRP1219  -2.023  -8.875  -0.715
  910    HZ3  TRP1219           HZ3      TRP1219  -5.878  -9.328   1.059
  911    HH2  TRP1219           HH2      TRP1219  -3.503  -9.890   0.967
  912    H    ASP1220           HN       ASP1220  -4.513  -2.915  -3.079
  913    HA   ASP1220           HA       ASP1220  -3.770  -1.538  -4.726
  914   1HB   ASP1220           HB2      ASP1220  -4.039  -3.645  -6.056
  915   2HB   ASP1220           HB1      ASP1220  -5.643  -3.087  -6.527
  916    H    GLY1221           HN       GLY1221  -6.606  -1.262  -3.375
  917   1HA   GLY1221           HA1      GLY1221  -7.186   1.272  -4.660
  918   2HA   GLY1221           HA2      GLY1221  -7.909   0.659  -3.184
  919    H    LYS1222           HN       LYS1222  -8.568  -1.927  -4.521
  920    HA   LYS1222           HA       LYS1222 -10.831  -0.958  -6.144
  921   1HB   LYS1222           HB2      LYS1222  -8.847  -2.751  -6.911
  922   2HB   LYS1222           HB1      LYS1222 -10.220  -3.771  -6.496
  923   1HG   LYS1222           HG2      LYS1222 -10.316  -1.466  -8.428
  924   2HG   LYS1222           HG1      LYS1222 -10.161  -3.166  -8.877
  925   1HD   LYS1222           HD2      LYS1222 -12.311  -3.643  -7.806
  926   2HD   LYS1222           HD1      LYS1222 -12.466  -1.943  -7.360
  927   1HE   LYS1222           HE2      LYS1222 -12.317  -3.031 -10.169
  928   2HE   LYS1222           HE1      LYS1222 -13.775  -2.460  -9.356
  929   1HZ   LYS1222           HZ1      LYS1222 -11.390  -0.806  -9.989
  930   2HZ   LYS1222           HZ3      LYS1222 -12.863  -0.775 -10.822
  931   3HZ   LYS1222           HZ2      LYS1222 -12.791  -0.259  -9.213
  932    H    LEU1223           HN       LEU1223 -12.808  -1.472  -5.500
  933    HA   LEU1223           HA       LEU1223 -13.216  -3.682  -3.633
  934   1HB   LEU1223           HB2      LEU1223 -14.008  -0.822  -3.178
  935   2HB   LEU1223           HB1      LEU1223 -14.731  -2.156  -2.300
  936    HG   LEU1223           HG       LEU1223 -11.771  -1.608  -2.307
  937   1HD1  LEU1223          3HD1      LEU1223 -13.167   0.294  -1.428
  938   2HD1  LEU1223          2HD1      LEU1223 -13.721  -0.811  -0.169
  939   3HD1  LEU1223          1HD1      LEU1223 -12.010  -0.404  -0.295
  940   1HD2  LEU1223          2HD2      LEU1223 -12.504  -3.876  -1.701
  941   2HD2  LEU1223          1HD2      LEU1223 -11.772  -3.013  -0.348
  942   3HD2  LEU1223          3HD2      LEU1223 -13.523  -3.186  -0.437
  943    H    GLU1224           HN       GLU1224 -15.639  -3.904  -3.164
  944    HA   GLU1224           HA       GLU1224 -17.154  -3.472  -5.654
  945   1HB   GLU1224           HB2      GLU1224 -17.330  -5.804  -3.733
  946   2HB   GLU1224           HB1      GLU1224 -18.371  -5.567  -5.129
  947   1HG   GLU1224           HG2      GLU1224 -15.387  -5.961  -5.211
  948   2HG   GLU1224           HG1      GLU1224 -16.603  -7.185  -5.575
  949    H    TYR1225           HN       TYR1225 -17.897  -1.452  -4.699
  950    HA   TYR1225           HA       TYR1225 -19.330  -1.362  -2.267
  951   1HB   TYR1225           HB2      TYR1225 -20.435   0.689  -3.691
  952   2HB   TYR1225           HB1      TYR1225 -18.922   0.797  -2.798
  953    HD1  TYR1225           HD1      TYR1225 -17.050   1.549  -3.891
  954    HD2  TYR1225           HD2      TYR1225 -20.204  -0.157  -6.168
  955    HE1  TYR1225           HE1      TYR1225 -15.851   2.129  -5.950
  956    HE2  TYR1225           HE2      TYR1225 -19.016   0.415  -8.250
  957    HH   TYR1225           HH       TYR1225 -17.309   2.018  -9.016
  958    HA   PRO1226           HA       PRO1226 -22.972  -3.613  -3.416
  959   1HB   PRO1226           HB2      PRO1226 -24.155  -2.070  -1.171
  960   2HB   PRO1226           HB1      PRO1226 -24.094  -3.817  -1.429
  961   1HG   PRO1226           HG2      PRO1226 -22.523  -2.667   0.384
  962   2HG   PRO1226           HG1      PRO1226 -21.913  -3.987  -0.632
  963   1HD   PRO1226           HD2      PRO1226 -21.447  -1.044  -0.876
  964   2HD   PRO1226           HD1      PRO1226 -20.305  -2.390  -1.086
  965    H    THR1227           HN       THR1227 -25.514  -2.841  -3.188
  966    HA   THR1227           HA       THR1227 -26.062  -0.187  -4.067
  967    HB   THR1227           HB       THR1227 -26.450  -2.303  -6.195
  968    HG1  THR1227           HG1      THR1227 -24.643  -0.478  -6.924
  969   1HG2  THR1227          1HG2      THR1227 -26.589   0.715  -6.267
  970   2HG2  THR1227          3HG2      THR1227 -26.817  -0.357  -7.650
  971   3HG2  THR1227          2HG2      THR1227 -27.963  -0.390  -6.309
  972    H    CYS1228           HN       CYS1228 -27.149  -1.367  -2.020
  973    HA   CYS1228           HA       CYS1228 -29.336  -3.072  -2.433
  974   1HB   CYS1228           HB2      CYS1228 -29.014  -1.052  -0.206
  975   2HB   CYS1228           HB1      CYS1228 -29.964  -2.537  -0.171
  976    H    ALA1229           HN       ALA1229 -31.619  -2.035  -1.419
  977    HA   ALA1229           HA       ALA1229 -32.237   0.449  -2.747
  978   1HB   ALA1229           HB3      ALA1229 -33.561  -2.078  -3.693
  979   2HB   ALA1229           HB1      ALA1229 -32.332  -1.180  -4.585
  980   3HB   ALA1229           HB2      ALA1229 -33.899  -0.440  -4.249
  981    H    LYS1230           HN       LYS1230 -34.171   1.346  -2.200
  982    HA   LYS1230           HA       LYS1230 -35.900   1.871  -0.876
  983   1HB   LYS1230           HB2      LYS1230 -37.214   0.275  -1.912
  984   2HB   LYS1230           HB1      LYS1230 -36.260  -1.062  -1.289
  985   1HG   LYS1230           HG2      LYS1230 -37.222  -0.837   0.871
  986   2HG   LYS1230           HG1      LYS1230 -38.050   0.653   0.412
  987   1HD   LYS1230           HD2      LYS1230 -39.635  -1.160   0.382
  988   2HD   LYS1230           HD1      LYS1230 -39.327  -0.645  -1.278
  989   1HE   LYS1230           HE2      LYS1230 -37.764  -2.506  -1.564
  990   2HE   LYS1230           HE1      LYS1230 -38.073  -3.020   0.094
  991   1HZ   LYS1230           HZ2      LYS1230 -40.091  -2.905  -2.081
  992   2HZ   LYS1230           HZ1      LYS1230 -39.361  -4.311  -1.486
  993   3HZ   LYS1230           HZ3      LYS1230 -40.385  -3.402  -0.491
  994    H    ARG1231           HN       ARG1231 -34.869   2.732   0.825
  995    HA   ARG1231           HA       ARG1231 -33.798   1.329   2.988
  996   1HB   ARG1231           HB2      ARG1231 -34.047   3.593   4.146
  997   2HB   ARG1231           HB1      ARG1231 -33.043   3.533   2.715
  998   1HG   ARG1231           HG2      ARG1231 -34.894   4.426   1.386
  999   2HG   ARG1231           HG1      ARG1231 -35.895   4.494   2.839
 1000   1HD   ARG1231           HD2      ARG1231 -34.309   6.055   3.856
 1001   2HD   ARG1231           HD1      ARG1231 -33.312   5.988   2.403
 1002    HE   ARG1231           HE       ARG1231 -35.928   6.749   1.703
 1003   1HH1  ARG1231          1HH1      ARG1231 -33.116   7.979   3.354
 1004   2HH1  ARG1231          2HH1      ARG1231 -33.466   9.634   2.986
 1005   1HH2  ARG1231          1HH2      ARG1231 -36.395   8.926   1.215
 1006   2HH2  ARG1231          2HH2      ARG1231 -35.330  10.173   1.772

  No H/Q in entry =        1006
  Start of MODEL   11
    1    H1   GLU1103           HT3      GLU1103  32.249  -9.235  -2.228
    2    H2   GLU1103           HT2      GLU1103  30.720  -9.660  -1.642
    3    H3   GLU1103           HT1      GLU1103  30.857  -8.626  -2.972
    4    HA   GLU1103           HA       GLU1103  31.856  -6.926  -1.632
    5   1HB   GLU1103           HB2      GLU1103  29.293  -8.076  -0.516
    6   2HB   GLU1103           HB1      GLU1103  29.918  -6.494  -0.077
    7   1HG   GLU1103           HG2      GLU1103  28.255  -6.178  -1.735
    8   2HG   GLU1103           HG1      GLU1103  29.819  -5.865  -2.485
    9    H    ALA1104           HN       ALA1104  33.552  -6.894  -0.314
   10    HA   ALA1104           HA       ALA1104  33.281  -7.715   2.418
   11   1HB   ALA1104           HB3      ALA1104  35.277  -9.189   0.705
   12   2HB   ALA1104           HB2      ALA1104  35.105  -9.329   2.454
   13   3HB   ALA1104           HB1      ALA1104  33.806  -9.875   1.393
   14    H    GLU1105           HN       GLU1105  34.686  -5.945  -0.049
   15    HA   GLU1105           HA       GLU1105  37.008  -5.114   1.506
   16   1HB   GLU1105           HB2      GLU1105  37.071  -5.529  -1.003
   17   2HB   GLU1105           HB1      GLU1105  36.138  -4.049  -1.179
   18   1HG   GLU1105           HG2      GLU1105  37.911  -2.765  -0.163
   19   2HG   GLU1105           HG1      GLU1105  38.834  -4.235   0.145
   20    H    PHE1106           HN       PHE1106  34.820  -3.107  -0.444
   21    HA   PHE1106           HA       PHE1106  33.666  -1.728   1.737
   22   1HB   PHE1106           HB2      PHE1106  34.829   0.338   1.743
   23   2HB   PHE1106           HB1      PHE1106  36.070  -0.907   1.833
   24    HD1  PHE1106           HD1      PHE1106  37.468  -1.407  -0.130
   25    HD2  PHE1106           HD2      PHE1106  34.679   1.807  -0.121
   26    HE1  PHE1106           HE1      PHE1106  38.597  -0.427  -2.084
   27    HE2  PHE1106           HE2      PHE1106  35.801   2.792  -2.076
   28    HZ   PHE1106           HZ       PHE1106  37.763   1.674  -3.060
   29    H    GLY1107           HN       GLY1107  32.062  -0.297   1.089
   30   1HA   GLY1107           HA1      GLY1107  30.987  -0.688  -1.475
   31   2HA   GLY1107           HA2      GLY1107  31.796   0.868  -1.427
   32    H    LYS1108           HN       LYS1108  31.197   2.176   0.644
   33    HA   LYS1108           HA       LYS1108  28.834   1.863   2.017
   34   1HB   LYS1108           HB2      LYS1108  30.087   4.437   1.042
   35   2HB   LYS1108           HB1      LYS1108  28.816   4.343   2.253
   36   1HG   LYS1108           HG2      LYS1108  30.338   2.972   3.660
   37   2HG   LYS1108           HG1      LYS1108  31.615   3.260   2.474
   38   1HD   LYS1108           HD2      LYS1108  31.414   5.669   2.839
   39   2HD   LYS1108           HD1      LYS1108  30.132   5.385   4.018
   40   1HE   LYS1108           HE2      LYS1108  32.987   4.435   4.237
   41   2HE   LYS1108           HE1      LYS1108  32.274   5.786   5.119
   42   1HZ   LYS1108           HZ1      LYS1108  30.749   4.237   6.180
   43   2HZ   LYS1108           HZ3      LYS1108  31.440   2.943   5.338
   44   3HZ   LYS1108           HZ2      LYS1108  32.354   3.796   6.477
   45    H    CYS1109           HN       CYS1109  26.743   2.007   1.565
   46    HA   CYS1109           HA       CYS1109  25.958   2.367  -1.188
   47   1HB   CYS1109           HB2      CYS1109  23.918   2.017   0.943
   48   2HB   CYS1109           HB1      CYS1109  24.036   1.259  -0.644
   49    H    GLY1110           HN       GLY1110  24.247   3.765  -1.860
   50   1HA   GLY1110           HA1      GLY1110  24.143   6.218  -2.021
   51   2HA   GLY1110           HA2      GLY1110  24.117   6.249  -0.263
   52    HA   PRO1111           HA       PRO1111  19.709   6.899  -0.840
   53   1HB   PRO1111           HB2      PRO1111  19.790   7.535  -3.756
   54   2HB   PRO1111           HB1      PRO1111  18.973   8.387  -2.441
   55   1HG   PRO1111           HG2      PRO1111  21.228   9.346  -3.488
   56   2HG   PRO1111           HG1      PRO1111  20.915   9.449  -1.745
   57   1HD   PRO1111           HD2      PRO1111  22.743   7.630  -3.242
   58   2HD   PRO1111           HD1      PRO1111  22.927   8.337  -1.624
   59    HA   PRO1112           HA       PRO1112  19.113   2.717  -2.489
   60   1HB   PRO1112           HB2      PRO1112  17.073   2.057  -0.838
   61   2HB   PRO1112           HB1      PRO1112  18.765   2.022  -0.331
   62   1HG   PRO1112           HG2      PRO1112  16.687   4.128   0.140
   63   2HG   PRO1112           HG1      PRO1112  17.877   3.459   1.272
   64   1HD   PRO1112           HD2      PRO1112  18.227   5.836   0.013
   65   2HD   PRO1112           HD1      PRO1112  19.582   4.775   0.451
   66    HA   PRO1113           HA       PRO1113  15.974   4.291  -5.441
   67   1HB   PRO1113           HB2      PRO1113  16.368   1.443  -6.265
   68   2HB   PRO1113           HB1      PRO1113  16.252   2.895  -7.267
   69   1HG   PRO1113           HG2      PRO1113  18.616   1.774  -6.780
   70   2HG   PRO1113           HG1      PRO1113  18.437   3.538  -6.816
   71   1HD   PRO1113           HD2      PRO1113  18.788   1.718  -4.492
   72   2HD   PRO1113           HD1      PRO1113  19.321   3.396  -4.702
   73    HA   PRO1114           HA       PRO1114  12.746   2.219  -3.041
   74   1HB   PRO1114           HB2      PRO1114  11.012   4.223  -2.981
   75   2HB   PRO1114           HB1      PRO1114  12.524   4.318  -2.068
   76   1HG   PRO1114           HG2      PRO1114  11.813   5.553  -4.702
   77   2HG   PRO1114           HG1      PRO1114  12.690   6.266  -3.337
   78   1HD   PRO1114           HD2      PRO1114  13.872   5.168  -5.595
   79   2HD   PRO1114           HD1      PRO1114  14.683   5.401  -4.033
   80    H    ILE1115           HN       ILE1115  10.294   2.095  -3.353
   81    HA   ILE1115           HA       ILE1115   9.771   1.197  -6.067
   82    HB   ILE1115           HB       ILE1115   7.414   0.833  -4.727
   83   1HG1  ILE1115          2HG1      ILE1115   9.639   0.467  -2.708
   84   2HG1  ILE1115          1HG1      ILE1115   8.382   1.696  -2.633
   85   1HG2  ILE1115          3HG2      ILE1115   9.799  -0.992  -4.892
   86   2HG2  ILE1115          2HG2      ILE1115   8.186  -1.514  -4.405
   87   3HG2  ILE1115          1HG2      ILE1115   8.453  -0.871  -6.025
   88   1HD1  ILE1115          2HD1      ILE1115   7.922  -1.273  -2.499
   89   2HD1  ILE1115          1HD1      ILE1115   7.939  -0.167  -1.124
   90   3HD1  ILE1115          3HD1      ILE1115   6.691  -0.017  -2.364
   91    H    ASP1116           HN       ASP1116   7.422   1.660  -6.856
   92    HA   ASP1116           HA       ASP1116   7.194   4.417  -7.354
   93   1HB   ASP1116           HB2      ASP1116   6.240   2.715  -8.856
   94   2HB   ASP1116           HB1      ASP1116   5.081   2.259  -7.611
   95    H    ASN1117           HN       ASN1117   7.004   5.729  -5.616
   96    HA   ASN1117           HA       ASN1117   5.961   6.876  -3.941
   97   1HB   ASN1117           HB2      ASN1117   3.666   4.951  -4.396
   98   2HB   ASN1117           HB1      ASN1117   3.598   6.423  -3.430
   99   1HD2  ASN1117          1HD2      ASN1117   2.119   5.575  -5.842
  100   2HD2  ASN1117          2HD2      ASN1117   2.353   6.845  -6.990
  101    H    GLY1118           HN       GLY1118   7.734   4.698  -3.457
  102   1HA   GLY1118           HA1      GLY1118   7.900   2.808  -1.933
  103   2HA   GLY1118           HA2      GLY1118   6.622   3.541  -0.981
  104    H    ASP1119           HN       ASP1119   9.015   2.664   0.114
  105    HA   ASP1119           HA       ASP1119  11.117   4.358   0.481
  106   1HB   ASP1119           HB2      ASP1119  10.513   5.717   2.461
  107   2HB   ASP1119           HB1      ASP1119   9.562   6.164   1.049
  108    H    ILE1120           HN       ILE1120  12.172   4.061   2.744
  109    HA   ILE1120           HA       ILE1120  12.064   1.296   3.349
  110    HB   ILE1120           HB       ILE1120  13.235   2.839   5.500
  111   1HG1  ILE1120          2HG1      ILE1120  13.516   4.558   3.742
  112   2HG1  ILE1120          1HG1      ILE1120  15.057   3.875   4.247
  113   1HG2  ILE1120          3HG2      ILE1120  14.357   0.943   3.453
  114   2HG2  ILE1120          2HG2      ILE1120  15.198   1.492   4.903
  115   3HG2  ILE1120          1HG2      ILE1120  13.734   0.519   5.048
  116   1HD1  ILE1120          3HD1      ILE1120  15.101   2.480   2.258
  117   2HD1  ILE1120          2HD1      ILE1120  13.555   3.158   1.747
  118   3HD1  ILE1120          1HD1      ILE1120  14.981   4.191   1.851
  119    H    THR1121           HN       THR1121  11.187   0.206   5.064
  120    HA   THR1121           HA       THR1121   8.745   1.048   6.079
  121    HB   THR1121           HB       THR1121   8.931  -0.817   7.694
  122    HG1  THR1121           HG1      THR1121  11.177  -0.659   8.134
  123   1HG2  THR1121          1HG2      THR1121   9.873  -1.455   4.893
  124   2HG2  THR1121          3HG2      THR1121   9.187  -2.619   6.027
  125   3HG2  THR1121          2HG2      THR1121   8.199  -1.290   5.421
  126    H    SER1122           HN       SER1122  11.896   1.886   7.075
  127    HA   SER1122           HA       SER1122  10.917   2.878   9.661
  128   1HB   SER1122           HB2      SER1122  13.757   2.511   8.674
  129   2HB   SER1122           HB1      SER1122  13.301   3.103  10.272
  130    HG   SER1122           HG       SER1122  12.759   0.542   9.177
  131    H    PHE1123           HN       PHE1123  13.416   3.975   7.374
  132    HA   PHE1123           HA       PHE1123  12.093   6.393   6.704
  133   1HB   PHE1123           HB2      PHE1123  12.767   6.800   9.099
  134   2HB   PHE1123           HB1      PHE1123  14.443   6.675   8.579
  135    HD1  PHE1123           HD1      PHE1123  15.532   8.467   7.475
  136    HD2  PHE1123           HD2      PHE1123  11.361   8.667   8.292
  137    HE1  PHE1123           HE1      PHE1123  15.538  10.861   6.904
  138    HE2  PHE1123           HE2      PHE1123  11.358  11.060   7.722
  139    HZ   PHE1123           HZ       PHE1123  13.450  12.160   7.027
  140    HA   PRO1124           HA       PRO1124  15.150   5.943   3.503
  141   1HB   PRO1124           HB2      PRO1124  14.802   8.304   2.229
  142   2HB   PRO1124           HB1      PRO1124  13.627   6.988   2.123
  143   1HG   PRO1124           HG2      PRO1124  13.578   9.442   3.840
  144   2HG   PRO1124           HG1      PRO1124  12.261   8.700   2.914
  145   1HD   PRO1124           HD2      PRO1124  12.563   8.346   5.590
  146   2HD   PRO1124           HD1      PRO1124  11.852   7.112   4.531
  147    H    LEU1125           HN       LEU1125  17.291   6.124   3.798
  148    HA   LEU1125           HA       LEU1125  18.320   8.593   5.021
  149   1HB   LEU1125           HB2      LEU1125  19.951   6.088   4.922
  150   2HB   LEU1125           HB1      LEU1125  19.983   7.398   6.088
  151    HG   LEU1125           HG       LEU1125  18.031   5.119   5.916
  152   1HD1  LEU1125          3HD1      LEU1125  20.102   4.688   7.104
  153   2HD1  LEU1125          2HD1      LEU1125  19.839   6.115   8.108
  154   3HD1  LEU1125          1HD1      LEU1125  18.740   4.740   8.223
  155   1HD2  LEU1125          3HD2      LEU1125  17.680   7.788   7.167
  156   2HD2  LEU1125          2HD2      LEU1125  16.487   6.708   6.432
  157   3HD2  LEU1125          1HD2      LEU1125  17.112   6.369   8.050
  158    H    SER1126           HN       SER1126  20.359   9.402   4.262
  159    HA   SER1126           HA       SER1126  20.556   9.211   1.388
  160   1HB   SER1126           HB2      SER1126  22.229  11.022   1.612
  161   2HB   SER1126           HB1      SER1126  20.727  11.408   2.452
  162    HG   SER1126           HG       SER1126  23.111  11.451   3.468
  163    H    VAL1127           HN       VAL1127  22.730   8.664   4.150
  164    HA   VAL1127           HA       VAL1127  24.464   7.090   2.371
  165    HB   VAL1127           HB       VAL1127  25.134   8.283   5.065
  166   1HG1  VAL1127          1HG1      VAL1127  26.364   6.225   4.617
  167   2HG1  VAL1127          3HG1      VAL1127  26.876   6.860   3.054
  168   3HG1  VAL1127          2HG1      VAL1127  27.435   7.624   4.540
  169   1HG2  VAL1127          3HG2      VAL1127  25.938   9.132   2.284
  170   2HG2  VAL1127          2HG2      VAL1127  24.873  10.010   3.382
  171   3HG2  VAL1127          1HG2      VAL1127  26.578   9.808   3.782
  172    H    TYR1128           HN       TYR1128  24.347   4.971   2.541
  173    HA   TYR1128           HA       TYR1128  23.351   3.797   5.050
  174   1HB   TYR1128           HB2      TYR1128  22.968   3.070   2.182
  175   2HB   TYR1128           HB1      TYR1128  22.993   1.773   3.373
  176    HD1  TYR1128           HD1      TYR1128  21.210   1.526   4.986
  177    HD2  TYR1128           HD2      TYR1128  21.165   4.712   2.166
  178    HE1  TYR1128           HE1      TYR1128  18.839   1.934   5.494
  179    HE2  TYR1128           HE2      TYR1128  18.795   5.130   2.668
  180    HH   TYR1128           HH       TYR1128  16.861   3.908   3.576
  181    H    ALA1129           HN       ALA1129  24.145   1.563   5.465
  182    HA   ALA1129           HA       ALA1129  27.042   1.536   5.264
  183   1HB   ALA1129           HB3      ALA1129  25.962   1.027   7.404
  184   2HB   ALA1129           HB1      ALA1129  26.938  -0.327   6.833
  185   3HB   ALA1129           HB2      ALA1129  25.181  -0.376   6.675
  186    HA   PRO1130           HA       PRO1130  27.226  -1.104   1.706
  187   1HB   PRO1130           HB2      PRO1130  29.651  -2.305   2.285
  188   2HB   PRO1130           HB1      PRO1130  29.454  -0.753   1.468
  189   1HG   PRO1130           HG2      PRO1130  30.071  -1.331   4.332
  190   2HG   PRO1130           HG1      PRO1130  30.693  -0.040   3.288
  191   1HD   PRO1130           HD2      PRO1130  28.798   0.420   5.140
  192   2HD   PRO1130           HD1      PRO1130  28.817   1.278   3.585
  193    H    ALA1131           HN       ALA1131  26.886  -3.222   1.132
  194    HA   ALA1131           HA       ALA1131  26.178  -5.370   1.348
  195   1HB   ALA1131           HB3      ALA1131  28.492  -5.713   2.069
  196   2HB   ALA1131           HB1      ALA1131  27.382  -6.806   2.896
  197   3HB   ALA1131           HB2      ALA1131  28.016  -5.392   3.737
  198    H    SER1132           HN       SER1132  24.805  -3.145   2.864
  199    HA   SER1132           HA       SER1132  23.589  -4.710   5.033
  200   1HB   SER1132           HB2      SER1132  23.384  -1.759   4.398
  201   2HB   SER1132           HB1      SER1132  22.584  -2.558   5.751
  202    HG   SER1132           HG       SER1132  25.386  -2.621   5.347
  203    H    SER1133           HN       SER1133  21.229  -4.548   5.311
  204    HA   SER1133           HA       SER1133  19.745  -4.165   2.812
  205   1HB   SER1133           HB2      SER1133  19.251  -6.592   4.534
  206   2HB   SER1133           HB1      SER1133  18.704  -6.284   2.887
  207    HG   SER1133           HG       SER1133  21.287  -6.965   3.791
  208    H    VAL1134           HN       VAL1134  17.491  -3.762   3.108
  209    HA   VAL1134           HA       VAL1134  16.591  -3.395   5.869
  210    HB   VAL1134           HB       VAL1134  15.653  -1.154   5.305
  211   1HG1  VAL1134          2HG1      VAL1134  18.647  -1.461   5.198
  212   2HG1  VAL1134          1HG1      VAL1134  17.800   0.051   5.527
  213   3HG1  VAL1134          3HG1      VAL1134  17.645  -1.308   6.640
  214   1HG2  VAL1134          1HG2      VAL1134  15.689  -1.369   2.874
  215   2HG2  VAL1134          3HG2      VAL1134  16.562   0.069   3.405
  216   3HG2  VAL1134          2HG2      VAL1134  17.453  -1.366   2.896
  217    H    GLU1135           HN       GLU1135  14.258  -2.708   5.922
  218    HA   GLU1135           HA       GLU1135  12.755  -4.353   4.038
  219   1HB   GLU1135           HB2      GLU1135  11.873  -3.043   6.618
  220   2HB   GLU1135           HB1      GLU1135  10.957  -4.205   5.677
  221   1HG   GLU1135           HG2      GLU1135  12.616  -5.919   6.131
  222   2HG   GLU1135           HG1      GLU1135  13.575  -4.755   7.044
  223    H    TYR1136           HN       TYR1136  11.055  -3.533   2.806
  224    HA   TYR1136           HA       TYR1136  10.926  -0.595   2.729
  225   1HB   TYR1136           HB2      TYR1136  11.498  -2.461   0.652
  226   2HB   TYR1136           HB1      TYR1136   9.974  -1.658   0.279
  227    HD1  TYR1136           HD1      TYR1136   9.954   0.534  -0.558
  228    HD2  TYR1136           HD2      TYR1136  13.511  -1.009   1.187
  229    HE1  TYR1136           HE1      TYR1136  11.185   2.520  -1.323
  230    HE2  TYR1136           HE2      TYR1136  14.751   0.970   0.427
  231    HH   TYR1136           HH       TYR1136  14.572   2.703  -1.305
  232    H    GLN1137           HN       GLN1137   8.944   0.341   1.976
  233    HA   GLN1137           HA       GLN1137   6.521  -1.185   1.998
  234   1HB   GLN1137           HB2      GLN1137   7.009  -0.972   4.429
  235   2HB   GLN1137           HB1      GLN1137   7.004   0.777   4.253
  236   1HG   GLN1137           HG2      GLN1137   4.661   0.702   3.565
  237   2HG   GLN1137           HG1      GLN1137   4.667  -1.051   3.748
  238   1HE2  GLN1137          1HE2      GLN1137   3.055  -1.008   5.302
  239   2HE2  GLN1137          2HE2      GLN1137   3.338  -0.452   6.912
  240    H    CYS1138           HN       CYS1138   4.637   0.189   1.565
  241    HA   CYS1138           HA       CYS1138   5.436   2.486  -0.047
  242   1HB   CYS1138           HB2      CYS1138   2.765   1.078   0.107
  243   2HB   CYS1138           HB1      CYS1138   3.229   2.306  -1.068
  244    H    GLN1139           HN       GLN1139   4.279   4.474   0.040
  245    HA   GLN1139           HA       GLN1139   4.088   5.665   2.489
  246   1HB   GLN1139           HB2      GLN1139   2.546   6.372  -0.009
  247   2HB   GLN1139           HB1      GLN1139   2.738   7.429   1.383
  248   1HG   GLN1139           HG2      GLN1139   5.158   7.439   1.039
  249   2HG   GLN1139           HG1      GLN1139   4.960   6.387  -0.362
  250   1HE2  GLN1139          1HE2      GLN1139   6.096   9.070  -0.175
  251   2HE2  GLN1139          2HE2      GLN1139   5.186  10.050  -1.268
  252    H    ASN1140           HN       ASN1140   2.181   6.652   3.539
  253    HA   ASN1140           HA       ASN1140   0.562   4.940   4.819
  254   1HB   ASN1140           HB2      ASN1140   0.736   7.368   5.290
  255   2HB   ASN1140           HB1      ASN1140  -0.307   7.689   3.908
  256   1HD2  ASN1140          1HD2      ASN1140  -1.939   8.608   5.000
  257   2HD2  ASN1140          2HD2      ASN1140  -2.947   7.757   6.111
  258    H    LEU1141           HN       LEU1141  -1.285   3.831   4.528
  259    HA   LEU1141           HA       LEU1141  -3.161   2.971   3.573
  260   1HB   LEU1141           HB2      LEU1141  -2.855   5.454   1.968
  261   2HB   LEU1141           HB1      LEU1141  -3.882   4.192   1.319
  262    HG   LEU1141           HG       LEU1141  -5.196   5.832   2.547
  263   1HD1  LEU1141          2HD1      LEU1141  -5.958   3.520   2.547
  264   2HD1  LEU1141          1HD1      LEU1141  -5.011   3.198   4.000
  265   3HD1  LEU1141          3HD1      LEU1141  -6.369   4.321   4.064
  266   1HD2  LEU1141          1HD2      LEU1141  -3.516   5.063   4.927
  267   2HD2  LEU1141          3HD2      LEU1141  -3.484   6.614   4.089
  268   3HD2  LEU1141          2HD2      LEU1141  -4.934   6.112   4.959
  269    H    TYR1142           HN       TYR1142  -0.699   3.932   1.185
  270    HA   TYR1142           HA       TYR1142  -1.292   1.961  -0.715
  271   1HB   TYR1142           HB2      TYR1142   1.360   3.284  -0.106
  272   2HB   TYR1142           HB1      TYR1142   1.006   2.353  -1.558
  273    HD1  TYR1142           HD1      TYR1142   0.289   5.474   0.255
  274    HD2  TYR1142           HD2      TYR1142  -0.277   3.294  -3.353
  275    HE1  TYR1142           HE1      TYR1142  -0.552   7.511  -0.833
  276    HE2  TYR1142           HE2      TYR1142  -1.120   5.325  -4.455
  277    HH   TYR1142           HH       TYR1142  -2.151   7.469  -3.824
  278    H    GLN1143           HN       GLN1143  -0.726  -0.128  -0.963
  279    HA   GLN1143           HA       GLN1143   0.630  -1.408   1.302
  280   1HB   GLN1143           HB2      GLN1143  -1.672  -2.168   0.658
  281   2HB   GLN1143           HB1      GLN1143  -1.011  -2.705  -0.881
  282   1HG   GLN1143           HG2      GLN1143  -1.203  -4.592   0.557
  283   2HG   GLN1143           HG1      GLN1143   0.509  -4.220   0.361
  284   1HE2  GLN1143          1HE2      GLN1143   1.666  -3.385   2.098
  285   2HE2  GLN1143          2HE2      GLN1143   1.074  -3.463   3.718
  286    H    LEU1144           HN       LEU1144   2.111  -3.212   0.814
  287    HA   LEU1144           HA       LEU1144   3.624  -2.661  -1.650
  288   1HB   LEU1144           HB2      LEU1144   4.788  -2.201   0.494
  289   2HB   LEU1144           HB1      LEU1144   4.621  -3.892   0.918
  290    HG   LEU1144           HG       LEU1144   6.000  -3.212  -1.640
  291   1HD1  LEU1144          1HD1      LEU1144   7.262  -2.981   1.086
  292   2HD1  LEU1144          3HD1      LEU1144   8.126  -2.963  -0.451
  293   3HD1  LEU1144          2HD1      LEU1144   6.997  -1.665  -0.057
  294   1HD2  LEU1144          2HD2      LEU1144   5.573  -5.543  -1.048
  295   2HD2  LEU1144          1HD2      LEU1144   7.302  -5.195  -1.058
  296   3HD2  LEU1144          3HD2      LEU1144   6.436  -5.320   0.474
  297    H    GLU1145           HN       GLU1145   4.492  -4.381  -2.833
  298    HA   GLU1145           HA       GLU1145   3.530  -7.071  -2.192
  299   1HB   GLU1145           HB2      GLU1145   1.943  -5.895  -3.785
  300   2HB   GLU1145           HB1      GLU1145   3.256  -5.882  -4.955
  301   1HG   GLU1145           HG2      GLU1145   2.181  -8.392  -3.700
  302   2HG   GLU1145           HG1      GLU1145   1.584  -7.726  -5.218
  303    H    GLY1146           HN       GLY1146   5.202  -8.408  -2.226
  304   1HA   GLY1146           HA1      GLY1146   7.388  -7.877  -4.143
  305   2HA   GLY1146           HA2      GLY1146   6.895  -9.488  -3.641
  306    H    ASN1147           HN       ASN1147   9.494  -8.997  -3.429
  307    HA   ASN1147           HA       ASN1147   9.958  -9.205  -0.612
  308   1HB   ASN1147           HB2      ASN1147  12.318  -9.547  -1.240
  309   2HB   ASN1147           HB1      ASN1147  11.238 -10.575  -2.174
  310   1HD2  ASN1147          1HD2      ASN1147  13.535  -8.031  -2.257
  311   2HD2  ASN1147          2HD2      ASN1147  13.609  -7.852  -3.974
  312    H    LYS1148           HN       LYS1148   9.470  -7.253   0.341
  313    HA   LYS1148           HA       LYS1148  10.448  -4.760  -0.606
  314   1HB   LYS1148           HB2      LYS1148   9.792  -4.001   1.755
  315   2HB   LYS1148           HB1      LYS1148   8.525  -4.611   0.698
  316   1HG   LYS1148           HG2      LYS1148   8.142  -5.529   2.842
  317   2HG   LYS1148           HG1      LYS1148   8.778  -6.832   1.837
  318   1HD   LYS1148           HD2      LYS1148  11.013  -6.452   2.805
  319   2HD   LYS1148           HD1      LYS1148  10.330  -5.206   3.852
  320   1HE   LYS1148           HE2      LYS1148   8.864  -6.861   4.882
  321   2HE   LYS1148           HE1      LYS1148   9.508  -8.108   3.815
  322   1HZ   LYS1148           HZ2      LYS1148  11.696  -7.751   4.814
  323   2HZ   LYS1148           HZ1      LYS1148  11.036  -6.607   5.869
  324   3HZ   LYS1148           HZ3      LYS1148  10.554  -8.225   5.967
  325    H    ARG1149           HN       ARG1149  11.989  -7.304   0.953
  326    HA   ARG1149           HA       ARG1149  13.882  -5.719   2.444
  327   1HB   ARG1149           HB2      ARG1149  13.336  -7.931   3.263
  328   2HB   ARG1149           HB1      ARG1149  13.827  -8.660   1.741
  329   1HG   ARG1149           HG2      ARG1149  15.576  -9.058   3.268
  330   2HG   ARG1149           HG1      ARG1149  16.141  -7.774   2.197
  331   1HD   ARG1149           HD2      ARG1149  16.728  -7.221   4.463
  332   2HD   ARG1149           HD1      ARG1149  15.477  -6.112   3.902
  333    HE   ARG1149           HE       ARG1149  14.029  -7.997   5.136
  334   1HH1  ARG1149          1HH1      ARG1149  16.877  -6.248   6.122
  335   2HH1  ARG1149          2HH1      ARG1149  16.486  -6.306   7.808
  336   1HH2  ARG1149          1HH2      ARG1149  13.506  -8.077   7.354
  337   2HH2  ARG1149          2HH2      ARG1149  14.571  -7.345   8.509
  338    H    ILE1150           HN       ILE1150  14.981  -4.379   1.077
  339    HA   ILE1150           HA       ILE1150  16.242  -5.499  -1.305
  340    HB   ILE1150           HB       ILE1150  16.845  -3.197  -1.859
  341   1HG1  ILE1150          2HG1      ILE1150  15.352  -2.387   0.643
  342   2HG1  ILE1150          1HG1      ILE1150  17.108  -2.469   0.543
  343   1HG2  ILE1150          1HG2      ILE1150  14.682  -4.058  -2.569
  344   2HG2  ILE1150          3HG2      ILE1150  13.954  -3.512  -1.058
  345   3HG2  ILE1150          2HG2      ILE1150  14.579  -2.334  -2.213
  346   1HD1  ILE1150          1HD1      ILE1150  15.355  -0.710  -1.153
  347   2HD1  ILE1150          3HD1      ILE1150  16.259  -0.194   0.272
  348   3HD1  ILE1150          2HD1      ILE1150  17.118  -0.759  -1.163
  349    H    THR1151           HN       THR1151  18.516  -4.485  -1.728
  350    HA   THR1151           HA       THR1151  20.200  -4.246   0.603
  351    HB   THR1151           HB       THR1151  20.605  -6.603  -1.252
  352    HG1  THR1151           HG1      THR1151  20.288  -7.602   1.035
  353   1HG2  THR1151          2HG2      THR1151  22.097  -5.748   1.231
  354   2HG2  THR1151          1HG2      THR1151  22.384  -7.229   0.318
  355   3HG2  THR1151          3HG2      THR1151  22.701  -5.660  -0.424
  356    H    CYS1152           HN       CYS1152  22.035  -3.115   0.144
  357    HA   CYS1152           HA       CYS1152  22.313  -2.145  -2.578
  358   1HB   CYS1152           HB2      CYS1152  24.129  -0.700  -1.506
  359   2HB   CYS1152           HB1      CYS1152  22.467  -0.404  -1.016
  360    H    ARG1153           HN       ARG1153  24.006  -2.459  -3.900
  361    HA   ARG1153           HA       ARG1153  26.022  -4.415  -3.009
  362   1HB   ARG1153           HB2      ARG1153  25.072  -3.934  -5.833
  363   2HB   ARG1153           HB1      ARG1153  26.170  -5.194  -5.287
  364   1HG   ARG1153           HG2      ARG1153  24.147  -6.298  -5.556
  365   2HG   ARG1153           HG1      ARG1153  24.222  -5.986  -3.821
  366   1HD   ARG1153           HD2      ARG1153  22.794  -4.013  -4.118
  367   2HD   ARG1153           HD1      ARG1153  22.713  -4.339  -5.850
  368    HE   ARG1153           HE       ARG1153  21.526  -6.014  -3.742
  369   1HH1  ARG1153          1HH1      ARG1153  21.760  -5.011  -7.071
  370   2HH1  ARG1153          2HH1      ARG1153  20.367  -5.910  -7.573
  371   1HH2  ARG1153          1HH2      ARG1153  19.692  -7.201  -4.395
  372   2HH2  ARG1153          2HH2      ARG1153  19.191  -7.154  -6.051
  373    H    ASN1154           HN       ASN1154  27.853  -3.395  -2.572
  374    HA   ASN1154           HA       ASN1154  29.616  -1.953  -2.684
  375   1HB   ASN1154           HB2      ASN1154  29.148  -2.334  -5.650
  376   2HB   ASN1154           HB1      ASN1154  30.622  -1.700  -4.925
  377   1HD2  ASN1154          1HD2      ASN1154  28.661  -4.515  -5.444
  378   2HD2  ASN1154          2HD2      ASN1154  29.844  -5.678  -4.963
  379    H    GLY1155           HN       GLY1155  27.114  -0.684  -2.358
  380   1HA   GLY1155           HA1      GLY1155  27.820   1.969  -3.290
  381   2HA   GLY1155           HA2      GLY1155  26.537   1.564  -2.161
  382    H    GLN1156           HN       GLN1156  25.368  -0.442  -3.952
  383    HA   GLN1156           HA       GLN1156  23.824   1.387  -5.598
  384   1HB   GLN1156           HB2      GLN1156  25.375  -0.939  -6.735
  385   2HB   GLN1156           HB1      GLN1156  24.031  -0.182  -7.573
  386   1HG   GLN1156           HG2      GLN1156  25.231   1.944  -7.584
  387   2HG   GLN1156           HG1      GLN1156  26.580   1.182  -6.742
  388   1HE2  GLN1156          1HE2      GLN1156  28.018   1.636  -8.396
  389   2HE2  GLN1156          2HE2      GLN1156  27.985   0.800  -9.907
  390    H    TRP1157           HN       TRP1157  22.058   0.928  -4.309
  391    HA   TRP1157           HA       TRP1157  21.232  -1.649  -3.522
  392   1HB   TRP1157           HB2      TRP1157  19.611   0.866  -3.906
  393   2HB   TRP1157           HB1      TRP1157  19.017  -0.590  -3.125
  394    HD1  TRP1157           HD1      TRP1157  21.509   2.265  -2.591
  395    HE1  TRP1157           HE1      TRP1157  21.931   2.488  -0.069
  396    HE3  TRP1157           HE3      TRP1157  18.983  -1.868  -1.000
  397    HZ2  TRP1157           HZ2      TRP1157  21.299   1.057   2.303
  398    HZ3  TRP1157           HZ3      TRP1157  18.941  -2.383   1.403
  399    HH2  TRP1157           HH2      TRP1157  20.074  -0.952   3.018
  400    H    SER1158           HN       SER1158  18.814  -2.168  -4.065
  401    HA   SER1158           HA       SER1158  18.397  -2.179  -6.972
  402   1HB   SER1158           HB2      SER1158  17.501  -4.495  -6.745
  403   2HB   SER1158           HB1      SER1158  19.230  -4.384  -6.417
  404    HG   SER1158           HG       SER1158  17.790  -4.004  -4.164
  405    H    GLU1159           HN       GLU1159  16.569  -1.160  -7.379
  406    HA   GLU1159           HA       GLU1159  14.724  -0.199  -5.615
  407   1HB   GLU1159           HB2      GLU1159  14.810   0.503  -7.945
  408   2HB   GLU1159           HB1      GLU1159  14.239  -1.075  -8.466
  409   1HG   GLU1159           HG2      GLU1159  12.113  -0.687  -7.336
  410   2HG   GLU1159           HG1      GLU1159  12.685   0.893  -6.804
  411    HA   PRO1160           HA       PRO1160  12.583  -3.764  -4.051
  412   1HB   PRO1160           HB2      PRO1160  10.336  -2.446  -3.162
  413   2HB   PRO1160           HB1      PRO1160  11.853  -2.545  -2.264
  414   1HG   PRO1160           HG2      PRO1160  10.797  -0.332  -3.968
  415   2HG   PRO1160           HG1      PRO1160  11.660  -0.247  -2.424
  416   1HD   PRO1160           HD2      PRO1160  12.878   0.250  -4.769
  417   2HD   PRO1160           HD1      PRO1160  13.718  -0.529  -3.412
  418    HA   PRO1161           HA       PRO1161   9.658  -5.281  -6.957
  419   1HB   PRO1161           HB2      PRO1161   7.620  -5.454  -4.789
  420   2HB   PRO1161           HB1      PRO1161   8.156  -6.689  -5.934
  421   1HG   PRO1161           HG2      PRO1161   8.987  -6.753  -3.415
  422   2HG   PRO1161           HG1      PRO1161  10.104  -7.132  -4.740
  423   1HD   PRO1161           HD2      PRO1161   9.879  -4.647  -3.096
  424   2HD   PRO1161           HD1      PRO1161  11.328  -5.456  -3.729
  425    H    LYS1162           HN       LYS1162   6.833  -4.284  -5.228
  426    HA   LYS1162           HA       LYS1162   6.619  -1.729  -6.528
  427   1HB   LYS1162           HB2      LYS1162   4.611  -2.412  -7.817
  428   2HB   LYS1162           HB1      LYS1162   6.110  -3.112  -8.397
  429   1HG   LYS1162           HG2      LYS1162   5.564  -5.203  -7.249
  430   2HG   LYS1162           HG1      LYS1162   4.049  -4.491  -6.689
  431   1HD   LYS1162           HD2      LYS1162   3.611  -5.861  -8.623
  432   2HD   LYS1162           HD1      LYS1162   3.380  -4.164  -9.052
  433   1HE   LYS1162           HE2      LYS1162   5.606  -4.116 -10.062
  434   2HE   LYS1162           HE1      LYS1162   5.841  -5.809  -9.632
  435   1HZ   LYS1162           HZ3      LYS1162   3.974  -6.390 -11.055
  436   2HZ   LYS1162           HZ2      LYS1162   3.757  -4.765 -11.473
  437   3HZ   LYS1162           HZ1      LYS1162   5.169  -5.575 -11.935
  438    H    CYS1163           HN       CYS1163   4.278  -0.889  -6.318
  439    HA   CYS1163           HA       CYS1163   3.339  -1.512  -3.606
  440   1HB   CYS1163           HB2      CYS1163   3.118   0.955  -5.327
  441   2HB   CYS1163           HB1      CYS1163   2.143   0.736  -3.877
  442    H    LEU1164           HN       LEU1164   0.915  -1.017  -3.339
  443    HA   LEU1164           HA       LEU1164  -0.654  -1.938  -5.636
  444   1HB   LEU1164           HB2      LEU1164  -0.088  -3.443  -3.232
  445   2HB   LEU1164           HB1      LEU1164  -1.809  -3.148  -3.384
  446    HG   LEU1164           HG       LEU1164  -1.218  -5.291  -4.359
  447   1HD1  LEU1164          1HD1      LEU1164  -1.941  -3.243  -6.448
  448   2HD1  LEU1164          3HD1      LEU1164  -2.186  -4.984  -6.586
  449   3HD1  LEU1164          2HD1      LEU1164  -3.060  -4.066  -5.360
  450   1HD2  LEU1164          1HD2      LEU1164   1.108  -4.782  -4.930
  451   2HD2  LEU1164          3HD2      LEU1164   0.231  -5.460  -6.302
  452   3HD2  LEU1164          2HD2      LEU1164   0.554  -3.728  -6.231
  453    H    HIS1165           HN       HIS1165  -2.276  -0.556  -5.952
  454    HA   HIS1165           HA       HIS1165  -2.959   1.599  -4.424
  455   1HB   HIS1165           HB2      HIS1165  -4.841  -0.061  -6.119
  456   2HB   HIS1165           HB1      HIS1165  -5.158   1.580  -5.566
  457    HD1  HIS1165           HD1      HIS1165  -3.496  -0.328  -8.224
  458    HD2  HIS1165           HD2      HIS1165  -3.439   3.563  -6.766
  459    HE1  HIS1165           HE1      HIS1165  -2.384   1.045 -10.015
  460    HE2  HIS1165           HE2      HIS1165  -2.274   3.378  -9.068
  461    HA   PRO1166           HA       PRO1166  -4.849  -0.262  -0.865
  462   1HB   PRO1166           HB2      PRO1166  -5.556   1.955   0.445
  463   2HB   PRO1166           HB1      PRO1166  -3.856   1.530   0.216
  464   1HG   PRO1166           HG2      PRO1166  -5.535   3.506  -1.278
  465   2HG   PRO1166           HG1      PRO1166  -3.862   3.661  -0.714
  466   1HD   PRO1166           HD2      PRO1166  -4.586   3.003  -3.293
  467   2HD   PRO1166           HD1      PRO1166  -3.030   2.595  -2.553
  468    H    CYS1167           HN       CYS1167  -6.897   0.038   0.463
  469    HA   CYS1167           HA       CYS1167  -9.131  -0.448  -1.169
  470   1HB   CYS1167           HB2      CYS1167  -9.491   0.427   1.664
  471   2HB   CYS1167           HB1      CYS1167 -10.254  -0.902   0.797
  472    H    VAL1168           HN       VAL1168  -9.129   1.431  -2.551
  473    HA   VAL1168           HA       VAL1168 -10.287   3.821  -1.271
  474    HB   VAL1168           HB       VAL1168  -8.682   3.601  -3.819
  475   1HG1  VAL1168          3HG1      VAL1168 -10.001   6.026  -2.602
  476   2HG1  VAL1168          2HG1      VAL1168  -8.899   6.038  -3.979
  477   3HG1  VAL1168          1HG1      VAL1168 -10.462   5.233  -4.108
  478   1HG2  VAL1168          3HG2      VAL1168  -7.339   3.512  -1.794
  479   2HG2  VAL1168          2HG2      VAL1168  -7.087   5.039  -2.640
  480   3HG2  VAL1168          1HG2      VAL1168  -8.107   4.985  -1.202
  481    H    ILE1169           HN       ILE1169 -12.459   3.507  -1.426
  482    HA   ILE1169           HA       ILE1169 -13.586   2.653  -3.986
  483    HB   ILE1169           HB       ILE1169 -14.878   3.078  -1.290
  484   1HG1  ILE1169          2HG1      ILE1169 -14.032   0.688  -2.896
  485   2HG1  ILE1169          1HG1      ILE1169 -13.731   1.046  -1.198
  486   1HG2  ILE1169          2HG2      ILE1169 -16.438   3.714  -3.059
  487   2HG2  ILE1169          1HG2      ILE1169 -16.166   2.167  -3.863
  488   3HG2  ILE1169          3HG2      ILE1169 -16.940   2.214  -2.279
  489   1HD1  ILE1169          3HD1      ILE1169 -16.135   0.666  -0.747
  490   2HD1  ILE1169          2HD1      ILE1169 -16.331   0.172  -2.428
  491   3HD1  ILE1169          1HD1      ILE1169 -15.288  -0.757  -1.354
  492    H    SER1170           HN       SER1170 -15.401   3.841  -4.904
  493    HA   SER1170           HA       SER1170 -14.790   6.621  -5.125
  494   1HB   SER1170           HB2      SER1170 -15.614   5.360  -7.052
  495   2HB   SER1170           HB1      SER1170 -17.133   5.041  -6.212
  496    HG   SER1170           HG       SER1170 -16.172   7.433  -7.315
  497    H    ARG1171           HN       ARG1171 -15.464   8.208  -3.868
  498    HA   ARG1171           HA       ARG1171 -17.451   7.792  -1.826
  499   1HB   ARG1171           HB2      ARG1171 -16.967  10.127  -1.217
  500   2HB   ARG1171           HB1      ARG1171 -15.493   9.185  -1.392
  501   1HG   ARG1171           HG2      ARG1171 -15.109  10.155  -3.587
  502   2HG   ARG1171           HG1      ARG1171 -16.616  11.064  -3.460
  503   1HD   ARG1171           HD2      ARG1171 -15.731  12.242  -1.500
  504   2HD   ARG1171           HD1      ARG1171 -14.221  11.344  -1.648
  505    HE   ARG1171           HE       ARG1171 -14.615  12.572  -4.084
  506   1HH1  ARG1171          1HH1      ARG1171 -14.232  13.576  -0.770
  507   2HH1  ARG1171          2HH1      ARG1171 -13.498  15.091  -1.180
  508   1HH2  ARG1171          1HH2      ARG1171 -13.650  14.563  -4.632
  509   2HH2  ARG1171          2HH2      ARG1171 -13.168  15.653  -3.374
  510    H    GLU1172           HN       GLU1172 -18.185   7.715  -4.746
  511    HA   GLU1172           HA       GLU1172 -20.448   9.572  -4.549
  512   1HB   GLU1172           HB2      GLU1172 -18.811   9.039  -7.039
  513   2HB   GLU1172           HB1      GLU1172 -20.295   9.981  -6.986
  514   1HG   GLU1172           HG2      GLU1172 -19.220  11.597  -5.507
  515   2HG   GLU1172           HG1      GLU1172 -17.732  10.652  -5.557
  516    H    ILE1173           HN       ILE1173 -19.654   6.511  -4.418
  517    HA   ILE1173           HA       ILE1173 -22.075   5.640  -5.838
  518    HB   ILE1173           HB       ILE1173 -20.040   4.949  -7.087
  519   1HG1  ILE1173          2HG1      ILE1173 -20.810   2.309  -6.438
  520   2HG1  ILE1173          1HG1      ILE1173 -22.230   3.324  -6.200
  521   1HG2  ILE1173          3HG2      ILE1173 -19.463   3.331  -4.613
  522   2HG2  ILE1173          2HG2      ILE1173 -18.630   3.170  -6.160
  523   3HG2  ILE1173          1HG2      ILE1173 -18.502   4.670  -5.241
  524   1HD1  ILE1173          1HD1      ILE1173 -20.571   3.186  -8.701
  525   2HD1  ILE1173          3HD1      ILE1173 -22.139   2.419  -8.453
  526   3HD1  ILE1173          2HD1      ILE1173 -22.010   4.179  -8.462
  527    H    MET1174           HN       MET1174 -19.841   5.201  -3.174
  528    HA   MET1174           HA       MET1174 -21.494   3.202  -1.899
  529   1HB   MET1174           HB2      MET1174 -18.874   3.444  -1.913
  530   2HB   MET1174           HB1      MET1174 -19.167   4.578  -0.603
  531   1HG   MET1174           HG2      MET1174 -20.246   1.786  -0.564
  532   2HG   MET1174           HG1      MET1174 -18.629   2.184   0.012
  533   1HE   MET1174           HE3      MET1174 -18.179   3.932   2.005
  534   2HE   MET1174           HE2      MET1174 -19.196   5.129   1.204
  535   3HE   MET1174           HE1      MET1174 -19.470   4.732   2.901
  536    H    GLU1175           HN       GLU1175 -20.236   6.438  -1.106
  537    HA   GLU1175           HA       GLU1175 -22.179   6.785   0.993
  538   1HB   GLU1175           HB2      GLU1175 -21.025   8.730   1.553
  539   2HB   GLU1175           HB1      GLU1175 -19.752   7.732   0.858
  540   1HG   GLU1175           HG2      GLU1175 -19.835   8.931  -1.201
  541   2HG   GLU1175           HG1      GLU1175 -21.268   9.820  -0.685
  542    H    ASN1176           HN       ASN1176 -22.658   6.663  -2.142
  543    HA   ASN1176           HA       ASN1176 -24.232   9.110  -2.419
  544   1HB   ASN1176           HB2      ASN1176 -22.655   8.423  -4.223
  545   2HB   ASN1176           HB1      ASN1176 -23.664   7.007  -4.481
  546   1HD2  ASN1176          1HD2      ASN1176 -23.004   9.250  -6.259
  547   2HD2  ASN1176          2HD2      ASN1176 -24.519   9.907  -6.759
  548    H    TYR1177           HN       TYR1177 -24.739   5.707  -3.386
  549    HA   TYR1177           HA       TYR1177 -27.464   5.794  -3.712
  550   1HB   TYR1177           HB2      TYR1177 -25.833   3.493  -2.614
  551   2HB   TYR1177           HB1      TYR1177 -27.475   3.362  -3.232
  552    HD1  TYR1177           HD1      TYR1177 -27.267   5.091  -5.657
  553    HD2  TYR1177           HD2      TYR1177 -24.614   2.164  -4.081
  554    HE1  TYR1177           HE1      TYR1177 -26.389   4.679  -7.916
  555    HE2  TYR1177           HE2      TYR1177 -23.723   1.747  -6.330
  556    HH   TYR1177           HH       TYR1177 -24.352   3.791  -8.966
  557    H    ASN1178           HN       ASN1178 -25.997   4.292  -0.863
  558    HA   ASN1178           HA       ASN1178 -27.166   5.766   1.127
  559   1HB   ASN1178           HB2      ASN1178 -29.100   4.266   1.767
  560   2HB   ASN1178           HB1      ASN1178 -29.356   5.238   0.320
  561   1HD2  ASN1178          1HD2      ASN1178 -30.846   3.917  -0.616
  562   2HD2  ASN1178          2HD2      ASN1178 -30.482   2.335  -1.207
  563    H    ILE1179           HN       ILE1179 -24.846   4.079   0.489
  564    HA   ILE1179           HA       ILE1179 -25.043   2.221   2.773
  565    HB   ILE1179           HB       ILE1179 -23.197   0.924   1.691
  566   1HG1  ILE1179          2HG1      ILE1179 -23.912   2.564  -0.747
  567   2HG1  ILE1179          1HG1      ILE1179 -22.435   2.764   0.191
  568   1HG2  ILE1179          3HG2      ILE1179 -25.781   1.159   0.157
  569   2HG2  ILE1179          2HG2      ILE1179 -24.668  -0.207   0.085
  570   3HG2  ILE1179          1HG2      ILE1179 -25.503   0.172   1.592
  571   1HD1  ILE1179          1HD1      ILE1179 -23.246   0.272  -1.280
  572   2HD1  ILE1179          3HD1      ILE1179 -22.061   1.457  -1.827
  573   3HD1  ILE1179          2HD1      ILE1179 -21.753   0.507  -0.373
  574    H    ALA1180           HN       ALA1180 -23.273   2.050   4.172
  575    HA   ALA1180           HA       ALA1180 -21.160   4.070   3.881
  576   1HB   ALA1180           HB2      ALA1180 -21.389   4.713   6.224
  577   2HB   ALA1180           HB1      ALA1180 -22.883   5.018   5.339
  578   3HB   ALA1180           HB3      ALA1180 -22.759   3.615   6.400
  579    H    LEU1181           HN       LEU1181 -20.249   3.433   6.635
  580    HA   LEU1181           HA       LEU1181 -19.060   0.800   6.064
  581   1HB   LEU1181           HB2      LEU1181 -17.989   3.311   7.215
  582   2HB   LEU1181           HB1      LEU1181 -17.423   1.822   7.944
  583    HG   LEU1181           HG       LEU1181 -15.931   2.708   6.161
  584   1HD1  LEU1181          3HD1      LEU1181 -15.897   0.346   6.752
  585   2HD1  LEU1181          2HD1      LEU1181 -17.186   0.028   5.592
  586   3HD1  LEU1181          1HD1      LEU1181 -15.605   0.569   5.028
  587   1HD2  LEU1181          2HD2      LEU1181 -17.631   3.627   4.681
  588   2HD2  LEU1181          1HD2      LEU1181 -16.611   2.469   3.827
  589   3HD2  LEU1181          3HD2      LEU1181 -18.231   2.003   4.345
  590    H    ARG1182           HN       ARG1182 -18.195  -0.188   8.272
  591    HA   ARG1182           HA       ARG1182 -20.492  -0.886   9.758
  592   1HB   ARG1182           HB2      ARG1182 -18.884  -2.065  11.259
  593   2HB   ARG1182           HB1      ARG1182 -18.705  -2.472   9.559
  594   1HG   ARG1182           HG2      ARG1182 -16.804  -0.923   9.406
  595   2HG   ARG1182           HG1      ARG1182 -16.967  -0.583  11.130
  596   1HD   ARG1182           HD2      ARG1182 -16.556  -2.937  11.636
  597   2HD   ARG1182           HD1      ARG1182 -16.406  -3.285   9.914
  598    HE   ARG1182           HE       ARG1182 -14.585  -1.258  10.675
  599   1HH1  ARG1182          1HH1      ARG1182 -15.121  -4.693  10.912
  600   2HH1  ARG1182          2HH1      ARG1182 -13.437  -5.077  11.039
  601   1HH2  ARG1182          1HH2      ARG1182 -12.366  -1.755  10.841
  602   2HH2  ARG1182          2HH2      ARG1182 -11.871  -3.407  11.000
  603    H    TRP1183           HN       TRP1183 -18.747   1.890   9.830
  604    HA   TRP1183           HA       TRP1183 -19.197   2.369  12.692
  605   1HB   TRP1183           HB2      TRP1183 -17.659   4.168  10.824
  606   2HB   TRP1183           HB1      TRP1183 -17.564   4.079  12.581
  607    HD1  TRP1183           HD1      TRP1183 -16.633   1.951   9.485
  608    HE1  TRP1183           HE1      TRP1183 -14.603   0.494  10.097
  609    HE3  TRP1183           HE3      TRP1183 -16.184   3.202  14.425
  610    HZ2  TRP1183           HZ2      TRP1183 -13.018  -0.042  12.352
  611    HZ3  TRP1183           HZ3      TRP1183 -14.377   2.171  15.739
  612    HH2  TRP1183           HH2      TRP1183 -12.826   0.581  14.723
  613    H    THR1184           HN       THR1184 -20.374   3.029   9.584
  614    HA   THR1184           HA       THR1184 -21.908   4.467   8.717
  615    HB   THR1184           HB       THR1184 -23.897   4.893  10.144
  616    HG1  THR1184           HG1      THR1184 -23.604   3.513  12.237
  617   1HG2  THR1184          3HG2      THR1184 -23.668   2.801   8.888
  618   2HG2  THR1184          2HG2      THR1184 -22.841   2.068  10.262
  619   3HG2  THR1184          1HG2      THR1184 -24.532   2.550  10.405
  620    H    ALA1185           HN       ALA1185 -20.514   6.229   8.385
  621    HA   ALA1185           HA       ALA1185 -21.130   8.514  10.119
  622   1HB   ALA1185           HB3      ALA1185 -18.943   7.661  10.819
  623   2HB   ALA1185           HB1      ALA1185 -18.817   9.264  10.094
  624   3HB   ALA1185           HB2      ALA1185 -18.349   7.838   9.168
  625    H    LYS1186           HN       LYS1186 -19.138   7.843   7.237
  626    HA   LYS1186           HA       LYS1186 -20.665   8.936   5.268
  627   1HB   LYS1186           HB2      LYS1186 -20.564  11.020   6.732
  628   2HB   LYS1186           HB1      LYS1186 -18.855  11.107   6.330
  629   1HG   LYS1186           HG2      LYS1186 -20.078  12.592   4.901
  630   2HG   LYS1186           HG1      LYS1186 -19.462  11.245   3.939
  631   1HD   LYS1186           HD2      LYS1186 -21.650  10.165   4.032
  632   2HD   LYS1186           HD1      LYS1186 -22.270  11.491   5.020
  633   1HE   LYS1186           HE2      LYS1186 -21.230  11.722   2.198
  634   2HE   LYS1186           HE1      LYS1186 -22.926  11.738   2.678
  635   1HZ   LYS1186           HZ1      LYS1186 -20.884  13.741   3.481
  636   2HZ   LYS1186           HZ3      LYS1186 -22.090  13.971   2.316
  637   3HZ   LYS1186           HZ2      LYS1186 -22.512  13.757   3.940
  638    H    GLN1187           HN       GLN1187 -19.671   7.812   3.736
  639    HA   GLN1187           HA       GLN1187 -18.093   7.159   2.232
  640   1HB   GLN1187           HB2      GLN1187 -17.424   9.513   2.095
  641   2HB   GLN1187           HB1      GLN1187 -16.415   9.324   3.522
  642   1HG   GLN1187           HG2      GLN1187 -15.099   7.616   2.236
  643   2HG   GLN1187           HG1      GLN1187 -16.009   8.106   0.807
  644   1HE2  GLN1187          1HE2      GLN1187 -13.613   9.033   3.142
  645   2HE2  GLN1187          2HE2      GLN1187 -13.025  10.418   2.292
  646    H    LYS1188           HN       LYS1188 -15.627   8.072   4.533
  647    HA   LYS1188           HA       LYS1188 -13.973   6.776   5.472
  648   1HB   LYS1188           HB2      LYS1188 -15.965   6.904   7.067
  649   2HB   LYS1188           HB1      LYS1188 -16.323   5.254   6.582
  650   1HG   LYS1188           HG2      LYS1188 -14.121   4.542   7.380
  651   2HG   LYS1188           HG1      LYS1188 -13.770   6.201   7.872
  652   1HD   LYS1188           HD2      LYS1188 -15.733   6.115   9.386
  653   2HD   LYS1188           HD1      LYS1188 -15.947   4.417   8.956
  654   1HE   LYS1188           HE2      LYS1188 -13.544   5.642  10.303
  655   2HE   LYS1188           HE1      LYS1188 -14.752   4.600  11.055
  656   1HZ   LYS1188           HZ1      LYS1188 -14.069   2.814   9.567
  657   2HZ   LYS1188           HZ3      LYS1188 -12.895   3.815   8.873
  658   3HZ   LYS1188           HZ2      LYS1188 -12.767   3.360  10.497
  659    H    LEU1189           HN       LEU1189 -14.830   5.791   2.833
  660    HA   LEU1189           HA       LEU1189 -14.651   2.896   3.107
  661   1HB   LEU1189           HB2      LEU1189 -14.814   3.152   0.493
  662   2HB   LEU1189           HB1      LEU1189 -16.232   3.277   1.515
  663    HG   LEU1189           HG       LEU1189 -16.026   5.751   1.442
  664   1HD1  LEU1189          2HD1      LEU1189 -13.578   5.746   0.995
  665   2HD1  LEU1189          1HD1      LEU1189 -13.934   5.262  -0.663
  666   3HD1  LEU1189          3HD1      LEU1189 -14.508   6.817  -0.056
  667   1HD2  LEU1189          1HD2      LEU1189 -17.501   4.570  -0.110
  668   2HD2  LEU1189          3HD2      LEU1189 -16.807   6.016  -0.843
  669   3HD2  LEU1189          2HD2      LEU1189 -16.171   4.425  -1.259
  670    H    TYR1190           HN       TYR1190 -12.366   4.346   3.885
  671    HA   TYR1190           HA       TYR1190 -10.467   3.587   1.767
  672   1HB   TYR1190           HB2      TYR1190 -10.500   5.915   3.641
  673   2HB   TYR1190           HB1      TYR1190  -8.951   5.275   3.101
  674    HD1  TYR1190           HD1      TYR1190 -11.745   5.030   0.789
  675    HD2  TYR1190           HD2      TYR1190  -8.511   7.488   2.075
  676    HE1  TYR1190           HE1      TYR1190 -11.916   6.345  -1.284
  677    HE2  TYR1190           HE2      TYR1190  -8.680   8.806   0.007
  678    HH   TYR1190           HH       TYR1190 -11.327   8.590  -2.099
  679    H    SER1191           HN       SER1191  -8.733   2.356   2.277
  680    HA   SER1191           HA       SER1191  -7.908   1.824   4.966
  681   1HB   SER1191           HB2      SER1191  -9.479  -0.264   3.450
  682   2HB   SER1191           HB1      SER1191  -8.380  -0.679   4.763
  683    HG   SER1191           HG       SER1191 -10.374  -0.429   5.673
  684    H    ARG1192           HN       ARG1192  -6.356  -0.224   4.871
  685    HA   ARG1192           HA       ARG1192  -4.546   0.285   2.652
  686   1HB   ARG1192           HB2      ARG1192  -4.248  -1.120   5.305
  687   2HB   ARG1192           HB1      ARG1192  -3.005  -1.157   4.071
  688   1HG   ARG1192           HG2      ARG1192  -2.897   1.310   4.152
  689   2HG   ARG1192           HG1      ARG1192  -4.067   1.281   5.472
  690   1HD   ARG1192           HD2      ARG1192  -1.327   0.023   5.479
  691   2HD   ARG1192           HD1      ARG1192  -1.809   1.483   6.343
  692    HE   ARG1192           HE       ARG1192  -3.525  -0.450   7.233
  693   1HH1  ARG1192          1HH1      ARG1192  -0.062  -0.082   7.115
  694   2HH1  ARG1192          2HH1      ARG1192   0.216  -1.028   8.539
  695   1HH2  ARG1192          1HH2      ARG1192  -3.167  -1.697   9.108
  696   2HH2  ARG1192          2HH2      ARG1192  -1.548  -1.946   9.672
  697    H    THR1193           HN       THR1193  -4.728  -0.989   0.916
  698    HA   THR1193           HA       THR1193  -6.315  -3.137   0.546
  699    HB   THR1193           HB       THR1193  -3.730  -2.363  -0.731
  700    HG1  THR1193           HG1      THR1193  -6.179  -1.799  -1.159
  701   1HG2  THR1193          3HG2      THR1193  -3.566  -4.810  -0.635
  702   2HG2  THR1193          2HG2      THR1193  -5.172  -4.948  -1.351
  703   3HG2  THR1193          1HG2      THR1193  -3.846  -4.255  -2.286
  704    H    GLY1194           HN       GLY1194  -6.545  -4.946   1.595
  705   1HA   GLY1194           HA1      GLY1194  -4.172  -6.186   2.824
  706   2HA   GLY1194           HA2      GLY1194  -5.355  -7.148   1.946
  707    H    GLU1195           HN       GLU1195  -6.826  -4.593   3.538
  708    HA   GLU1195           HA       GLU1195  -7.333  -6.204   5.950
  709   1HB   GLU1195           HB2      GLU1195  -7.760  -3.251   5.455
  710   2HB   GLU1195           HB1      GLU1195  -8.139  -4.088   6.954
  711   1HG   GLU1195           HG2      GLU1195  -5.402  -3.802   5.736
  712   2HG   GLU1195           HG1      GLU1195  -6.030  -2.889   7.109
  713    H    SER1196           HN       SER1196  -9.464  -6.506   6.693
  714    HA   SER1196           HA       SER1196 -11.399  -6.739   4.576
  715   1HB   SER1196           HB2      SER1196 -12.827  -7.777   6.305
  716   2HB   SER1196           HB1      SER1196 -11.222  -8.506   6.253
  717    HG   SER1196           HG       SER1196 -10.716  -6.963   8.006
  718    H    VAL1197           HN       VAL1197 -12.725  -5.182   3.979
  719    HA   VAL1197           HA       VAL1197 -13.368  -3.045   5.894
  720    HB   VAL1197           HB       VAL1197 -13.862  -2.903   2.928
  721   1HG1  VAL1197          2HG1      VAL1197 -13.413  -0.807   5.055
  722   2HG1  VAL1197          1HG1      VAL1197 -13.693  -0.487   3.344
  723   3HG1  VAL1197          3HG1      VAL1197 -14.959  -1.232   4.319
  724   1HG2  VAL1197          3HG2      VAL1197 -11.328  -2.144   4.383
  725   2HG2  VAL1197          2HG2      VAL1197 -11.506  -3.447   3.209
  726   3HG2  VAL1197          1HG2      VAL1197 -11.694  -1.769   2.699
  727    H    GLU1198           HN       GLU1198 -15.309  -3.122   6.800
  728    HA   GLU1198           HA       GLU1198 -17.439  -4.640   5.471
  729   1HB   GLU1198           HB2      GLU1198 -17.253  -5.532   7.587
  730   2HB   GLU1198           HB1      GLU1198 -16.807  -3.994   8.314
  731   1HG   GLU1198           HG2      GLU1198 -19.043  -3.233   8.321
  732   2HG   GLU1198           HG1      GLU1198 -19.568  -4.558   7.275
  733    H    PHE1199           HN       PHE1199 -18.947  -3.556   4.418
  734    HA   PHE1199           HA       PHE1199 -19.486  -0.769   5.164
  735   1HB   PHE1199           HB2      PHE1199 -20.157  -2.294   2.637
  736   2HB   PHE1199           HB1      PHE1199 -20.599  -0.619   2.942
  737    HD1  PHE1199           HD1      PHE1199 -19.202   1.064   2.210
  738    HD2  PHE1199           HD2      PHE1199 -17.618  -2.837   2.814
  739    HE1  PHE1199           HE1      PHE1199 -17.047   1.803   1.256
  740    HE2  PHE1199           HE2      PHE1199 -15.469  -2.115   1.876
  741    HZ   PHE1199           HZ       PHE1199 -15.178   0.203   1.100
  742    H    VAL1200           HN       VAL1200 -21.819  -0.099   4.812
  743    HA   VAL1200           HA       VAL1200 -23.771  -2.178   5.448
  744    HB   VAL1200           HB       VAL1200 -24.712  -0.914   7.308
  745   1HG1  VAL1200          3HG1      VAL1200 -21.764  -1.444   7.666
  746   2HG1  VAL1200          2HG1      VAL1200 -22.946  -1.285   8.967
  747   3HG1  VAL1200          1HG1      VAL1200 -23.065  -2.625   7.827
  748   1HG2  VAL1200          2HG2      VAL1200 -22.373   0.951   6.928
  749   2HG2  VAL1200          1HG2      VAL1200 -24.069   1.325   6.620
  750   3HG2  VAL1200          3HG2      VAL1200 -23.521   1.004   8.265
  751    H    CYS1201           HN       CYS1201 -25.834  -0.320   6.096
  752    HA   CYS1201           HA       CYS1201 -26.077   1.188   3.583
  753   1HB   CYS1201           HB2      CYS1201 -28.574   0.198   4.817
  754   2HB   CYS1201           HB1      CYS1201 -28.120   0.307   3.119
  755    H    LYS1202           HN       LYS1202 -25.060   2.649   5.293
  756    HA   LYS1202           HA       LYS1202 -25.169   4.274   6.878
  757   1HB   LYS1202           HB2      LYS1202 -27.023   5.948   6.421
  758   2HB   LYS1202           HB1      LYS1202 -25.892   5.617   5.121
  759   1HG   LYS1202           HG2      LYS1202 -27.547   4.080   4.123
  760   2HG   LYS1202           HG1      LYS1202 -28.686   4.541   5.388
  761   1HD   LYS1202           HD2      LYS1202 -27.401   6.467   3.461
  762   2HD   LYS1202           HD1      LYS1202 -29.012   5.770   3.256
  763   1HE   LYS1202           HE2      LYS1202 -29.714   6.782   5.370
  764   2HE   LYS1202           HE1      LYS1202 -28.107   7.476   5.574
  765   1HZ   LYS1202           HZ3      LYS1202 -28.443   8.756   3.549
  766   2HZ   LYS1202           HZ2      LYS1202 -29.988   8.094   3.361
  767   3HZ   LYS1202           HZ1      LYS1202 -29.653   9.096   4.682
  768    H    ARG1203           HN       ARG1203 -28.607   4.159   6.689
  769    HA   ARG1203           HA       ARG1203 -28.843   2.871   9.269
  770   1HB   ARG1203           HB2      ARG1203 -29.824   5.665   8.736
  771   2HB   ARG1203           HB1      ARG1203 -30.054   4.760  10.222
  772   1HG   ARG1203           HG2      ARG1203 -27.640   4.765  10.593
  773   2HG   ARG1203           HG1      ARG1203 -27.421   5.648   9.075
  774   1HD   ARG1203           HD2      ARG1203 -28.716   7.515   9.972
  775   2HD   ARG1203           HD1      ARG1203 -28.964   6.633  11.478
  776    HE   ARG1203           HE       ARG1203 -26.199   6.893  10.898
  777   1HH1  ARG1203          1HH1      ARG1203 -28.955   8.675  12.069
  778   2HH1  ARG1203          2HH1      ARG1203 -28.005   9.779  13.006
  779   1HH2  ARG1203          1HH2      ARG1203 -24.941   8.342  12.129
  780   2HH2  ARG1203          2HH2      ARG1203 -25.724   9.589  13.040
  781    H    GLY1204           HN       GLY1204 -30.219   1.268   8.484
  782   1HA   GLY1204           HA1      GLY1204 -32.841   2.263   7.571
  783   2HA   GLY1204           HA2      GLY1204 -32.604   0.795   8.497
  784    H    TYR1205           HN       TYR1205 -31.452   2.160   5.393
  785    HA   TYR1205           HA       TYR1205 -32.736   0.584   3.631
  786   1HB   TYR1205           HB2      TYR1205 -29.834   1.383   3.472
  787   2HB   TYR1205           HB1      TYR1205 -30.763   0.761   2.120
  788    HD1  TYR1205           HD1      TYR1205 -32.479   2.126   1.065
  789    HD2  TYR1205           HD2      TYR1205 -30.185   3.625   4.317
  790    HE1  TYR1205           HE1      TYR1205 -33.238   4.404   0.539
  791    HE2  TYR1205           HE2      TYR1205 -30.940   5.909   3.801
  792    HH   TYR1205           HH       TYR1205 -31.810   7.171   1.879
  793    H    ARG1206           HN       ARG1206 -32.818  -1.453   2.972
  794    HA   ARG1206           HA       ARG1206 -31.174  -3.405   4.398
  795   1HB   ARG1206           HB2      ARG1206 -32.896  -4.955   3.066
  796   2HB   ARG1206           HB1      ARG1206 -33.286  -4.213   4.612
  797   1HG   ARG1206           HG2      ARG1206 -33.882  -2.684   2.136
  798   2HG   ARG1206           HG1      ARG1206 -34.915  -4.057   2.551
  799   1HD   ARG1206           HD2      ARG1206 -34.242  -1.829   4.454
  800   2HD   ARG1206           HD1      ARG1206 -35.684  -1.842   3.438
  801    HE   ARG1206           HE       ARG1206 -35.497  -4.229   4.954
  802   1HH1  ARG1206          1HH1      ARG1206 -36.288  -0.848   5.233
  803   2HH1  ARG1206          2HH1      ARG1206 -37.358  -1.077   6.575
  804   1HH2  ARG1206          1HH2      ARG1206 -36.906  -4.540   6.721
  805   2HH2  ARG1206          2HH2      ARG1206 -37.710  -3.176   7.421
  806    H    LEU1207           HN       LEU1207 -29.840  -4.809   3.438
  807    HA   LEU1207           HA       LEU1207 -28.516  -4.187   1.104
  808   1HB   LEU1207           HB2      LEU1207 -27.788  -5.788   2.909
  809   2HB   LEU1207           HB1      LEU1207 -28.839  -6.986   2.178
  810    HG   LEU1207           HG       LEU1207 -27.494  -6.659   0.039
  811   1HD1  LEU1207          3HD1      LEU1207 -26.459  -4.531   0.646
  812   2HD1  LEU1207          2HD1      LEU1207 -25.604  -5.321   1.972
  813   3HD1  LEU1207          1HD1      LEU1207 -25.241  -5.761   0.304
  814   1HD2  LEU1207          1HD2      LEU1207 -26.109  -7.770   2.476
  815   2HD2  LEU1207          3HD2      LEU1207 -27.266  -8.626   1.457
  816   3HD2  LEU1207          2HD2      LEU1207 -25.703  -8.140   0.800
  817    H    SER1208           HN       SER1208 -28.818  -4.542  -1.021
  818    HA   SER1208           HA       SER1208 -31.371  -5.522  -1.903
  819   1HB   SER1208           HB2      SER1208 -30.331  -3.608  -3.020
  820   2HB   SER1208           HB1      SER1208 -28.957  -4.611  -3.489
  821    HG   SER1208           HG       SER1208 -30.247  -4.668  -5.230
  822    H    SER1209           HN       SER1209 -28.541  -7.024  -1.080
  823    HA   SER1209           HA       SER1209 -27.887  -9.202  -1.195
  824   1HB   SER1209           HB2      SER1209 -30.245  -9.860  -1.270
  825   2HB   SER1209           HB1      SER1209 -30.278  -9.581  -3.010
  826    HG   SER1209           HG       SER1209 -29.197 -11.681  -1.565
  827    H    ARG1210           HN       ARG1210 -28.960  -7.935  -4.340
  828    HA   ARG1210           HA       ARG1210 -26.933  -9.340  -5.789
  829   1HB   ARG1210           HB2      ARG1210 -27.718  -8.060  -7.719
  830   2HB   ARG1210           HB1      ARG1210 -29.072  -8.749  -6.832
  831   1HG   ARG1210           HG2      ARG1210 -29.468  -6.580  -5.766
  832   2HG   ARG1210           HG1      ARG1210 -28.127  -5.893  -6.686
  833   1HD   ARG1210           HD2      ARG1210 -30.252  -5.363  -7.741
  834   2HD   ARG1210           HD1      ARG1210 -29.290  -6.423  -8.771
  835    HE   ARG1210           HE       ARG1210 -30.925  -8.076  -7.286
  836   1HH1  ARG1210          1HH1      ARG1210 -31.334  -5.493  -9.589
  837   2HH1  ARG1210          2HH1      ARG1210 -32.836  -6.100 -10.198
  838   1HH2  ARG1210          1HH2      ARG1210 -32.902  -8.883  -8.082
  839   2HH2  ARG1210          2HH2      ARG1210 -33.729  -8.027  -9.341
  840    H    SER1211           HN       SER1211 -26.646  -6.940  -3.665
  841    HA   SER1211           HA       SER1211 -25.069  -5.000  -4.988
  842   1HB   SER1211           HB2      SER1211 -24.481  -4.229  -2.759
  843   2HB   SER1211           HB1      SER1211 -26.194  -4.652  -2.791
  844    HG   SER1211           HG       SER1211 -24.149  -6.402  -1.901
  845    H    HIS1212           HN       HIS1212 -22.762  -4.676  -3.641
  846    HA   HIS1212           HA       HIS1212 -21.198  -7.001  -4.507
  847   1HB   HIS1212           HB2      HIS1212 -20.310  -4.160  -3.970
  848   2HB   HIS1212           HB1      HIS1212 -19.280  -5.459  -4.561
  849    HD1  HIS1212           HD1      HIS1212 -21.652  -2.885  -5.672
  850    HD2  HIS1212           HD2      HIS1212 -19.906  -6.313  -7.242
  851    HE1  HIS1212           HE1      HIS1212 -22.024  -2.751  -8.155
  852    HE2  HIS1212           HE2      HIS1212 -20.881  -4.792  -9.093
  853    H    THR1213           HN       THR1213 -22.331  -7.620  -2.243
  854    HA   THR1213           HA       THR1213 -22.049  -8.256  -0.088
  855    HB   THR1213           HB       THR1213 -19.772  -8.877   0.620
  856    HG1  THR1213           HG1      THR1213 -18.203  -7.757  -0.241
  857   1HG2  THR1213          2HG2      THR1213 -20.452  -9.652  -2.218
  858   2HG2  THR1213          1HG2      THR1213 -19.347 -10.522  -1.153
  859   3HG2  THR1213          3HG2      THR1213 -21.061 -10.423  -0.753
  860    H    LEU1214           HN       LEU1214 -20.890  -7.761   2.048
  861    HA   LEU1214           HA       LEU1214 -20.819  -4.840   2.369
  862   1HB   LEU1214           HB2      LEU1214 -21.347  -7.066   4.338
  863   2HB   LEU1214           HB1      LEU1214 -21.132  -5.395   4.816
  864    HG   LEU1214           HG       LEU1214 -23.478  -5.882   4.764
  865   1HD1  LEU1214          1HD1      LEU1214 -22.696  -4.259   2.349
  866   2HD1  LEU1214          3HD1      LEU1214 -24.267  -4.223   3.151
  867   3HD1  LEU1214          2HD1      LEU1214 -22.827  -3.665   4.004
  868   1HD2  LEU1214          3HD2      LEU1214 -23.423  -7.812   3.280
  869   2HD2  LEU1214          2HD2      LEU1214 -24.619  -6.634   2.743
  870   3HD2  LEU1214          1HD2      LEU1214 -23.070  -6.758   1.910
  871    H    ARG1215           HN       ARG1215 -19.376  -7.639   4.010
  872    HA   ARG1215           HA       ARG1215 -16.913  -6.104   4.397
  873   1HB   ARG1215           HB2      ARG1215 -18.020  -7.305   6.320
  874   2HB   ARG1215           HB1      ARG1215 -17.607  -8.819   5.527
  875   1HG   ARG1215           HG2      ARG1215 -15.225  -8.196   5.645
  876   2HG   ARG1215           HG1      ARG1215 -15.679  -6.733   6.521
  877   1HD   ARG1215           HD2      ARG1215 -16.683  -8.113   8.282
  878   2HD   ARG1215           HD1      ARG1215 -16.191  -9.566   7.414
  879    HE   ARG1215           HE       ARG1215 -13.909  -8.035   7.812
  880   1HH1  ARG1215          1HH1      ARG1215 -16.278  -9.712   9.740
  881   2HH1  ARG1215          2HH1      ARG1215 -15.176 -10.048  11.034
  882   1HH2  ARG1215          1HH2      ARG1215 -12.452  -8.472   9.510
  883   2HH2  ARG1215          2HH2      ARG1215 -13.002  -9.342  10.903
  884    H    THR1216           HN       THR1216 -15.444  -6.283   2.848
  885    HA   THR1216           HA       THR1216 -14.909  -8.939   1.711
  886    HB   THR1216           HB       THR1216 -16.220  -7.878   0.026
  887    HG1  THR1216           HG1      THR1216 -14.839  -8.365  -1.501
  888   1HG2  THR1216          1HG2      THR1216 -14.406  -5.500   0.380
  889   2HG2  THR1216          3HG2      THR1216 -15.580  -5.673  -0.925
  890   3HG2  THR1216          2HG2      THR1216 -16.128  -5.588   0.749
  891    H    THR1217           HN       THR1217 -12.872  -8.721   0.232
  892    HA   THR1217           HA       THR1217 -10.798  -7.434   1.865
  893    HB   THR1217           HB       THR1217 -10.678  -9.724  -0.095
  894    HG1  THR1217           HG1      THR1217 -10.112 -10.876   1.708
  895   1HG2  THR1217          1HG2      THR1217  -8.747  -8.133  -0.391
  896   2HG2  THR1217          3HG2      THR1217  -8.309  -8.462   1.287
  897   3HG2  THR1217          2HG2      THR1217  -8.293  -9.766   0.101
  898    H    CYS1218           HN       CYS1218 -10.115  -5.533   1.149
  899    HA   CYS1218           HA       CYS1218 -10.496  -4.722  -1.574
  900   1HB   CYS1218           HB2      CYS1218  -9.094  -2.704  -0.717
  901   2HB   CYS1218           HB1      CYS1218 -10.726  -2.939  -0.107
  902    H    TRP1219           HN       TRP1219  -9.010  -4.563  -3.189
  903    HA   TRP1219           HA       TRP1219  -6.202  -4.953  -2.657
  904   1HB   TRP1219           HB2      TRP1219  -7.632  -7.248  -2.928
  905   2HB   TRP1219           HB1      TRP1219  -7.193  -6.940  -4.605
  906    HD1  TRP1219           HD1      TRP1219  -4.578  -7.037  -5.228
  907    HE1  TRP1219           HE1      TRP1219  -2.596  -8.177  -4.047
  908    HE3  TRP1219           HE3      TRP1219  -6.695  -7.844  -0.643
  909    HZ2  TRP1219           HZ2      TRP1219  -2.001  -9.267  -1.533
  910    HZ3  TRP1219           HZ3      TRP1219  -5.347  -8.945   1.097
  911    HH2  TRP1219           HH2      TRP1219  -3.047  -9.643   0.661
  912    H    ASP1220           HN       ASP1220  -4.958  -4.050  -4.195
  913    HA   ASP1220           HA       ASP1220  -4.365  -2.843  -6.029
  914   1HB   ASP1220           HB2      ASP1220  -4.971  -5.019  -7.136
  915   2HB   ASP1220           HB1      ASP1220  -6.569  -4.348  -7.451
  916    H    GLY1221           HN       GLY1221  -6.547  -1.931  -4.230
  917   1HA   GLY1221           HA1      GLY1221  -7.416   0.294  -5.883
  918   2HA   GLY1221           HA2      GLY1221  -7.581   0.162  -4.141
  919    H    LYS1222           HN       LYS1222  -8.697  -1.948  -6.782
  920    HA   LYS1222           HA       LYS1222 -11.372  -1.202  -6.782
  921   1HB   LYS1222           HB2      LYS1222  -9.934  -2.948  -8.226
  922   2HB   LYS1222           HB1      LYS1222 -10.763  -4.079  -7.167
  923   1HG   LYS1222           HG2      LYS1222 -12.186  -2.001  -8.806
  924   2HG   LYS1222           HG1      LYS1222 -11.884  -3.650  -9.357
  925   1HD   LYS1222           HD2      LYS1222 -13.137  -4.516  -7.437
  926   2HD   LYS1222           HD1      LYS1222 -13.451  -2.863  -6.903
  927   1HE   LYS1222           HE2      LYS1222 -15.371  -3.775  -8.095
  928   2HE   LYS1222           HE1      LYS1222 -14.665  -2.419  -8.973
  929   1HZ   LYS1222           HZ2      LYS1222 -14.215  -5.290  -9.581
  930   2HZ   LYS1222           HZ1      LYS1222 -15.213  -4.242 -10.456
  931   3HZ   LYS1222           HZ3      LYS1222 -13.540  -3.989 -10.424
  932    H    LEU1223           HN       LEU1223 -13.159  -1.799  -5.639
  933    HA   LEU1223           HA       LEU1223 -12.939  -3.821  -3.556
  934   1HB   LEU1223           HB2      LEU1223 -12.279  -1.387  -2.789
  935   2HB   LEU1223           HB1      LEU1223 -14.017  -1.189  -2.707
  936    HG   LEU1223           HG       LEU1223 -12.623  -3.454  -1.313
  937   1HD1  LEU1223          3HD1      LEU1223 -13.153  -0.688  -0.272
  938   2HD1  LEU1223          2HD1      LEU1223 -12.695  -2.076   0.718
  939   3HD1  LEU1223          1HD1      LEU1223 -11.583  -1.459  -0.505
  940   1HD2  LEU1223          2HD2      LEU1223 -15.285  -2.091  -0.958
  941   2HD2  LEU1223          1HD2      LEU1223 -14.994  -3.735  -1.522
  942   3HD2  LEU1223          3HD2      LEU1223 -14.631  -3.298   0.147
  943    H    GLU1224           HN       GLU1224 -14.955  -4.572  -2.792
  944    HA   GLU1224           HA       GLU1224 -17.149  -4.116  -4.646
  945   1HB   GLU1224           HB2      GLU1224 -16.925  -6.073  -2.351
  946   2HB   GLU1224           HB1      GLU1224 -18.189  -6.057  -3.572
  947   1HG   GLU1224           HG2      GLU1224 -15.262  -6.590  -4.044
  948   2HG   GLU1224           HG1      GLU1224 -16.557  -7.787  -4.031
  949    H    TYR1225           HN       TYR1225 -18.421  -2.408  -4.208
  950    HA   TYR1225           HA       TYR1225 -19.042  -1.808  -1.405
  951   1HB   TYR1225           HB2      TYR1225 -20.164   0.262  -2.713
  952   2HB   TYR1225           HB1      TYR1225 -18.483   0.246  -2.189
  953    HD1  TYR1225           HD1      TYR1225 -16.698  -0.347  -3.858
  954    HD2  TYR1225           HD2      TYR1225 -20.729   0.394  -4.994
  955    HE1  TYR1225           HE1      TYR1225 -15.968   0.031  -6.175
  956    HE2  TYR1225           HE2      TYR1225 -20.010   0.774  -7.315
  957    HH   TYR1225           HH       TYR1225 -16.917  -0.049  -8.442
  958    HA   PRO1226           HA       PRO1226 -23.022  -3.685  -1.667
  959   1HB   PRO1226           HB2      PRO1226 -23.795  -1.592   0.285
  960   2HB   PRO1226           HB1      PRO1226 -23.909  -3.349   0.412
  961   1HG   PRO1226           HG2      PRO1226 -22.048  -1.986   1.759
  962   2HG   PRO1226           HG1      PRO1226 -21.697  -3.577   1.058
  963   1HD   PRO1226           HD2      PRO1226 -20.929  -0.859   0.089
  964   2HD   PRO1226           HD1      PRO1226 -20.000  -2.371   0.065
  965    H    THR1227           HN       THR1227 -25.427  -2.696  -1.412
  966    HA   THR1227           HA       THR1227 -25.935  -0.203  -2.686
  967    HB   THR1227           HB       THR1227 -26.620  -2.615  -4.378
  968    HG1  THR1227           HG1      THR1227 -24.642  -2.537  -5.106
  969   1HG2  THR1227          3HG2      THR1227 -26.625   0.350  -4.953
  970   2HG2  THR1227          2HG2      THR1227 -27.027  -0.919  -6.109
  971   3HG2  THR1227          1HG2      THR1227 -28.047  -0.660  -4.693
  972    H    CYS1228           HN       CYS1228 -26.875  -1.035  -0.356
  973    HA   CYS1228           HA       CYS1228 -29.181  -2.608  -0.299
  974   1HB   CYS1228           HB2      CYS1228 -28.572  -0.246   1.488
  975   2HB   CYS1228           HB1      CYS1228 -29.636  -1.602   1.853
  976    H    ALA1229           HN       ALA1229 -31.326  -1.352   0.652
  977    HA   ALA1229           HA       ALA1229 -31.983   0.971  -0.900
  978   1HB   ALA1229           HB2      ALA1229 -33.306  -1.646  -1.579
  979   2HB   ALA1229           HB3      ALA1229 -32.171  -0.763  -2.599
  980   3HB   ALA1229           HB1      ALA1229 -33.748  -0.065  -2.225
  981    H    LYS1230           HN       LYS1230 -34.062   1.801  -0.505
  982    HA   LYS1230           HA       LYS1230 -35.524   2.620   1.018
  983   1HB   LYS1230           HB2      LYS1230 -37.365   1.044   1.520
  984   2HB   LYS1230           HB1      LYS1230 -36.898   1.054  -0.174
  985   1HG   LYS1230           HG2      LYS1230 -35.496  -0.984   0.332
  986   2HG   LYS1230           HG1      LYS1230 -36.315  -1.041   1.894
  987   1HD   LYS1230           HD2      LYS1230 -38.473  -1.209   0.768
  988   2HD   LYS1230           HD1      LYS1230 -37.670  -1.126  -0.801
  989   1HE   LYS1230           HE2      LYS1230 -38.185  -3.424  -0.297
  990   2HE   LYS1230           HE1      LYS1230 -36.437  -3.192  -0.237
  991   1HZ   LYS1230           HZ2      LYS1230 -36.585  -3.048   2.177
  992   2HZ   LYS1230           HZ1      LYS1230 -38.255  -3.304   2.108
  993   3HZ   LYS1230           HZ3      LYS1230 -37.190  -4.525   1.617
  994    H    ARG1231           HN       ARG1231 -34.559   3.338   2.774
  995    HA   ARG1231           HA       ARG1231 -33.461   1.852   4.840
  996   1HB   ARG1231           HB2      ARG1231 -33.053   3.869   5.835
  997   2HB   ARG1231           HB1      ARG1231 -33.402   4.425   4.211
  998   1HG   ARG1231           HG2      ARG1231 -35.703   4.921   4.865
  999   2HG   ARG1231           HG1      ARG1231 -35.342   4.391   6.509
 1000   1HD   ARG1231           HD2      ARG1231 -34.027   6.680   5.052
 1001   2HD   ARG1231           HD1      ARG1231 -35.242   6.823   6.321
 1002    HE   ARG1231           HE       ARG1231 -33.142   5.327   7.356
 1003   1HH1  ARG1231          1HH1      ARG1231 -33.693   8.553   6.161
 1004   2HH1  ARG1231          2HH1      ARG1231 -32.482   9.272   7.170
 1005   1HH2  ARG1231          1HH2      ARG1231 -31.546   6.265   8.687
 1006   2HH2  ARG1231          2HH2      ARG1231 -31.261   7.970   8.605

  No H/Q in entry =        1006
  Start of MODEL   12
    1    H1   GLU1103           HT2      GLU1103  34.090  -2.223  -7.266
    2    H2   GLU1103           HT1      GLU1103  34.642  -0.649  -6.984
    3    H3   GLU1103           HT3      GLU1103  34.430  -1.201  -8.569
    4    HA   GLU1103           HA       GLU1103  36.176  -2.828  -8.273
    5   1HB   GLU1103           HB2      GLU1103  36.995  -0.011  -7.536
    6   2HB   GLU1103           HB1      GLU1103  38.070  -1.251  -8.166
    7   1HG   GLU1103           HG2      GLU1103  36.790  -1.309 -10.244
    8   2HG   GLU1103           HG1      GLU1103  35.710  -0.067  -9.610
    9    H    ALA1104           HN       ALA1104  38.148  -3.350  -6.993
   10    HA   ALA1104           HA       ALA1104  39.100  -4.174  -5.098
   11   1HB   ALA1104           HB2      ALA1104  39.389  -1.794  -4.597
   12   2HB   ALA1104           HB3      ALA1104  39.126  -2.739  -3.131
   13   3HB   ALA1104           HB1      ALA1104  37.813  -1.771  -3.804
   14    H    GLU1105           HN       GLU1105  38.413  -4.469  -2.528
   15    HA   GLU1105           HA       GLU1105  36.228  -6.332  -2.679
   16   1HB   GLU1105           HB2      GLU1105  36.790  -6.828  -0.328
   17   2HB   GLU1105           HB1      GLU1105  38.198  -6.904  -1.379
   18   1HG   GLU1105           HG2      GLU1105  38.886  -4.689  -0.627
   19   2HG   GLU1105           HG1      GLU1105  37.470  -4.603   0.419
   20    H    PHE1106           HN       PHE1106  36.687  -3.077  -1.603
   21    HA   PHE1106           HA       PHE1106  34.299  -3.012   0.020
   22   1HB   PHE1106           HB2      PHE1106  36.080  -0.769  -0.955
   23   2HB   PHE1106           HB1      PHE1106  34.783  -0.598   0.223
   24    HD1  PHE1106           HD1      PHE1106  38.187  -1.728  -0.356
   25    HD2  PHE1106           HD2      PHE1106  35.005  -1.546   2.464
   26    HE1  PHE1106           HE1      PHE1106  39.765  -2.267   1.453
   27    HE2  PHE1106           HE2      PHE1106  36.577  -2.085   4.278
   28    HZ   PHE1106           HZ       PHE1106  38.960  -2.446   3.774
   29    H    GLY1107           HN       GLY1107  32.448  -1.690  -0.437
   30   1HA   GLY1107           HA1      GLY1107  31.194  -2.108  -2.810
   31   2HA   GLY1107           HA2      GLY1107  32.063  -0.604  -3.057
   32    H    LYS1108           HN       LYS1108  31.811   0.753  -0.755
   33    HA   LYS1108           HA       LYS1108  29.453   0.739   0.645
   34   1HB   LYS1108           HB2      LYS1108  31.031   3.131  -0.325
   35   2HB   LYS1108           HB1      LYS1108  29.768   3.201   0.897
   36   1HG   LYS1108           HG2      LYS1108  32.124   1.388   1.229
   37   2HG   LYS1108           HG1      LYS1108  32.219   3.097   1.654
   38   1HD   LYS1108           HD2      LYS1108  30.259   2.794   3.138
   39   2HD   LYS1108           HD1      LYS1108  30.281   1.070   2.764
   40   1HE   LYS1108           HE2      LYS1108  31.385   1.558   4.898
   41   2HE   LYS1108           HE1      LYS1108  32.500   0.863   3.721
   42   1HZ   LYS1108           HZ1      LYS1108  32.260   3.750   4.381
   43   2HZ   LYS1108           HZ3      LYS1108  33.499   2.719   4.896
   44   3HZ   LYS1108           HZ2      LYS1108  33.331   3.084   3.254
   45    H    CYS1109           HN       CYS1109  27.421   0.927   0.134
   46    HA   CYS1109           HA       CYS1109  26.664   1.662  -2.554
   47   1HB   CYS1109           HB2      CYS1109  24.760   0.950  -0.339
   48   2HB   CYS1109           HB1      CYS1109  24.578   0.698  -2.074
   49    H    GLY1110           HN       GLY1110  24.507   2.957  -2.667
   50   1HA   GLY1110           HA1      GLY1110  24.495   5.457  -2.691
   51   2HA   GLY1110           HA2      GLY1110  24.803   5.354  -0.963
   52    HA   PRO1111           HA       PRO1111  20.394   6.060  -0.623
   53   1HB   PRO1111           HB2      PRO1111  19.911   6.988  -3.416
   54   2HB   PRO1111           HB1      PRO1111  19.408   7.712  -1.885
   55   1HG   PRO1111           HG2      PRO1111  21.432   8.741  -3.286
   56   2HG   PRO1111           HG1      PRO1111  21.480   8.686  -1.515
   57   1HD   PRO1111           HD2      PRO1111  22.910   6.989  -3.506
   58   2HD   PRO1111           HD1      PRO1111  23.441   7.546  -1.906
   59    HA   PRO1112           HA       PRO1112  19.236   2.113  -2.439
   60   1HB   PRO1112           HB2      PRO1112  17.286   1.504  -0.689
   61   2HB   PRO1112           HB1      PRO1112  18.999   1.397  -0.270
   62   1HG   PRO1112           HG2      PRO1112  17.030   3.572   0.345
   63   2HG   PRO1112           HG1      PRO1112  18.240   2.828   1.407
   64   1HD   PRO1112           HD2      PRO1112  18.625   5.216   0.164
   65   2HD   PRO1112           HD1      PRO1112  19.953   4.105   0.557
   66    HA   PRO1113           HA       PRO1113  16.027   4.035  -5.122
   67   1HB   PRO1113           HB2      PRO1113  16.277   1.226  -6.125
   68   2HB   PRO1113           HB1      PRO1113  16.138   2.734  -7.036
   69   1HG   PRO1113           HG2      PRO1113  18.496   1.525  -6.758
   70   2HG   PRO1113           HG1      PRO1113  18.365   3.293  -6.705
   71   1HD   PRO1113           HD2      PRO1113  18.840   1.364  -4.499
   72   2HD   PRO1113           HD1      PRO1113  19.363   3.049  -4.657
   73    HA   PRO1114           HA       PRO1114  12.942   1.927  -2.539
   74   1HB   PRO1114           HB2      PRO1114  11.308   3.989  -2.200
   75   2HB   PRO1114           HB1      PRO1114  12.890   3.963  -1.408
   76   1HG   PRO1114           HG2      PRO1114  12.069   5.338  -3.945
   77   2HG   PRO1114           HG1      PRO1114  12.976   6.001  -2.572
   78   1HD   PRO1114           HD2      PRO1114  14.158   5.069  -4.855
   79   2HD   PRO1114           HD1      PRO1114  14.950   5.044  -3.265
   80    H    ILE1115           HN       ILE1115  10.357   2.391  -2.680
   81    HA   ILE1115           HA       ILE1115   9.618   1.630  -5.421
   82    HB   ILE1115           HB       ILE1115   7.433   0.953  -4.104
   83   1HG1  ILE1115          2HG1      ILE1115   9.577   0.926  -1.964
   84   2HG1  ILE1115          1HG1      ILE1115   8.109   1.895  -1.960
   85   1HG2  ILE1115          2HG2      ILE1115   9.996  -0.629  -4.015
   86   2HG2  ILE1115          1HG2      ILE1115   8.378  -1.294  -3.787
   87   3HG2  ILE1115          3HG2      ILE1115   8.832  -0.588  -5.339
   88   1HD1  ILE1115          1HD1      ILE1115   8.205  -1.108  -1.829
   89   2HD1  ILE1115          3HD1      ILE1115   7.965  -0.025  -0.457
   90   3HD1  ILE1115          2HD1      ILE1115   6.760  -0.101  -1.745
   91    H    ASP1116           HN       ASP1116   7.353   2.280  -6.063
   92    HA   ASP1116           HA       ASP1116   7.095   5.065  -6.076
   93   1HB   ASP1116           HB2      ASP1116   6.080   3.628  -7.792
   94   2HB   ASP1116           HB1      ASP1116   4.969   2.971  -6.594
   95    H    ASN1117           HN       ASN1117   6.664   6.319  -4.384
   96    HA   ASN1117           HA       ASN1117   5.667   7.174  -2.524
   97   1HB   ASN1117           HB2      ASN1117   3.575   5.049  -3.061
   98   2HB   ASN1117           HB1      ASN1117   3.405   6.373  -1.909
   99   1HD2  ASN1117          1HD2      ASN1117   1.816   5.708  -4.266
  100   2HD2  ASN1117          2HD2      ASN1117   1.854   7.110  -5.275
  101    H    GLY1118           HN       GLY1118   7.665   5.106  -2.362
  102   1HA   GLY1118           HA1      GLY1118   7.856   3.038  -0.951
  103   2HA   GLY1118           HA2      GLY1118   6.922   3.926   0.241
  104    H    ASP1119           HN       ASP1119   9.231   2.858   1.028
  105    HA   ASP1119           HA       ASP1119  11.630   4.142   0.809
  106   1HB   ASP1119           HB2      ASP1119  10.335   6.218   1.445
  107   2HB   ASP1119           HB1      ASP1119  10.040   5.474   3.013
  108    H    ILE1120           HN       ILE1120  12.991   3.906   2.907
  109    HA   ILE1120           HA       ILE1120  12.733   1.268   3.797
  110    HB   ILE1120           HB       ILE1120  14.180   2.923   5.701
  111   1HG1  ILE1120          2HG1      ILE1120  14.827   3.159   2.756
  112   2HG1  ILE1120          1HG1      ILE1120  14.506   4.470   3.885
  113   1HG2  ILE1120          3HG2      ILE1120  14.970   0.740   3.785
  114   2HG2  ILE1120          2HG2      ILE1120  15.981   1.364   5.089
  115   3HG2  ILE1120          1HG2      ILE1120  14.472   0.530   5.463
  116   1HD1  ILE1120          1HD1      ILE1120  16.580   3.928   5.075
  117   2HD1  ILE1120          3HD1      ILE1120  16.906   2.657   3.898
  118   3HD1  ILE1120          2HD1      ILE1120  16.861   4.344   3.384
  119    H    THR1121           HN       THR1121  12.086   0.373   5.749
  120    HA   THR1121           HA       THR1121   9.794   1.580   6.925
  121    HB   THR1121           HB       THR1121   9.709  -0.394   8.367
  122    HG1  THR1121           HG1      THR1121  11.457  -1.532   8.742
  123   1HG2  THR1121          3HG2      THR1121  10.432  -1.027   5.500
  124   2HG2  THR1121          2HG2      THR1121   9.589  -2.117   6.602
  125   3HG2  THR1121          1HG2      THR1121   8.831  -0.603   6.107
  126    H    SER1122           HN       SER1122  12.748   2.629   7.333
  127    HA   SER1122           HA       SER1122  12.311   3.266  10.168
  128   1HB   SER1122           HB2      SER1122  14.974   2.519   8.934
  129   2HB   SER1122           HB1      SER1122  14.742   3.097  10.584
  130    HG   SER1122           HG       SER1122  13.364   0.833   9.619
  131    H    PHE1123           HN       PHE1123  15.001   4.141   8.059
  132    HA   PHE1123           HA       PHE1123  13.958   6.789   7.561
  133   1HB   PHE1123           HB2      PHE1123  14.925   6.940   9.856
  134   2HB   PHE1123           HB1      PHE1123  16.482   6.447   9.197
  135    HD1  PHE1123           HD1      PHE1123  17.894   7.987   8.088
  136    HD2  PHE1123           HD2      PHE1123  13.947   9.120   9.206
  137    HE1  PHE1123           HE1      PHE1123  18.434  10.338   7.600
  138    HE2  PHE1123           HE2      PHE1123  14.479  11.472   8.719
  139    HZ   PHE1123           HZ       PHE1123  16.726  12.084   7.914
  140    HA   PRO1124           HA       PRO1124  16.439   6.002   3.958
  141   1HB   PRO1124           HB2      PRO1124  16.363   8.463   2.834
  142   2HB   PRO1124           HB1      PRO1124  14.974   7.369   2.835
  143   1HG   PRO1124           HG2      PRO1124  15.567   9.686   4.641
  144   2HG   PRO1124           HG1      PRO1124  14.037   9.237   3.865
  145   1HD   PRO1124           HD2      PRO1124  14.583   8.668   6.458
  146   2HD   PRO1124           HD1      PRO1124  13.561   7.630   5.446
  147    H    LEU1125           HN       LEU1125  18.584   5.898   3.688
  148    HA   LEU1125           HA       LEU1125  20.242   8.006   4.903
  149   1HB   LEU1125           HB2      LEU1125  21.104   5.158   4.364
  150   2HB   LEU1125           HB1      LEU1125  21.986   6.391   5.246
  151    HG   LEU1125           HG       LEU1125  19.959   6.352   6.875
  152   1HD1  LEU1125          2HD1      LEU1125  18.514   4.970   5.450
  153   2HD1  LEU1125          1HD1      LEU1125  19.682   3.651   5.567
  154   3HD1  LEU1125          3HD1      LEU1125  18.831   4.203   7.008
  155   1HD2  LEU1125          1HD2      LEU1125  22.215   5.622   7.446
  156   2HD2  LEU1125          3HD2      LEU1125  21.006   4.550   8.151
  157   3HD2  LEU1125          2HD2      LEU1125  21.900   4.049   6.715
  158    H    SER1126           HN       SER1126  21.978   8.824   3.744
  159    HA   SER1126           HA       SER1126  21.718   8.603   0.872
  160   1HB   SER1126           HB2      SER1126  23.668  10.244   2.506
  161   2HB   SER1126           HB1      SER1126  23.356  10.410   0.779
  162    HG   SER1126           HG       SER1126  22.024  11.883   1.575
  163    H    VAL1127           HN       VAL1127  24.241   8.010   3.301
  164    HA   VAL1127           HA       VAL1127  25.752   6.502   1.287
  165    HB   VAL1127           HB       VAL1127  27.058   8.192   2.465
  166   1HG1  VAL1127          2HG1      VAL1127  25.786   8.275   4.546
  167   2HG1  VAL1127          1HG1      VAL1127  26.376   6.670   4.977
  168   3HG1  VAL1127          3HG1      VAL1127  27.502   8.021   4.861
  169   1HG2  VAL1127          3HG2      VAL1127  28.187   6.160   1.740
  170   2HG2  VAL1127          2HG2      VAL1127  28.896   6.765   3.237
  171   3HG2  VAL1127          1HG2      VAL1127  27.802   5.382   3.275
  172    H    TYR1128           HN       TYR1128  25.612   4.381   1.273
  173    HA   TYR1128           HA       TYR1128  24.749   3.005   3.728
  174   1HB   TYR1128           HB2      TYR1128  23.785   2.865   0.989
  175   2HB   TYR1128           HB1      TYR1128  24.231   1.281   1.613
  176    HD1  TYR1128           HD1      TYR1128  23.306   0.762   4.039
  177    HD2  TYR1128           HD2      TYR1128  21.642   3.622   1.366
  178    HE1  TYR1128           HE1      TYR1128  21.155   0.605   5.220
  179    HE2  TYR1128           HE2      TYR1128  19.488   3.478   2.539
  180    HH   TYR1128           HH       TYR1128  19.135   1.958   5.556
  181    H    ALA1129           HN       ALA1129  25.409   0.707   3.829
  182    HA   ALA1129           HA       ALA1129  28.238   0.478   3.110
  183   1HB   ALA1129           HB2      ALA1129  27.632   0.116   5.452
  184   2HB   ALA1129           HB1      ALA1129  26.570  -1.208   4.976
  185   3HB   ALA1129           HB3      ALA1129  28.311  -1.345   4.735
  186    HA   PRO1130           HA       PRO1130  27.571  -2.435  -0.132
  187   1HB   PRO1130           HB2      PRO1130  29.712  -4.110   0.217
  188   2HB   PRO1130           HB1      PRO1130  29.809  -2.524  -0.554
  189   1HG   PRO1130           HG2      PRO1130  30.488  -3.323   2.247
  190   2HG   PRO1130           HG1      PRO1130  31.338  -2.207   1.163
  191   1HD   PRO1130           HD2      PRO1130  29.738  -1.340   3.156
  192   2HD   PRO1130           HD1      PRO1130  29.896  -0.463   1.619
  193    H    ALA1131           HN       ALA1131  26.618  -4.376  -0.517
  194    HA   ALA1131           HA       ALA1131  25.514  -6.320  -0.126
  195   1HB   ALA1131           HB2      ALA1131  27.756  -7.163   0.379
  196   2HB   ALA1131           HB3      ALA1131  26.524  -7.948   1.367
  197   3HB   ALA1131           HB1      ALA1131  27.549  -6.695   2.066
  198    H    SER1132           HN       SER1132  25.106  -3.749   1.634
  199    HA   SER1132           HA       SER1132  23.906  -4.796   4.025
  200   1HB   SER1132           HB2      SER1132  23.816  -2.062   2.743
  201   2HB   SER1132           HB1      SER1132  23.015  -2.448   4.267
  202    HG   SER1132           HG       SER1132  25.015  -1.645   4.772
  203    H    SER1133           HN       SER1133  21.711  -4.875   4.559
  204    HA   SER1133           HA       SER1133  19.809  -4.647   2.332
  205   1HB   SER1133           HB2      SER1133  19.622  -6.938   4.275
  206   2HB   SER1133           HB1      SER1133  18.882  -6.769   2.685
  207    HG   SER1133           HG       SER1133  20.632  -8.180   2.563
  208    H    VAL1134           HN       VAL1134  17.678  -4.140   2.930
  209    HA   VAL1134           HA       VAL1134  17.093  -3.756   5.761
  210    HB   VAL1134           HB       VAL1134  16.277  -1.419   5.350
  211   1HG1  VAL1134          2HG1      VAL1134  19.234  -1.922   5.056
  212   2HG1  VAL1134          1HG1      VAL1134  18.501  -0.397   5.554
  213   3HG1  VAL1134          3HG1      VAL1134  18.327  -1.829   6.566
  214   1HG2  VAL1134          2HG2      VAL1134  17.913  -1.697   2.833
  215   2HG2  VAL1134          1HG2      VAL1134  16.165  -1.483   2.930
  216   3HG2  VAL1134          3HG2      VAL1134  17.242  -0.190   3.458
  217    H    GLU1135           HN       GLU1135  14.829  -2.855   6.036
  218    HA   GLU1135           HA       GLU1135  13.048  -4.313   4.238
  219   1HB   GLU1135           HB2      GLU1135  12.649  -3.154   6.999
  220   2HB   GLU1135           HB1      GLU1135  11.378  -3.927   6.069
  221   1HG   GLU1135           HG2      GLU1135  12.231  -5.503   7.637
  222   2HG   GLU1135           HG1      GLU1135  12.734  -5.999   6.022
  223    H    TYR1136           HN       TYR1136  11.168  -3.348   3.368
  224    HA   TYR1136           HA       TYR1136  11.199  -0.406   3.379
  225   1HB   TYR1136           HB2      TYR1136  11.358  -2.274   1.120
  226   2HB   TYR1136           HB1      TYR1136  10.163  -0.994   0.923
  227    HD1  TYR1136           HD1      TYR1136  13.745  -1.548   1.787
  228    HD2  TYR1136           HD2      TYR1136  10.823   1.119   0.224
  229    HE1  TYR1136           HE1      TYR1136  15.526   0.027   1.156
  230    HE2  TYR1136           HE2      TYR1136  12.593   2.696  -0.411
  231    HH   TYR1136           HH       TYR1136  15.847   1.874  -0.496
  232    H    GLN1137           HN       GLN1137   9.158   0.550   2.568
  233    HA   GLN1137           HA       GLN1137   6.729  -0.921   2.632
  234   1HB   GLN1137           HB2      GLN1137   5.784  -0.093   4.694
  235   2HB   GLN1137           HB1      GLN1137   7.289  -0.924   5.058
  236   1HG   GLN1137           HG2      GLN1137   8.441   1.208   5.246
  237   2HG   GLN1137           HG1      GLN1137   6.953   2.060   4.838
  238   1HE2  GLN1137          1HE2      GLN1137   5.306   0.195   6.381
  239   2HE2  GLN1137          2HE2      GLN1137   5.554   0.606   8.040
  240    H    CYS1138           HN       CYS1138   4.890   0.946   3.231
  241    HA   CYS1138           HA       CYS1138   5.644   3.359   1.742
  242   1HB   CYS1138           HB2      CYS1138   3.356   1.500   1.153
  243   2HB   CYS1138           HB1      CYS1138   3.290   3.198   0.688
  244    H    GLN1139           HN       GLN1139   5.009   5.176   2.669
  245    HA   GLN1139           HA       GLN1139   3.747   5.189   5.192
  246   1HB   GLN1139           HB2      GLN1139   3.947   7.565   5.116
  247   2HB   GLN1139           HB1      GLN1139   5.378   6.898   4.344
  248   1HG   GLN1139           HG2      GLN1139   2.977   8.076   2.963
  249   2HG   GLN1139           HG1      GLN1139   4.576   8.805   3.110
  250   1HE2  GLN1139          1HE2      GLN1139   6.277   7.999   1.881
  251   2HE2  GLN1139          2HE2      GLN1139   6.015   6.991   0.503
  252    H    ASN1140           HN       ASN1140   2.020   7.322   5.167
  253    HA   ASN1140           HA       ASN1140  -0.225   7.701   5.105
  254   1HB   ASN1140           HB2      ASN1140   0.807   8.138   2.675
  255   2HB   ASN1140           HB1      ASN1140  -0.357   6.882   2.258
  256   1HD2  ASN1140          1HD2      ASN1140  -2.140   7.748   4.471
  257   2HD2  ASN1140          2HD2      ASN1140  -2.923   9.172   3.886
  258    H    LEU1141           HN       LEU1141  -2.207   6.559   3.441
  259    HA   LEU1141           HA       LEU1141  -2.759   4.176   4.936
  260   1HB   LEU1141           HB2      LEU1141  -4.328   5.165   2.572
  261   2HB   LEU1141           HB1      LEU1141  -4.899   4.227   3.937
  262    HG   LEU1141           HG       LEU1141  -3.925   7.064   4.221
  263   1HD1  LEU1141          3HD1      LEU1141  -5.776   7.045   2.637
  264   2HD1  LEU1141          2HD1      LEU1141  -6.745   6.098   3.768
  265   3HD1  LEU1141          1HD1      LEU1141  -6.272   7.746   4.178
  266   1HD2  LEU1141          1HD2      LEU1141  -5.661   5.306   5.947
  267   2HD2  LEU1141          3HD2      LEU1141  -3.988   5.759   6.271
  268   3HD2  LEU1141          2HD2      LEU1141  -5.253   6.989   6.276
  269    H    TYR1142           HN       TYR1142  -0.551   4.348   2.750
  270    HA   TYR1142           HA       TYR1142  -1.410   2.437   0.779
  271   1HB   TYR1142           HB2      TYR1142   1.276   3.647   1.435
  272   2HB   TYR1142           HB1      TYR1142   1.061   2.446   0.167
  273    HD1  TYR1142           HD1      TYR1142   0.202   3.048  -1.957
  274    HD2  TYR1142           HD2      TYR1142   0.130   5.863   1.231
  275    HE1  TYR1142           HE1      TYR1142  -0.390   4.826  -3.549
  276    HE2  TYR1142           HE2      TYR1142  -0.465   7.650  -0.351
  277    HH   TYR1142           HH       TYR1142  -0.262   8.121  -2.757
  278    H    GLN1143           HN       GLN1143  -0.369   0.358   0.424
  279    HA   GLN1143           HA       GLN1143   0.721  -0.886   2.854
  280   1HB   GLN1143           HB2      GLN1143  -1.676  -1.419   2.758
  281   2HB   GLN1143           HB1      GLN1143  -1.472  -2.063   1.135
  282   1HG   GLN1143           HG2      GLN1143  -1.592  -3.864   2.720
  283   2HG   GLN1143           HG1      GLN1143   0.028  -3.789   2.028
  284   1HE2  GLN1143          1HE2      GLN1143   1.741  -3.068   3.303
  285   2HE2  GLN1143          2HE2      GLN1143   1.639  -3.033   5.026
  286    H    LEU1144           HN       LEU1144   2.608  -1.815   2.405
  287    HA   LEU1144           HA       LEU1144   3.528  -2.151  -0.264
  288   1HB   LEU1144           HB2      LEU1144   5.073  -1.601   1.517
  289   2HB   LEU1144           HB1      LEU1144   4.682  -3.085   2.363
  290    HG   LEU1144           HG       LEU1144   5.743  -3.388  -0.392
  291   1HD1  LEU1144          1HD1      LEU1144   7.153  -1.593   0.465
  292   2HD1  LEU1144          3HD1      LEU1144   7.483  -2.537   1.919
  293   3HD1  LEU1144          2HD1      LEU1144   8.052  -3.107   0.349
  294   1HD2  LEU1144          2HD2      LEU1144   6.290  -4.770   2.233
  295   2HD2  LEU1144          1HD2      LEU1144   5.175  -5.319   0.982
  296   3HD2  LEU1144          3HD2      LEU1144   6.907  -5.265   0.657
  297    H    GLU1145           HN       GLU1145   4.372  -4.161  -1.151
  298    HA   GLU1145           HA       GLU1145   3.219  -6.643  -0.199
  299   1HB   GLU1145           HB2      GLU1145   1.467  -5.539  -1.639
  300   2HB   GLU1145           HB1      GLU1145   2.586  -5.668  -2.988
  301   1HG   GLU1145           HG2      GLU1145   0.879  -7.442  -2.945
  302   2HG   GLU1145           HG1      GLU1145   2.531  -8.060  -2.882
  303    H    GLY1146           HN       GLY1146   4.682  -8.199  -0.460
  304   1HA   GLY1146           HA1      GLY1146   6.636  -7.937  -2.659
  305   2HA   GLY1146           HA2      GLY1146   6.110  -9.469  -1.976
  306    H    ASN1147           HN       ASN1147   8.742  -9.165  -2.157
  307    HA   ASN1147           HA       ASN1147   9.597  -9.290   0.560
  308   1HB   ASN1147           HB2      ASN1147  11.856  -9.669  -0.413
  309   2HB   ASN1147           HB1      ASN1147  10.628 -10.739  -1.081
  310   1HD2  ASN1147          1HD2      ASN1147  13.195  -9.914  -2.181
  311   2HD2  ASN1147          2HD2      ASN1147  12.849  -9.193  -3.713
  312    H    LYS1148           HN       LYS1148   9.135  -7.229   1.396
  313    HA   LYS1148           HA       LYS1148  10.007  -4.795   0.337
  314   1HB   LYS1148           HB2      LYS1148   9.827  -4.016   2.772
  315   2HB   LYS1148           HB1      LYS1148   8.379  -4.649   2.004
  316   1HG   LYS1148           HG2      LYS1148   8.420  -5.567   4.164
  317   2HG   LYS1148           HG1      LYS1148   8.926  -6.866   3.084
  318   1HD   LYS1148           HD2      LYS1148  11.268  -6.415   3.644
  319   2HD   LYS1148           HD1      LYS1148  10.759  -5.119   4.731
  320   1HE   LYS1148           HE2      LYS1148  10.048  -8.040   4.996
  321   2HE   LYS1148           HE1      LYS1148  11.247  -7.176   5.958
  322   1HZ   LYS1148           HZ2      LYS1148   9.485  -5.758   6.811
  323   2HZ   LYS1148           HZ1      LYS1148   8.335  -6.590   5.891
  324   3HZ   LYS1148           HZ3      LYS1148   9.155  -7.384   7.140
  325    H    ARG1149           HN       ARG1149  11.831  -7.294   1.738
  326    HA   ARG1149           HA       ARG1149  13.982  -5.542   2.599
  327   1HB   ARG1149           HB2      ARG1149  13.485  -7.487   3.969
  328   2HB   ARG1149           HB1      ARG1149  13.744  -8.554   2.598
  329   1HG   ARG1149           HG2      ARG1149  16.089  -7.950   2.531
  330   2HG   ARG1149           HG1      ARG1149  15.850  -6.806   3.855
  331   1HD   ARG1149           HD2      ARG1149  16.814  -8.880   4.678
  332   2HD   ARG1149           HD1      ARG1149  15.189  -8.650   5.324
  333    HE   ARG1149           HE       ARG1149  14.888 -10.181   3.054
  334   1HH1  ARG1149          1HH1      ARG1149  16.575 -10.458   6.091
  335   2HH1  ARG1149          2HH1      ARG1149  16.471 -12.185   6.139
  336   1HH2  ARG1149          1HH2      ARG1149  14.746 -12.456   3.109
  337   2HH2  ARG1149          2HH2      ARG1149  15.431 -13.322   4.444
  338    H    ILE1150           HN       ILE1150  15.364  -4.772   1.146
  339    HA   ILE1150           HA       ILE1150  16.109  -6.513  -1.108
  340    HB   ILE1150           HB       ILE1150  16.285  -4.716  -2.567
  341   1HG1  ILE1150          2HG1      ILE1150  17.603  -3.222  -1.142
  342   2HG1  ILE1150          1HG1      ILE1150  16.281  -2.352  -1.910
  343   1HG2  ILE1150          2HG2      ILE1150  13.969  -4.059  -0.757
  344   2HG2  ILE1150          1HG2      ILE1150  14.160  -3.501  -2.419
  345   3HG2  ILE1150          3HG2      ILE1150  13.970  -5.222  -2.083
  346   1HD1  ILE1150          3HD1      ILE1150  15.004  -2.487   0.176
  347   2HD1  ILE1150          2HD1      ILE1150  16.368  -3.306   0.938
  348   3HD1  ILE1150          1HD1      ILE1150  16.541  -1.644   0.372
  349    H    THR1151           HN       THR1151  18.298  -5.348  -2.089
  350    HA   THR1151           HA       THR1151  20.185  -4.769   0.028
  351    HB   THR1151           HB       THR1151  20.576  -7.230  -1.689
  352    HG1  THR1151           HG1      THR1151  19.184  -7.912  -0.175
  353   1HG2  THR1151          1HG2      THR1151  22.663  -6.091  -1.087
  354   2HG2  THR1151          3HG2      THR1151  22.200  -6.140   0.614
  355   3HG2  THR1151          2HG2      THR1151  22.516  -7.640  -0.258
  356    H    CYS1152           HN       CYS1152  22.143  -3.893  -0.734
  357    HA   CYS1152           HA       CYS1152  21.994  -2.924  -3.483
  358   1HB   CYS1152           HB2      CYS1152  23.742  -1.335  -2.807
  359   2HB   CYS1152           HB1      CYS1152  22.346  -1.255  -1.742
  360    H    ARG1153           HN       ARG1153  23.258  -3.611  -5.051
  361    HA   ARG1153           HA       ARG1153  25.594  -5.254  -4.335
  362   1HB   ARG1153           HB2      ARG1153  25.291  -6.443  -6.461
  363   2HB   ARG1153           HB1      ARG1153  23.882  -6.595  -5.424
  364   1HG   ARG1153           HG2      ARG1153  24.060  -4.591  -7.656
  365   2HG   ARG1153           HG1      ARG1153  23.423  -6.222  -7.867
  366   1HD   ARG1153           HD2      ARG1153  21.818  -5.691  -5.980
  367   2HD   ARG1153           HD1      ARG1153  22.332  -4.011  -6.141
  368    HE   ARG1153           HE       ARG1153  20.524  -5.408  -7.831
  369   1HH1  ARG1153          1HH1      ARG1153  23.017  -2.972  -7.860
  370   2HH1  ARG1153          2HH1      ARG1153  22.379  -2.155  -9.247
  371   1HH2  ARG1153          1HH2      ARG1153  19.680  -4.338  -9.657
  372   2HH2  ARG1153          2HH2      ARG1153  20.483  -2.931 -10.269
  373    H    ASN1154           HN       ASN1154  27.443  -4.262  -4.702
  374    HA   ASN1154           HA       ASN1154  29.079  -3.015  -5.658
  375   1HB   ASN1154           HB2      ASN1154  27.322  -3.163  -8.118
  376   2HB   ASN1154           HB1      ASN1154  28.995  -2.613  -8.094
  377   1HD2  ASN1154          1HD2      ASN1154  26.870  -5.344  -7.846
  378   2HD2  ASN1154          2HD2      ASN1154  28.083  -6.562  -8.011
  379    H    GLY1155           HN       GLY1155  27.564  -1.597  -4.046
  380   1HA   GLY1155           HA1      GLY1155  27.875   1.049  -4.909
  381   2HA   GLY1155           HA2      GLY1155  26.964   0.543  -3.498
  382    H    GLN1156           HN       GLN1156  25.140  -1.095  -5.240
  383    HA   GLN1156           HA       GLN1156  23.323   1.076  -5.891
  384   1HB   GLN1156           HB2      GLN1156  24.268  -0.913  -7.960
  385   2HB   GLN1156           HB1      GLN1156  22.839   0.091  -8.154
  386   1HG   GLN1156           HG2      GLN1156  24.228   2.095  -8.005
  387   2HG   GLN1156           HG1      GLN1156  25.660   1.084  -7.815
  388   1HE2  GLN1156          1HE2      GLN1156  24.676  -0.913  -9.712
  389   2HE2  GLN1156          2HE2      GLN1156  24.882  -0.219 -11.280
  390    H    TRP1157           HN       TRP1157  21.517   0.516  -4.846
  391    HA   TRP1157           HA       TRP1157  20.917  -2.181  -4.125
  392   1HB   TRP1157           HB2      TRP1157  19.193   0.293  -3.999
  393   2HB   TRP1157           HB1      TRP1157  18.792  -1.252  -3.269
  394    HD1  TRP1157           HD1      TRP1157  21.457   1.521  -2.952
  395    HE1  TRP1157           HE1      TRP1157  22.219   1.582  -0.498
  396    HE3  TRP1157           HE3      TRP1157  18.862  -2.505  -1.230
  397    HZ2  TRP1157           HZ2      TRP1157  21.789   0.063   1.871
  398    HZ3  TRP1157           HZ3      TRP1157  19.087  -3.152   1.128
  399    HH2  TRP1157           HH2      TRP1157  20.517  -1.900   2.641
  400    H    SER1158           HN       SER1158  18.285  -2.442  -4.355
  401    HA   SER1158           HA       SER1158  17.573  -2.295  -7.191
  402   1HB   SER1158           HB2      SER1158  17.550  -4.766  -5.454
  403   2HB   SER1158           HB1      SER1158  16.605  -4.632  -6.936
  404    HG   SER1158           HG       SER1158  19.047  -5.423  -6.782
  405    H    GLU1159           HN       GLU1159  15.679  -1.309  -7.353
  406    HA   GLU1159           HA       GLU1159  14.064  -0.348  -5.430
  407   1HB   GLU1159           HB2      GLU1159  13.751   0.214  -7.765
  408   2HB   GLU1159           HB1      GLU1159  13.211  -1.421  -8.123
  409   1HG   GLU1159           HG2      GLU1159  11.241  -1.083  -6.728
  410   2HG   GLU1159           HG1      GLU1159  11.784   0.552  -6.354
  411    HA   PRO1160           HA       PRO1160  12.260  -3.803  -3.317
  412   1HB   PRO1160           HB2      PRO1160  10.068  -1.939  -2.638
  413   2HB   PRO1160           HB1      PRO1160  11.167  -2.815  -1.570
  414   1HG   PRO1160           HG2      PRO1160  11.388  -0.173  -1.920
  415   2HG   PRO1160           HG1      PRO1160  12.819  -1.202  -1.726
  416   1HD   PRO1160           HD2      PRO1160  11.647  -0.035  -4.223
  417   2HD   PRO1160           HD1      PRO1160  13.348  -0.162  -3.735
  418    HA   PRO1161           HA       PRO1161   9.020  -5.679  -5.649
  419   1HB   PRO1161           HB2      PRO1161   6.917  -5.923  -3.827
  420   2HB   PRO1161           HB1      PRO1161   8.221  -7.087  -4.066
  421   1HG   PRO1161           HG2      PRO1161   7.936  -4.954  -1.999
  422   2HG   PRO1161           HG1      PRO1161   8.613  -6.587  -1.846
  423   1HD   PRO1161           HD2      PRO1161  10.199  -4.439  -1.982
  424   2HD   PRO1161           HD1      PRO1161  10.648  -5.962  -2.781
  425    H    LYS1162           HN       LYS1162   6.470  -4.331  -3.704
  426    HA   LYS1162           HA       LYS1162   6.108  -1.907  -5.125
  427   1HB   LYS1162           HB2      LYS1162   5.610  -3.703  -6.886
  428   2HB   LYS1162           HB1      LYS1162   4.159  -4.042  -5.954
  429   1HG   LYS1162           HG2      LYS1162   3.611  -2.572  -7.766
  430   2HG   LYS1162           HG1      LYS1162   3.458  -1.696  -6.241
  431   1HD   LYS1162           HD2      LYS1162   5.664  -0.691  -6.601
  432   2HD   LYS1162           HD1      LYS1162   5.806  -1.560  -8.131
  433   1HE   LYS1162           HE2      LYS1162   3.708   0.497  -7.447
  434   2HE   LYS1162           HE1      LYS1162   5.108   0.753  -8.487
  435   1HZ   LYS1162           HZ1      LYS1162   2.901  -1.164  -9.008
  436   2HZ   LYS1162           HZ3      LYS1162   3.114   0.328  -9.777
  437   3HZ   LYS1162           HZ2      LYS1162   4.241  -0.911 -10.007
  438    H    CYS1163           HN       CYS1163   3.957  -0.926  -4.697
  439    HA   CYS1163           HA       CYS1163   2.802  -1.974  -2.197
  440   1HB   CYS1163           HB2      CYS1163   3.452   0.840  -3.023
  441   2HB   CYS1163           HB1      CYS1163   2.220   0.520  -1.807
  442    H    LEU1164           HN       LEU1164   0.586  -0.949  -1.780
  443    HA   LEU1164           HA       LEU1164  -0.949  -0.860  -4.290
  444   1HB   LEU1164           HB2      LEU1164  -1.821  -2.095  -1.674
  445   2HB   LEU1164           HB1      LEU1164  -2.809  -1.956  -3.112
  446    HG   LEU1164           HG       LEU1164  -2.070  -4.198  -2.994
  447   1HD1  LEU1164          1HD1      LEU1164  -2.008  -3.239  -5.231
  448   2HD1  LEU1164          3HD1      LEU1164  -0.337  -2.735  -4.980
  449   3HD1  LEU1164          2HD1      LEU1164  -0.742  -4.450  -5.032
  450   1HD2  LEU1164          2HD2      LEU1164  -0.230  -3.842  -1.417
  451   2HD2  LEU1164          1HD2      LEU1164   0.249  -4.854  -2.781
  452   3HD2  LEU1164          3HD2      LEU1164   0.745  -3.163  -2.721
  453    H    HIS1165           HN       HIS1165  -2.089   0.920  -4.552
  454    HA   HIS1165           HA       HIS1165  -2.038   3.128  -2.940
  455   1HB   HIS1165           HB2      HIS1165  -4.278   2.296  -4.801
  456   2HB   HIS1165           HB1      HIS1165  -4.023   3.925  -4.181
  457    HD1  HIS1165           HD1      HIS1165  -3.007   1.640  -6.864
  458    HD2  HIS1165           HD2      HIS1165  -1.629   5.188  -5.196
  459    HE1  HIS1165           HE1      HIS1165  -1.374   2.576  -8.530
  460    HE2  HIS1165           HE2      HIS1165  -0.608   4.760  -7.533
  461    HA   PRO1166           HA       PRO1166  -4.658   2.472   0.536
  462   1HB   PRO1166           HB2      PRO1166  -5.929   4.881   0.748
  463   2HB   PRO1166           HB1      PRO1166  -4.250   4.618   1.234
  464   1HG   PRO1166           HG2      PRO1166  -5.328   5.778  -1.307
  465   2HG   PRO1166           HG1      PRO1166  -3.971   6.338  -0.310
  466   1HD   PRO1166           HD2      PRO1166  -3.578   4.916  -2.558
  467   2HD   PRO1166           HD1      PRO1166  -2.534   4.713  -1.136
  468    H    CYS1167           HN       CYS1167  -6.930   2.413   1.243
  469    HA   CYS1167           HA       CYS1167  -8.609   1.363  -0.761
  470   1HB   CYS1167           HB2      CYS1167  -9.434   2.392   1.962
  471   2HB   CYS1167           HB1      CYS1167 -10.314   1.242   0.961
  472    H    VAL1168           HN       VAL1168  -9.159   2.676  -2.405
  473    HA   VAL1168           HA       VAL1168 -10.513   5.196  -1.709
  474    HB   VAL1168           HB       VAL1168  -8.776   4.734  -4.137
  475   1HG1  VAL1168          2HG1      VAL1168 -10.649   6.235  -4.580
  476   2HG1  VAL1168          1HG1      VAL1168 -10.204   7.214  -3.182
  477   3HG1  VAL1168          3HG1      VAL1168  -9.122   7.116  -4.570
  478   1HG2  VAL1168          1HG2      VAL1168  -8.289   6.407  -1.676
  479   2HG2  VAL1168          3HG2      VAL1168  -7.438   4.928  -2.118
  480   3HG2  VAL1168          2HG2      VAL1168  -7.266   6.375  -3.112
  481    H    ILE1169           HN       ILE1169 -12.533   4.240  -1.812
  482    HA   ILE1169           HA       ILE1169 -13.345   3.186  -4.426
  483    HB   ILE1169           HB       ILE1169 -13.711   1.903  -2.188
  484   1HG1  ILE1169          2HG1      ILE1169 -15.955   2.269  -4.178
  485   2HG1  ILE1169          1HG1      ILE1169 -14.558   1.219  -4.387
  486   1HG2  ILE1169          1HG2      ILE1169 -15.963   3.894  -2.106
  487   2HG2  ILE1169          3HG2      ILE1169 -15.962   2.372  -1.215
  488   3HG2  ILE1169          2HG2      ILE1169 -14.735   3.594  -0.874
  489   1HD1  ILE1169          3HD1      ILE1169 -15.282  -0.115  -2.476
  490   2HD1  ILE1169          2HD1      ILE1169 -16.691   0.929  -2.290
  491   3HD1  ILE1169          1HD1      ILE1169 -16.506  -0.054  -3.743
  492    H    SER1170           HN       SER1170 -16.116   3.675  -4.184
  493    HA   SER1170           HA       SER1170 -16.098   6.576  -4.614
  494   1HB   SER1170           HB2      SER1170 -18.046   4.459  -5.540
  495   2HB   SER1170           HB1      SER1170 -18.219   6.185  -5.860
  496    HG   SER1170           HG       SER1170 -15.843   4.850  -6.552
  497    H    ARG1171           HN       ARG1171 -17.045   7.925  -3.271
  498    HA   ARG1171           HA       ARG1171 -18.708   6.936  -1.083
  499   1HB   ARG1171           HB2      ARG1171 -18.546   9.251  -0.241
  500   2HB   ARG1171           HB1      ARG1171 -16.963   8.549  -0.546
  501   1HG   ARG1171           HG2      ARG1171 -16.818   9.769  -2.653
  502   2HG   ARG1171           HG1      ARG1171 -18.410  10.469  -2.357
  503   1HD   ARG1171           HD2      ARG1171 -16.639  12.032  -1.754
  504   2HD   ARG1171           HD1      ARG1171 -17.570  11.548  -0.337
  505    HE   ARG1171           HE       ARG1171 -15.346   9.856  -0.580
  506   1HH1  ARG1171          1HH1      ARG1171 -16.112  13.175   0.161
  507   2HH1  ARG1171          2HH1      ARG1171 -14.727  13.401   1.176
  508   1HH2  ARG1171          1HH2      ARG1171 -13.522  10.146   0.754
  509   2HH2  ARG1171          2HH2      ARG1171 -13.255  11.681   1.512
  510    H    GLU1172           HN       GLU1172 -18.908   8.912  -3.973
  511    HA   GLU1172           HA       GLU1172 -21.615   9.752  -3.514
  512   1HB   GLU1172           HB2      GLU1172 -19.926  11.036  -4.868
  513   2HB   GLU1172           HB1      GLU1172 -20.059   9.795  -6.106
  514   1HG   GLU1172           HG2      GLU1172 -22.429  10.310  -6.374
  515   2HG   GLU1172           HG1      GLU1172 -22.297  11.556  -5.132
  516    H    ILE1173           HN       ILE1173 -20.399   6.824  -4.112
  517    HA   ILE1173           HA       ILE1173 -22.717   5.991  -5.727
  518    HB   ILE1173           HB       ILE1173 -19.954   4.783  -5.663
  519   1HG1  ILE1173          2HG1      ILE1173 -20.374   6.857  -7.026
  520   2HG1  ILE1173          1HG1      ILE1173 -19.798   5.469  -7.947
  521   1HG2  ILE1173          3HG2      ILE1173 -22.428   3.799  -7.081
  522   2HG2  ILE1173          2HG2      ILE1173 -20.803   3.148  -7.284
  523   3HG2  ILE1173          1HG2      ILE1173 -21.619   3.011  -5.727
  524   1HD1  ILE1173          3HD1      ILE1173 -22.093   5.031  -8.683
  525   2HD1  ILE1173          2HD1      ILE1173 -22.644   6.439  -7.774
  526   3HD1  ILE1173          1HD1      ILE1173 -21.548   6.645  -9.140
  527    H    MET1174           HN       MET1174 -20.561   5.187  -3.045
  528    HA   MET1174           HA       MET1174 -22.054   2.879  -2.273
  529   1HB   MET1174           HB2      MET1174 -19.714   2.986  -1.715
  530   2HB   MET1174           HB1      MET1174 -19.930   4.521  -0.888
  531   1HG   MET1174           HG2      MET1174 -21.376   2.091   0.060
  532   2HG   MET1174           HG1      MET1174 -19.683   2.342   0.471
  533   1HE   MET1174           HE3      MET1174 -18.893   4.830   1.447
  534   2HE   MET1174           HE2      MET1174 -20.023   5.722   0.428
  535   3HE   MET1174           HE1      MET1174 -20.034   5.961   2.175
  536    H    GLU1175           HN       GLU1175 -21.436   5.924  -0.546
  537    HA   GLU1175           HA       GLU1175 -23.603   5.648   1.212
  538   1HB   GLU1175           HB2      GLU1175 -22.828   7.563   2.145
  539   2HB   GLU1175           HB1      GLU1175 -21.442   7.264   1.100
  540   1HG   GLU1175           HG2      GLU1175 -22.386   8.769  -0.581
  541   2HG   GLU1175           HG1      GLU1175 -23.773   9.069   0.463
  542    H    ASN1176           HN       ASN1176 -23.704   6.097  -2.048
  543    HA   ASN1176           HA       ASN1176 -26.181   7.666  -1.979
  544   1HB   ASN1176           HB2      ASN1176 -24.000   7.332  -3.956
  545   2HB   ASN1176           HB1      ASN1176 -25.627   7.491  -4.603
  546   1HD2  ASN1176          1HD2      ASN1176 -23.088   9.040  -2.814
  547   2HD2  ASN1176          2HD2      ASN1176 -23.721  10.644  -2.910
  548    H    TYR1177           HN       TYR1177 -24.762   4.644  -3.179
  549    HA   TYR1177           HA       TYR1177 -27.226   3.730  -4.352
  550   1HB   TYR1177           HB2      TYR1177 -24.551   2.449  -3.850
  551   2HB   TYR1177           HB1      TYR1177 -25.926   1.484  -4.371
  552    HD1  TYR1177           HD1      TYR1177 -25.839   4.856  -5.662
  553    HD2  TYR1177           HD2      TYR1177 -24.475   0.880  -6.323
  554    HE1  TYR1177           HE1      TYR1177 -25.340   5.422  -8.003
  555    HE2  TYR1177           HE2      TYR1177 -23.973   1.434  -8.663
  556    HH   TYR1177           HH       TYR1177 -24.669   3.073 -10.358
  557    H    ASN1178           HN       ASN1178 -27.725   4.496  -1.778
  558    HA   ASN1178           HA       ASN1178 -28.590   3.872   0.202
  559   1HB   ASN1178           HB2      ASN1178 -29.552   1.254  -0.469
  560   2HB   ASN1178           HB1      ASN1178 -30.460   2.743  -0.234
  561   1HD2  ASN1178          1HD2      ASN1178 -29.092   0.555  -2.506
  562   2HD2  ASN1178          2HD2      ASN1178 -29.755   1.275  -3.929
  563    H    ILE1179           HN       ILE1179 -25.772   3.023  -0.279
  564    HA   ILE1179           HA       ILE1179 -25.769   0.888   1.751
  565    HB   ILE1179           HB       ILE1179 -23.608   0.072   0.779
  566   1HG1  ILE1179          2HG1      ILE1179 -24.451   1.744  -1.597
  567   2HG1  ILE1179          1HG1      ILE1179 -23.079   2.089  -0.552
  568   1HG2  ILE1179          2HG2      ILE1179 -25.693  -1.118   0.431
  569   2HG2  ILE1179          1HG2      ILE1179 -26.055  -0.111  -0.971
  570   3HG2  ILE1179          3HG2      ILE1179 -24.681  -1.217  -1.010
  571   1HD1  ILE1179          1HD1      ILE1179 -23.396  -0.352  -2.279
  572   2HD1  ILE1179          3HD1      ILE1179 -22.381   1.046  -2.634
  573   3HD1  ILE1179          2HD1      ILE1179 -22.015   0.017  -1.248
  574    H    ALA1180           HN       ALA1180 -24.212   1.016   3.356
  575    HA   ALA1180           HA       ALA1180 -22.612   3.484   3.423
  576   1HB   ALA1180           HB1      ALA1180 -24.610   3.777   4.815
  577   2HB   ALA1180           HB3      ALA1180 -24.182   2.332   5.731
  578   3HB   ALA1180           HB2      ALA1180 -23.140   3.753   5.791
  579    H    LEU1181           HN       LEU1181 -21.584   2.861   6.074
  580    HA   LEU1181           HA       LEU1181 -19.953   0.502   5.396
  581   1HB   LEU1181           HB2      LEU1181 -19.212   3.148   6.545
  582   2HB   LEU1181           HB1      LEU1181 -18.296   1.736   7.038
  583    HG   LEU1181           HG       LEU1181 -18.039   1.318   4.482
  584   1HD1  LEU1181          1HD1      LEU1181 -19.674   3.063   3.845
  585   2HD1  LEU1181          3HD1      LEU1181 -18.576   4.286   4.490
  586   3HD1  LEU1181          2HD1      LEU1181 -18.086   3.295   3.116
  587   1HD2  LEU1181          3HD2      LEU1181 -16.606   3.571   5.881
  588   2HD2  LEU1181          2HD2      LEU1181 -16.202   1.856   5.982
  589   3HD2  LEU1181          1HD2      LEU1181 -16.030   2.715   4.451
  590    H    ARG1182           HN       ARG1182 -18.672  -0.089   7.598
  591    HA   ARG1182           HA       ARG1182 -20.625  -1.290   9.243
  592   1HB   ARG1182           HB2      ARG1182 -18.715  -2.023  10.614
  593   2HB   ARG1182           HB1      ARG1182 -18.449  -2.309   8.899
  594   1HG   ARG1182           HG2      ARG1182 -17.132  -0.179   8.840
  595   2HG   ARG1182           HG1      ARG1182 -17.251  -0.141  10.602
  596   1HD   ARG1182           HD2      ARG1182 -16.204  -2.387  10.667
  597   2HD   ARG1182           HD1      ARG1182 -15.982  -2.297   8.922
  598    HE   ARG1182           HE       ARG1182 -14.838  -0.025  10.106
  599   1HH1  ARG1182          1HH1      ARG1182 -14.334  -3.464   9.870
  600   2HH1  ARG1182          2HH1      ARG1182 -12.615  -3.355  10.059
  601   1HH2  ARG1182          1HH2      ARG1182 -12.577   0.129  10.354
  602   2HH2  ARG1182          2HH2      ARG1182 -11.617  -1.313  10.335
  603    H    TRP1183           HN       TRP1183 -19.695   1.847   9.119
  604    HA   TRP1183           HA       TRP1183 -20.048   2.322  11.996
  605   1HB   TRP1183           HB2      TRP1183 -19.243   4.398   9.965
  606   2HB   TRP1183           HB1      TRP1183 -18.969   4.403  11.706
  607    HD1  TRP1183           HD1      TRP1183 -17.740   2.548   8.544
  608    HE1  TRP1183           HE1      TRP1183 -15.335   1.741   8.973
  609    HE3  TRP1183           HE3      TRP1183 -17.258   3.971  13.433
  610    HZ2  TRP1183           HZ2      TRP1183 -13.482   1.719  11.082
  611    HZ3  TRP1183           HZ3      TRP1183 -15.129   3.520  14.584
  612    HH2  TRP1183           HH2      TRP1183 -13.279   2.416  13.431
  613    H    THR1184           HN       THR1184 -21.804   2.118   9.249
  614    HA   THR1184           HA       THR1184 -23.810   2.892   8.507
  615    HB   THR1184           HB       THR1184 -25.546   3.165  10.153
  616    HG1  THR1184           HG1      THR1184 -24.707   3.096  12.470
  617   1HG2  THR1184          3HG2      THR1184 -24.724   0.889   9.819
  618   2HG2  THR1184          2HG2      THR1184 -23.524   1.127  11.090
  619   3HG2  THR1184          1HG2      THR1184 -25.241   1.129  11.488
  620    H    ALA1185           HN       ALA1185 -21.659   4.847   8.650
  621    HA   ALA1185           HA       ALA1185 -22.966   7.333   9.412
  622   1HB   ALA1185           HB2      ALA1185 -20.605   7.005   9.971
  623   2HB   ALA1185           HB3      ALA1185 -20.834   8.390   8.903
  624   3HB   ALA1185           HB1      ALA1185 -20.220   6.868   8.255
  625    H    LYS1186           HN       LYS1186 -22.350   5.453   6.582
  626    HA   LYS1186           HA       LYS1186 -22.861   5.730   4.385
  627   1HB   LYS1186           HB2      LYS1186 -25.102   6.197   5.324
  628   2HB   LYS1186           HB1      LYS1186 -24.693   7.904   5.417
  629   1HG   LYS1186           HG2      LYS1186 -24.476   8.001   2.995
  630   2HG   LYS1186           HG1      LYS1186 -24.844   6.278   2.886
  631   1HD   LYS1186           HD2      LYS1186 -26.836   7.526   2.383
  632   2HD   LYS1186           HD1      LYS1186 -27.042   6.732   3.945
  633   1HE   LYS1186           HE2      LYS1186 -26.477   8.823   5.082
  634   2HE   LYS1186           HE1      LYS1186 -26.268   9.616   3.522
  635   1HZ   LYS1186           HZ3      LYS1186 -28.600   9.192   3.040
  636   2HZ   LYS1186           HZ2      LYS1186 -28.798   8.443   4.544
  637   3HZ   LYS1186           HZ1      LYS1186 -28.435  10.093   4.463
  638    H    GLN1187           HN       GLN1187 -20.814   6.430   3.795
  639    HA   GLN1187           HA       GLN1187 -20.399   8.540   2.242
  640   1HB   GLN1187           HB2      GLN1187 -20.928  10.199   3.843
  641   2HB   GLN1187           HB1      GLN1187 -19.974   9.408   5.094
  642   1HG   GLN1187           HG2      GLN1187 -18.370  10.849   4.573
  643   2HG   GLN1187           HG1      GLN1187 -18.131   9.871   3.120
  644   1HE2  GLN1187          1HE2      GLN1187 -17.423  11.632   1.927
  645   2HE2  GLN1187          2HE2      GLN1187 -18.497  12.870   1.379
  646    H    LYS1188           HN       LYS1188 -18.686   7.487   5.191
  647    HA   LYS1188           HA       LYS1188 -16.102   7.636   4.503
  648   1HB   LYS1188           HB2      LYS1188 -17.028   6.684   6.630
  649   2HB   LYS1188           HB1      LYS1188 -17.273   5.163   5.781
  650   1HG   LYS1188           HG2      LYS1188 -15.242   5.050   7.055
  651   2HG   LYS1188           HG1      LYS1188 -14.848   5.059   5.335
  652   1HD   LYS1188           HD2      LYS1188 -13.322   6.514   6.503
  653   2HD   LYS1188           HD1      LYS1188 -14.393   7.489   5.495
  654   1HE   LYS1188           HE2      LYS1188 -15.772   7.995   7.451
  655   2HE   LYS1188           HE1      LYS1188 -14.706   7.018   8.459
  656   1HZ   LYS1188           HZ1      LYS1188 -12.893   8.532   7.942
  657   2HZ   LYS1188           HZ3      LYS1188 -13.921   9.472   6.981
  658   3HZ   LYS1188           HZ2      LYS1188 -14.186   9.364   8.648
  659    H    LEU1189           HN       LEU1189 -14.518   6.208   3.575
  660    HA   LEU1189           HA       LEU1189 -15.216   3.923   2.072
  661   1HB   LEU1189           HB2      LEU1189 -15.037   4.804  -0.176
  662   2HB   LEU1189           HB1      LEU1189 -16.354   5.585   0.675
  663    HG   LEU1189           HG       LEU1189 -13.624   6.830   0.400
  664   1HD1  LEU1189          1HD1      LEU1189 -14.531   6.449  -1.826
  665   2HD1  LEU1189          3HD1      LEU1189 -16.041   7.227  -1.353
  666   3HD1  LEU1189          2HD1      LEU1189 -14.549   8.165  -1.421
  667   1HD2  LEU1189          3HD2      LEU1189 -15.124   7.629   2.208
  668   2HD2  LEU1189          2HD2      LEU1189 -14.727   8.862   1.011
  669   3HD2  LEU1189          1HD2      LEU1189 -16.303   8.070   0.974
  670    H    TYR1190           HN       TYR1190 -13.091   5.479   3.745
  671    HA   TYR1190           HA       TYR1190 -10.813   4.683   2.055
  672   1HB   TYR1190           HB2      TYR1190 -11.241   7.097   3.734
  673   2HB   TYR1190           HB1      TYR1190  -9.609   6.445   3.624
  674    HD1  TYR1190           HD1      TYR1190 -12.210   6.491   0.957
  675    HD2  TYR1190           HD2      TYR1190  -8.507   8.070   2.360
  676    HE1  TYR1190           HE1      TYR1190 -11.881   7.643  -1.195
  677    HE2  TYR1190           HE2      TYR1190  -8.173   9.219   0.217
  678    HH   TYR1190           HH       TYR1190 -10.641   9.571  -2.086
  679    H    SER1191           HN       SER1191  -9.186   3.553   2.880
  680    HA   SER1191           HA       SER1191  -8.945   3.053   5.722
  681   1HB   SER1191           HB2      SER1191  -9.770   0.929   3.755
  682   2HB   SER1191           HB1      SER1191  -8.879   0.512   5.216
  683    HG   SER1191           HG       SER1191 -11.353   1.905   5.111
  684    H    ARG1192           HN       ARG1192  -7.092   1.103   5.810
  685    HA   ARG1192           HA       ARG1192  -4.860   2.377   4.454
  686   1HB   ARG1192           HB2      ARG1192  -4.758   1.875   6.892
  687   2HB   ARG1192           HB1      ARG1192  -4.812   0.161   6.506
  688   1HG   ARG1192           HG2      ARG1192  -2.712   0.366   5.278
  689   2HG   ARG1192           HG1      ARG1192  -2.656   2.087   5.666
  690   1HD   ARG1192           HD2      ARG1192  -1.230   0.795   7.168
  691   2HD   ARG1192           HD1      ARG1192  -2.555   1.560   8.043
  692    HE   ARG1192           HE       ARG1192  -3.360  -1.018   7.336
  693   1HH1  ARG1192          1HH1      ARG1192  -1.019   0.543   9.391
  694   2HH1  ARG1192          2HH1      ARG1192  -0.982  -0.747  10.546
  695   1HH2  ARG1192          1HH2      ARG1192  -3.317  -2.720   8.851
  696   2HH2  ARG1192          2HH2      ARG1192  -2.288  -2.602  10.239
  697    H    THR1193           HN       THR1193  -5.868   1.453   2.407
  698    HA   THR1193           HA       THR1193  -5.825  -0.014   0.667
  699    HB   THR1193           HB       THR1193  -3.161  -0.687   1.929
  700    HG1  THR1193           HG1      THR1193  -2.557   1.161   1.123
  701   1HG2  THR1193          3HG2      THR1193  -3.916  -2.382   0.272
  702   2HG2  THR1193          2HG2      THR1193  -4.023  -1.100  -0.934
  703   3HG2  THR1193          1HG2      THR1193  -2.463  -1.515  -0.223
  704    H    GLY1194           HN       GLY1194  -3.838  -2.318   2.188
  705   1HA   GLY1194           HA1      GLY1194  -4.164  -4.411   3.044
  706   2HA   GLY1194           HA2      GLY1194  -5.347  -4.537   1.756
  707    H    GLU1195           HN       GLU1195  -6.155  -2.122   3.998
  708    HA   GLU1195           HA       GLU1195  -7.291  -3.628   6.071
  709   1HB   GLU1195           HB2      GLU1195  -7.844  -0.881   4.995
  710   2HB   GLU1195           HB1      GLU1195  -8.833  -1.555   6.282
  711   1HG   GLU1195           HG2      GLU1195  -5.851  -1.161   6.374
  712   2HG   GLU1195           HG1      GLU1195  -7.057  -0.140   7.157
  713    H    SER1196           HN       SER1196  -9.696  -3.714   6.517
  714    HA   SER1196           HA       SER1196 -11.047  -4.675   4.089
  715   1HB   SER1196           HB2      SER1196 -11.554  -5.421   6.978
  716   2HB   SER1196           HB1      SER1196 -12.389  -6.093   5.577
  717    HG   SER1196           HG       SER1196  -9.913  -6.680   6.592
  718    H    VAL1197           HN       VAL1197 -12.682  -3.521   3.341
  719    HA   VAL1197           HA       VAL1197 -14.074  -1.693   5.188
  720    HB   VAL1197           HB       VAL1197 -13.804  -1.417   2.190
  721   1HG1  VAL1197          3HG1      VAL1197 -15.865  -0.446   3.055
  722   2HG1  VAL1197          2HG1      VAL1197 -14.951   0.455   4.264
  723   3HG1  VAL1197          1HG1      VAL1197 -14.749   0.822   2.550
  724   1HG2  VAL1197          3HG2      VAL1197 -11.665  -1.063   3.297
  725   2HG2  VAL1197          2HG2      VAL1197 -12.310   0.462   2.689
  726   3HG2  VAL1197          1HG2      VAL1197 -12.414   0.084   4.408
  727    H    GLU1198           HN       GLU1198 -15.869  -2.726   5.819
  728    HA   GLU1198           HA       GLU1198 -17.405  -4.273   3.878
  729   1HB   GLU1198           HB2      GLU1198 -18.734  -4.969   5.875
  730   2HB   GLU1198           HB1      GLU1198 -17.029  -5.389   5.970
  731   1HG   GLU1198           HG2      GLU1198 -16.690  -3.330   7.342
  732   2HG   GLU1198           HG1      GLU1198 -18.443  -3.140   7.381
  733    H    PHE1199           HN       PHE1199 -18.657  -2.970   2.639
  734    HA   PHE1199           HA       PHE1199 -19.926  -0.638   3.777
  735   1HB   PHE1199           HB2      PHE1199 -20.407  -1.871   1.064
  736   2HB   PHE1199           HB1      PHE1199 -20.825  -0.242   1.573
  737    HD1  PHE1199           HD1      PHE1199 -19.035   1.433   1.937
  738    HD2  PHE1199           HD2      PHE1199 -18.259  -2.413   0.292
  739    HE1  PHE1199           HE1      PHE1199 -16.882   2.260   1.045
  740    HE2  PHE1199           HE2      PHE1199 -16.116  -1.613  -0.593
  741    HZ   PHE1199           HZ       PHE1199 -15.419   0.723  -0.211
  742    H    VAL1200           HN       VAL1200 -21.580  -0.975   5.139
  743    HA   VAL1200           HA       VAL1200 -23.321  -3.237   4.959
  744    HB   VAL1200           HB       VAL1200 -24.521  -2.304   6.808
  745   1HG1  VAL1200          2HG1      VAL1200 -22.344  -3.249   7.348
  746   2HG1  VAL1200          1HG1      VAL1200 -21.583  -1.679   7.095
  747   3HG1  VAL1200          3HG1      VAL1200 -22.719  -1.904   8.424
  748   1HG2  VAL1200          3HG2      VAL1200 -24.770  -0.027   5.995
  749   2HG2  VAL1200          2HG2      VAL1200 -24.127  -0.031   7.638
  750   3HG2  VAL1200          1HG2      VAL1200 -23.054   0.276   6.272
  751    H    CYS1201           HN       CYS1201 -25.846  -2.288   5.389
  752    HA   CYS1201           HA       CYS1201 -26.428  -0.904   2.860
  753   1HB   CYS1201           HB2      CYS1201 -28.224  -2.838   4.337
  754   2HB   CYS1201           HB1      CYS1201 -28.563  -2.064   2.798
  755    H    LYS1202           HN       LYS1202 -27.895   0.732   2.822
  756    HA   LYS1202           HA       LYS1202 -28.047   2.437   4.989
  757   1HB   LYS1202           HB2      LYS1202 -28.397   3.118   2.653
  758   2HB   LYS1202           HB1      LYS1202 -29.940   2.279   2.645
  759   1HG   LYS1202           HG2      LYS1202 -30.747   3.787   4.409
  760   2HG   LYS1202           HG1      LYS1202 -29.211   4.656   4.338
  761   1HD   LYS1202           HD2      LYS1202 -29.632   5.163   1.967
  762   2HD   LYS1202           HD1      LYS1202 -31.192   4.343   2.085
  763   1HE   LYS1202           HE2      LYS1202 -30.342   6.761   3.676
  764   2HE   LYS1202           HE1      LYS1202 -31.418   6.779   2.280
  765   1HZ   LYS1202           HZ1      LYS1202 -31.944   5.383   4.848
  766   2HZ   LYS1202           HZ3      LYS1202 -32.657   6.836   4.350
  767   3HZ   LYS1202           HZ2      LYS1202 -32.978   5.403   3.508
  768    H    ARG1203           HN       ARG1203 -28.758   1.573   6.843
  769    HA   ARG1203           HA       ARG1203 -30.155   0.213   8.183
  770   1HB   ARG1203           HB2      ARG1203 -31.918   1.878   8.932
  771   2HB   ARG1203           HB1      ARG1203 -30.244   2.393   9.010
  772   1HG   ARG1203           HG2      ARG1203 -30.465   3.756   7.100
  773   2HG   ARG1203           HG1      ARG1203 -32.029   3.051   6.696
  774   1HD   ARG1203           HD2      ARG1203 -31.420   4.729   9.128
  775   2HD   ARG1203           HD1      ARG1203 -32.269   5.279   7.684
  776    HE   ARG1203           HE       ARG1203 -33.569   3.018   8.759
  777   1HH1  ARG1203          1HH1      ARG1203 -33.043   6.405   9.387
  778   2HH1  ARG1203          2HH1      ARG1203 -34.528   6.607  10.255
  779   1HH2  ARG1203          1HH2      ARG1203 -35.526   3.275   9.900
  780   2HH2  ARG1203          2HH2      ARG1203 -35.939   4.827  10.548
  781    H    GLY1204           HN       GLY1204 -31.015  -1.551   7.016
  782   1HA   GLY1204           HA1      GLY1204 -33.812  -1.100   6.193
  783   2HA   GLY1204           HA2      GLY1204 -33.217  -2.585   6.908
  784    H    TYR1205           HN       TYR1205 -31.927  -0.652   4.196
  785    HA   TYR1205           HA       TYR1205 -32.907  -2.013   2.058
  786   1HB   TYR1205           HB2      TYR1205 -30.301  -0.654   2.548
  787   2HB   TYR1205           HB1      TYR1205 -30.469  -1.601   1.077
  788    HD1  TYR1205           HD1      TYR1205 -31.594   1.382   2.882
  789    HD2  TYR1205           HD2      TYR1205 -31.958  -0.878  -0.696
  790    HE1  TYR1205           HE1      TYR1205 -32.718   3.283   1.804
  791    HE2  TYR1205           HE2      TYR1205 -33.085   1.013  -1.787
  792    HH   TYR1205           HH       TYR1205 -33.125   4.136  -0.467
  793    H    ARG1206           HN       ARG1206 -33.204  -4.156   2.107
  794    HA   ARG1206           HA       ARG1206 -31.332  -6.011   3.174
  795   1HB   ARG1206           HB2      ARG1206 -32.811  -7.732   2.279
  796   2HB   ARG1206           HB1      ARG1206 -33.735  -6.478   3.095
  797   1HG   ARG1206           HG2      ARG1206 -34.353  -5.502   0.968
  798   2HG   ARG1206           HG1      ARG1206 -33.358  -6.686   0.115
  799   1HD   ARG1206           HD2      ARG1206 -35.691  -7.342   0.044
  800   2HD   ARG1206           HD1      ARG1206 -34.755  -8.491   1.001
  801    HE   ARG1206           HE       ARG1206 -35.860  -6.525   2.689
  802   1HH1  ARG1206          1HH1      ARG1206 -36.790  -9.278   0.767
  803   2HH1  ARG1206          2HH1      ARG1206 -38.159  -9.667   1.752
  804   1HH2  ARG1206          1HH2      ARG1206 -37.661  -7.029   3.993
  805   2HH2  ARG1206          2HH2      ARG1206 -38.655  -8.388   3.586
  806    H    LEU1207           HN       LEU1207 -29.755  -7.174   2.241
  807    HA   LEU1207           HA       LEU1207 -28.393  -6.366   0.020
  808   1HB   LEU1207           HB2      LEU1207 -28.612  -9.114   1.228
  809   2HB   LEU1207           HB1      LEU1207 -27.511  -8.753  -0.085
  810    HG   LEU1207           HG       LEU1207 -27.460  -7.430   2.630
  811   1HD1  LEU1207          2HD1      LEU1207 -26.820  -9.785   2.739
  812   2HD1  LEU1207          1HD1      LEU1207 -25.648  -9.530   1.445
  813   3HD1  LEU1207          3HD1      LEU1207 -25.430  -8.731   3.002
  814   1HD2  LEU1207          1HD2      LEU1207 -25.562  -7.252   0.294
  815   2HD2  LEU1207          3HD2      LEU1207 -26.631  -5.972   0.869
  816   3HD2  LEU1207          2HD2      LEU1207 -25.303  -6.536   1.884
  817    H    SER1208           HN       SER1208 -28.637  -6.474  -2.114
  818    HA   SER1208           HA       SER1208 -31.014  -7.674  -3.210
  819   1HB   SER1208           HB2      SER1208 -30.217  -5.496  -4.029
  820   2HB   SER1208           HB1      SER1208 -28.725  -6.249  -4.592
  821    HG   SER1208           HG       SER1208 -31.349  -6.560  -5.574
  822    H    SER1209           HN       SER1209 -28.323  -9.069  -2.235
  823    HA   SER1209           HA       SER1209 -27.387 -11.112  -2.609
  824   1HB   SER1209           HB2      SER1209 -29.630 -11.921  -3.186
  825   2HB   SER1209           HB1      SER1209 -29.423 -11.347  -4.840
  826    HG   SER1209           HG       SER1209 -28.558 -13.215  -5.211
  827    H    ARG1210           HN       ARG1210 -27.262  -8.539  -4.591
  828    HA   ARG1210           HA       ARG1210 -25.107  -9.719  -6.211
  829   1HB   ARG1210           HB2      ARG1210 -27.046  -7.555  -7.057
  830   2HB   ARG1210           HB1      ARG1210 -25.689  -8.135  -8.012
  831   1HG   ARG1210           HG2      ARG1210 -26.709 -10.349  -8.129
  832   2HG   ARG1210           HG1      ARG1210 -28.068  -9.774  -7.162
  833   1HD   ARG1210           HD2      ARG1210 -27.254  -8.731  -9.872
  834   2HD   ARG1210           HD1      ARG1210 -28.618  -9.799  -9.542
  835    HE   ARG1210           HE       ARG1210 -28.913  -7.514  -7.968
  836   1HH1  ARG1210          1HH1      ARG1210 -28.926  -8.413 -11.335
  837   2HH1  ARG1210          2HH1      ARG1210 -30.010  -7.145 -11.801
  838   1HH2  ARG1210          1HH2      ARG1210 -30.340  -5.842  -8.574
  839   2HH2  ARG1210          2HH2      ARG1210 -30.813  -5.684 -10.233
  840    H    SER1211           HN       SER1211 -25.292  -8.234  -3.599
  841    HA   SER1211           HA       SER1211 -24.148  -5.651  -4.028
  842   1HB   SER1211           HB2      SER1211 -23.842  -5.634  -1.586
  843   2HB   SER1211           HB1      SER1211 -25.468  -6.159  -2.020
  844    HG   SER1211           HG       SER1211 -23.787  -7.423  -0.492
  845    H    HIS1212           HN       HIS1212 -22.889  -8.692  -4.389
  846    HA   HIS1212           HA       HIS1212 -20.784  -9.548  -4.565
  847   1HB   HIS1212           HB2      HIS1212 -19.856  -6.675  -4.686
  848   2HB   HIS1212           HB1      HIS1212 -19.054  -8.088  -5.360
  849    HD1  HIS1212           HD1      HIS1212 -20.385  -9.261  -7.411
  850    HD2  HIS1212           HD2      HIS1212 -21.519  -5.391  -6.407
  851    HE1  HIS1212           HE1      HIS1212 -21.656  -8.395  -9.402
  852    HE2  HIS1212           HE2      HIS1212 -22.406  -6.083  -8.737
  853    H    THR1213           HN       THR1213 -21.738  -9.336  -1.988
  854    HA   THR1213           HA       THR1213 -21.108  -9.479   0.179
  855    HB   THR1213           HB       THR1213 -18.880 -10.097   0.753
  856    HG1  THR1213           HG1      THR1213 -17.248  -9.945  -1.037
  857   1HG2  THR1213          2HG2      THR1213 -19.521 -11.153  -2.002
  858   2HG2  THR1213          1HG2      THR1213 -18.408 -11.893  -0.851
  859   3HG2  THR1213          3HG2      THR1213 -20.127 -11.792  -0.474
  860    H    LEU1214           HN       LEU1214 -20.705  -8.174   1.904
  861    HA   LEU1214           HA       LEU1214 -20.198  -5.391   1.270
  862   1HB   LEU1214           HB2      LEU1214 -20.818  -6.611   3.960
  863   2HB   LEU1214           HB1      LEU1214 -20.926  -4.918   3.521
  864    HG   LEU1214           HG       LEU1214 -23.147  -5.622   3.545
  865   1HD1  LEU1214          3HD1      LEU1214 -22.530  -4.447   1.463
  866   2HD1  LEU1214          2HD1      LEU1214 -22.305  -6.010   0.679
  867   3HD1  LEU1214          1HD1      LEU1214 -23.902  -5.537   1.259
  868   1HD2  LEU1214          1HD2      LEU1214 -22.724  -8.013   3.771
  869   2HD2  LEU1214          3HD2      LEU1214 -23.952  -7.700   2.544
  870   3HD2  LEU1214          2HD2      LEU1214 -22.305  -8.109   2.061
  871    H    ARG1215           HN       ARG1215 -18.910  -7.813   3.526
  872    HA   ARG1215           HA       ARG1215 -16.666  -6.162   4.235
  873   1HB   ARG1215           HB2      ARG1215 -17.687  -7.789   5.812
  874   2HB   ARG1215           HB1      ARG1215 -17.132  -9.100   4.781
  875   1HG   ARG1215           HG2      ARG1215 -14.815  -8.442   5.178
  876   2HG   ARG1215           HG1      ARG1215 -15.367  -7.115   6.203
  877   1HD   ARG1215           HD2      ARG1215 -16.412  -8.733   7.719
  878   2HD   ARG1215           HD1      ARG1215 -15.838 -10.052   6.700
  879    HE   ARG1215           HE       ARG1215 -13.607  -8.574   7.386
  880   1HH1  ARG1215          1HH1      ARG1215 -16.071 -10.401   9.042
  881   2HH1  ARG1215          2HH1      ARG1215 -15.036 -10.844  10.359
  882   1HH2  ARG1215          1HH2      ARG1215 -12.240  -9.153   9.115
  883   2HH2  ARG1215          2HH2      ARG1215 -12.859 -10.135  10.400
  884    H    THR1216           HN       THR1216 -14.943  -5.889   2.993
  885    HA   THR1216           HA       THR1216 -13.831  -8.162   1.551
  886    HB   THR1216           HB       THR1216 -15.283  -7.212  -0.120
  887    HG1  THR1216           HG1      THR1216 -12.933  -6.100  -1.043
  888   1HG2  THR1216          1HG2      THR1216 -13.895  -4.594   0.450
  889   2HG2  THR1216          3HG2      THR1216 -15.025  -4.877  -0.875
  890   3HG2  THR1216          2HG2      THR1216 -15.581  -4.983   0.796
  891    H    THR1217           HN       THR1217 -11.836  -7.260   0.245
  892    HA   THR1217           HA       THR1217 -10.266  -5.633   2.133
  893    HB   THR1217           HB       THR1217  -9.415  -7.868   0.288
  894    HG1  THR1217           HG1      THR1217  -9.240  -7.452   3.103
  895   1HG2  THR1217          2HG2      THR1217  -7.828  -5.960   0.148
  896   2HG2  THR1217          1HG2      THR1217  -7.612  -6.056   1.897
  897   3HG2  THR1217          3HG2      THR1217  -7.116  -7.405   0.872
  898    H    CYS1218           HN       CYS1218  -9.336  -3.815   1.406
  899    HA   CYS1218           HA       CYS1218  -9.687  -3.201  -1.434
  900   1HB   CYS1218           HB2      CYS1218  -9.070  -0.812  -0.463
  901   2HB   CYS1218           HB1      CYS1218 -10.709  -1.448  -0.380
  902    H    TRP1219           HN       TRP1219  -8.024  -1.765  -2.377
  903    HA   TRP1219           HA       TRP1219  -5.509  -1.221  -1.676
  904   1HB   TRP1219           HB2      TRP1219  -4.068  -3.038  -1.998
  905   2HB   TRP1219           HB1      TRP1219  -5.410  -3.759  -1.120
  906    HD1  TRP1219           HD1      TRP1219  -3.590  -3.879  -4.427
  907    HE1  TRP1219           HE1      TRP1219  -4.492  -5.842  -5.817
  908    HE3  TRP1219           HE3      TRP1219  -7.623  -5.140  -1.549
  909    HZ2  TRP1219           HZ2      TRP1219  -6.617  -7.675  -5.721
  910    HZ3  TRP1219           HZ3      TRP1219  -9.042  -7.017  -2.271
  911    HH2  TRP1219           HH2      TRP1219  -8.549  -8.259  -4.317
  912    H    ASP1220           HN       ASP1220  -4.247  -0.541  -3.447
  913    HA   ASP1220           HA       ASP1220  -3.873   0.203  -5.564
  914   1HB   ASP1220           HB2      ASP1220  -3.996  -2.192  -6.192
  915   2HB   ASP1220           HB1      ASP1220  -5.736  -2.030  -6.409
  916    H    GLY1221           HN       GLY1221  -6.750   0.294  -3.990
  917   1HA   GLY1221           HA1      GLY1221  -7.711   2.484  -5.632
  918   2HA   GLY1221           HA2      GLY1221  -8.303   2.030  -4.045
  919    H    LYS1222           HN       LYS1222  -8.987  -0.634  -4.456
  920    HA   LYS1222           HA       LYS1222 -11.452  -0.289  -5.906
  921   1HB   LYS1222           HB2      LYS1222  -9.333  -1.250  -7.363
  922   2HB   LYS1222           HB1      LYS1222 -10.125  -2.721  -6.817
  923   1HG   LYS1222           HG2      LYS1222 -11.537  -0.478  -8.235
  924   2HG   LYS1222           HG1      LYS1222 -10.891  -1.913  -9.035
  925   1HD   LYS1222           HD2      LYS1222 -12.938  -1.960  -6.819
  926   2HD   LYS1222           HD1      LYS1222 -13.321  -2.061  -8.539
  927   1HE   LYS1222           HE2      LYS1222 -11.617  -4.005  -6.984
  928   2HE   LYS1222           HE1      LYS1222 -13.280  -4.274  -7.507
  929   1HZ   LYS1222           HZ1      LYS1222 -12.546  -4.104  -9.804
  930   2HZ   LYS1222           HZ3      LYS1222 -10.951  -3.848  -9.300
  931   3HZ   LYS1222           HZ2      LYS1222 -11.707  -5.331  -8.998
  932    H    LEU1223           HN       LEU1223 -13.040  -1.515  -5.090
  933    HA   LEU1223           HA       LEU1223 -12.565  -4.037  -3.847
  934   1HB   LEU1223           HB2      LEU1223 -13.542  -3.339  -1.632
  935   2HB   LEU1223           HB1      LEU1223 -11.871  -2.925  -1.950
  936    HG   LEU1223           HG       LEU1223 -14.127  -0.958  -2.293
  937   1HD1  LEU1223          3HD1      LEU1223 -12.364  -1.506   0.078
  938   2HD1  LEU1223          2HD1      LEU1223 -13.429  -0.106  -0.088
  939   3HD1  LEU1223          1HD1      LEU1223 -14.109  -1.733  -0.011
  940   1HD2  LEU1223          3HD2      LEU1223 -11.138  -0.690  -2.078
  941   2HD2  LEU1223          2HD2      LEU1223 -12.148  -0.322  -3.478
  942   3HD2  LEU1223          1HD2      LEU1223 -12.268   0.664  -2.021
  943    H    GLU1224           HN       GLU1224 -14.613  -4.885  -2.796
  944    HA   GLU1224           HA       GLU1224 -16.617  -5.158  -4.607
  945   1HB   GLU1224           HB2      GLU1224 -16.964  -5.237  -1.607
  946   2HB   GLU1224           HB1      GLU1224 -18.055  -5.957  -2.782
  947   1HG   GLU1224           HG2      GLU1224 -15.211  -6.749  -2.221
  948   2HG   GLU1224           HG1      GLU1224 -16.674  -7.664  -1.852
  949    H    TYR1225           HN       TYR1225 -18.881  -4.526  -4.567
  950    HA   TYR1225           HA       TYR1225 -19.412  -1.834  -3.523
  951   1HB   TYR1225           HB2      TYR1225 -19.303  -2.685  -6.371
  952   2HB   TYR1225           HB1      TYR1225 -20.658  -1.663  -5.916
  953    HD1  TYR1225           HD1      TYR1225 -20.397   0.651  -5.602
  954    HD2  TYR1225           HD2      TYR1225 -16.961  -1.818  -6.064
  955    HE1  TYR1225           HE1      TYR1225 -19.009   2.652  -5.941
  956    HE2  TYR1225           HE2      TYR1225 -15.568   0.174  -6.404
  957    HH   TYR1225           HH       TYR1225 -15.832   2.505  -7.125
  958    HA   PRO1226           HA       PRO1226 -23.029  -4.505  -2.627
  959   1HB   PRO1226           HB2      PRO1226 -23.564  -2.347  -0.690
  960   2HB   PRO1226           HB1      PRO1226 -23.434  -4.088  -0.425
  961   1HG   PRO1226           HG2      PRO1226 -21.523  -2.424   0.412
  962   2HG   PRO1226           HG1      PRO1226 -21.125  -4.022  -0.249
  963   1HD   PRO1226           HD2      PRO1226 -20.987  -1.337  -1.581
  964   2HD   PRO1226           HD1      PRO1226 -19.814  -2.672  -1.620
  965    H    THR1227           HN       THR1227 -25.416  -3.701  -2.155
  966    HA   THR1227           HA       THR1227 -26.090  -1.265  -3.577
  967    HB   THR1227           HB       THR1227 -27.471  -3.744  -4.530
  968    HG1  THR1227           HG1      THR1227 -25.673  -4.365  -5.457
  969   1HG2  THR1227          3HG2      THR1227 -28.400  -1.539  -5.078
  970   2HG2  THR1227          2HG2      THR1227 -26.865  -1.079  -5.818
  971   3HG2  THR1227          1HG2      THR1227 -27.833  -2.374  -6.525
  972    H    CYS1228           HN       CYS1228 -27.545  -4.279  -2.414
  973    HA   CYS1228           HA       CYS1228 -29.251  -4.708  -0.967
  974   1HB   CYS1228           HB2      CYS1228 -28.927  -1.933   0.146
  975   2HB   CYS1228           HB1      CYS1228 -29.319  -3.425   1.003
  976    H    ALA1229           HN       ALA1229 -31.504  -3.829  -0.234
  977    HA   ALA1229           HA       ALA1229 -32.616  -1.865  -2.048
  978   1HB   ALA1229           HB2      ALA1229 -33.561  -4.721  -2.163
  979   2HB   ALA1229           HB3      ALA1229 -32.617  -3.896  -3.403
  980   3HB   ALA1229           HB1      ALA1229 -34.256  -3.357  -3.038
  981    H    LYS1230           HN       LYS1230 -34.510  -1.010  -1.448
  982    HA   LYS1230           HA       LYS1230 -35.946  -0.153   0.073
  983   1HB   LYS1230           HB2      LYS1230 -37.743  -1.700   0.703
  984   2HB   LYS1230           HB1      LYS1230 -37.300  -1.844  -0.991
  985   1HG   LYS1230           HG2      LYS1230 -35.906  -3.823  -0.369
  986   2HG   LYS1230           HG1      LYS1230 -36.604  -3.724   1.247
  987   1HD   LYS1230           HD2      LYS1230 -37.834  -5.349  -0.030
  988   2HD   LYS1230           HD1      LYS1230 -38.859  -3.937   0.237
  989   1HE   LYS1230           HE2      LYS1230 -38.334  -3.130  -2.010
  990   2HE   LYS1230           HE1      LYS1230 -37.305  -4.538  -2.277
  991   1HZ   LYS1230           HZ1      LYS1230 -39.248  -5.956  -2.015
  992   2HZ   LYS1230           HZ3      LYS1230 -40.232  -4.600  -1.777
  993   3HZ   LYS1230           HZ2      LYS1230 -39.477  -4.846  -3.270
  994    H    ARG1231           HN       ARG1231 -34.952   0.685   1.764
  995    HA   ARG1231           HA       ARG1231 -33.731  -0.592   3.877
  996   1HB   ARG1231           HB2      ARG1231 -34.332   1.583   5.122
  997   2HB   ARG1231           HB1      ARG1231 -33.305   1.696   3.712
  998   1HG   ARG1231           HG2      ARG1231 -35.216   2.374   2.363
  999   2HG   ARG1231           HG1      ARG1231 -36.272   2.219   3.769
 1000   1HD   ARG1231           HD2      ARG1231 -34.995   3.959   4.919
 1001   2HD   ARG1231           HD1      ARG1231 -33.941   4.114   3.514
 1002    HE   ARG1231           HE       ARG1231 -36.525   4.507   2.609
 1003   1HH1  ARG1231          1HH1      ARG1231 -34.332   6.023   4.852
 1004   2HH1  ARG1231          2HH1      ARG1231 -34.995   7.608   4.628
 1005   1HH2  ARG1231          1HH2      ARG1231 -37.403   6.590   2.309
 1006   2HH2  ARG1231          2HH2      ARG1231 -36.740   7.930   3.183

  No H/Q in entry =        1006
  Start of MODEL   13
    1    H1   GLU1103           HT3      GLU1103  42.352   2.707   0.710
    2    H2   GLU1103           HT2      GLU1103  43.032   3.483  -0.629
    3    H3   GLU1103           HT1      GLU1103  42.398   4.396   0.645
    4    HA   GLU1103           HA       GLU1103  40.187   3.634   0.176
    5   1HB   GLU1103           HB2      GLU1103  41.705   4.734  -2.194
    6   2HB   GLU1103           HB1      GLU1103  39.951   4.616  -2.146
    7   1HG   GLU1103           HG2      GLU1103  40.555   6.842  -1.583
    8   2HG   GLU1103           HG1      GLU1103  39.971   6.053  -0.119
    9    H    ALA1104           HN       ALA1104  39.159   1.796  -0.180
   10    HA   ALA1104           HA       ALA1104  39.677   0.294  -2.620
   11   1HB   ALA1104           HB2      ALA1104  41.200  -0.704  -0.983
   12   2HB   ALA1104           HB1      ALA1104  39.838  -1.008   0.097
   13   3HB   ALA1104           HB3      ALA1104  39.930  -1.832  -1.459
   14    H    GLU1105           HN       GLU1105  37.887   0.139   0.462
   15    HA   GLU1105           HA       GLU1105  35.697  -0.218   0.943
   16   1HB   GLU1105           HB2      GLU1105  35.277   0.737  -1.895
   17   2HB   GLU1105           HB1      GLU1105  34.015   0.571  -0.682
   18   1HG   GLU1105           HG2      GLU1105  35.114   2.259   0.697
   19   2HG   GLU1105           HG1      GLU1105  36.382   2.424  -0.517
   20    H    PHE1106           HN       PHE1106  33.647  -1.426   0.105
   21    HA   PHE1106           HA       PHE1106  34.376  -3.710  -1.574
   22   1HB   PHE1106           HB2      PHE1106  33.212  -3.940   1.210
   23   2HB   PHE1106           HB1      PHE1106  33.368  -5.275   0.074
   24    HD1  PHE1106           HD1      PHE1106  35.088  -3.124   2.429
   25    HD2  PHE1106           HD2      PHE1106  35.584  -6.137  -0.534
   26    HE1  PHE1106           HE1      PHE1106  37.365  -3.557   3.256
   27    HE2  PHE1106           HE2      PHE1106  37.862  -6.576   0.288
   28    HZ   PHE1106           HZ       PHE1106  38.755  -5.285   2.185
   29    H    GLY1107           HN       GLY1107  32.870  -1.850  -2.634
   30   1HA   GLY1107           HA1      GLY1107  30.464  -3.117  -3.275
   31   2HA   GLY1107           HA2      GLY1107  30.859  -1.450  -3.656
   32    H    LYS1108           HN       LYS1108  31.002  -0.225  -1.260
   33    HA   LYS1108           HA       LYS1108  29.109  -0.819   0.669
   34   1HB   LYS1108           HB2      LYS1108  29.969   1.907  -0.321
   35   2HB   LYS1108           HB1      LYS1108  29.080   1.616   1.168
   36   1HG   LYS1108           HG2      LYS1108  31.013   0.147   1.877
   37   2HG   LYS1108           HG1      LYS1108  31.896   0.820   0.504
   38   1HD   LYS1108           HD2      LYS1108  32.495   2.141   2.370
   39   2HD   LYS1108           HD1      LYS1108  31.345   3.106   1.441
   40   1HE   LYS1108           HE2      LYS1108  29.549   2.424   2.953
   41   2HE   LYS1108           HE1      LYS1108  30.698   1.462   3.884
   42   1HZ   LYS1108           HZ3      LYS1108  31.905   3.487   4.416
   43   2HZ   LYS1108           HZ2      LYS1108  30.801   4.408   3.526
   44   3HZ   LYS1108           HZ1      LYS1108  30.295   3.601   4.924
   45    H    CYS1109           HN       CYS1109  26.965  -0.072   1.031
   46    HA   CYS1109           HA       CYS1109  25.356  -0.172  -1.327
   47   1HB   CYS1109           HB2      CYS1109  24.565   0.422   1.533
   48   2HB   CYS1109           HB1      CYS1109  23.447   0.096   0.213
   49    H    GLY1110           HN       GLY1110  24.791   1.453  -2.585
   50   1HA   GLY1110           HA1      GLY1110  24.945   3.686  -3.331
   51   2HA   GLY1110           HA2      GLY1110  25.238   4.195  -1.673
   52    HA   PRO1111           HA       PRO1111  21.153   6.011  -1.696
   53   1HB   PRO1111           HB2      PRO1111  20.974   5.898  -4.690
   54   2HB   PRO1111           HB1      PRO1111  20.474   7.187  -3.588
   55   1HG   PRO1111           HG2      PRO1111  22.780   7.344  -4.932
   56   2HG   PRO1111           HG1      PRO1111  22.646   7.933  -3.266
   57   1HD   PRO1111           HD2      PRO1111  24.035   5.542  -4.311
   58   2HD   PRO1111           HD1      PRO1111  24.328   6.458  -2.819
   59    HA   PRO1112           HA       PRO1112  18.900   2.172  -2.158
   60   1HB   PRO1112           HB2      PRO1112  16.984   2.644  -0.374
   61   2HB   PRO1112           HB1      PRO1112  18.663   2.431   0.136
   62   1HG   PRO1112           HG2      PRO1112  17.077   4.948  -0.185
   63   2HG   PRO1112           HG1      PRO1112  18.230   4.507   1.088
   64   1HD   PRO1112           HD2      PRO1112  18.802   6.099  -1.126
   65   2HD   PRO1112           HD1      PRO1112  20.008   5.260  -0.131
   66    HA   PRO1113           HA       PRO1113  15.973   3.956  -5.234
   67   1HB   PRO1113           HB2      PRO1113  15.945   1.136  -6.121
   68   2HB   PRO1113           HB1      PRO1113  16.258   2.601  -7.056
   69   1HG   PRO1113           HG2      PRO1113  18.228   0.896  -6.432
   70   2HG   PRO1113           HG1      PRO1113  18.497   2.648  -6.481
   71   1HD   PRO1113           HD2      PRO1113  18.112   0.854  -4.118
   72   2HD   PRO1113           HD1      PRO1113  19.221   2.224  -4.323
   73    HA   PRO1114           HA       PRO1114  12.719   2.175  -2.630
   74   1HB   PRO1114           HB2      PRO1114  11.141   4.300  -2.514
   75   2HB   PRO1114           HB1      PRO1114  12.700   4.295  -1.678
   76   1HG   PRO1114           HG2      PRO1114  11.970   5.509  -4.320
   77   2HG   PRO1114           HG1      PRO1114  12.909   6.218  -2.993
   78   1HD   PRO1114           HD2      PRO1114  14.018   5.037  -5.221
   79   2HD   PRO1114           HD1      PRO1114  14.839   5.177  -3.653
   80    H    ILE1115           HN       ILE1115  10.189   2.544  -2.837
   81    HA   ILE1115           HA       ILE1115   9.451   1.495  -5.455
   82    HB   ILE1115           HB       ILE1115   7.158   1.316  -4.143
   83   1HG1  ILE1115          2HG1      ILE1115   9.234   1.505  -1.949
   84   2HG1  ILE1115          1HG1      ILE1115   7.837   2.550  -2.176
   85   1HG2  ILE1115          2HG2      ILE1115   9.556  -0.460  -3.785
   86   2HG2  ILE1115          1HG2      ILE1115   7.930  -0.908  -3.267
   87   3HG2  ILE1115          3HG2      ILE1115   8.262  -0.609  -4.974
   88   1HD1  ILE1115          2HD1      ILE1115   7.722  -0.377  -1.493
   89   2HD1  ILE1115          1HD1      ILE1115   7.519   0.956  -0.355
   90   3HD1  ILE1115          3HD1      ILE1115   6.347   0.716  -1.652
   91    H    ASP1116           HN       ASP1116   7.058   2.174  -6.057
   92    HA   ASP1116           HA       ASP1116   7.145   4.882  -6.814
   93   1HB   ASP1116           HB2      ASP1116   5.857   3.198  -8.062
   94   2HB   ASP1116           HB1      ASP1116   4.762   3.015  -6.695
   95    H    ASN1117           HN       ASN1117   7.152   6.457  -5.330
   96    HA   ASN1117           HA       ASN1117   6.392   7.883  -3.722
   97   1HB   ASN1117           HB2      ASN1117   3.924   6.126  -3.746
   98   2HB   ASN1117           HB1      ASN1117   4.056   7.688  -2.941
   99   1HD2  ASN1117          1HD2      ASN1117   2.276   6.779  -5.084
  100   2HD2  ASN1117          2HD2      ASN1117   2.513   7.885  -6.391
  101    H    GLY1118           HN       GLY1118   7.929   5.461  -3.139
  102   1HA   GLY1118           HA1      GLY1118   7.919   3.807  -1.315
  103   2HA   GLY1118           HA2      GLY1118   7.070   5.003  -0.349
  104    H    ASP1119           HN       ASP1119   9.307   3.799   0.637
  105    HA   ASP1119           HA       ASP1119  11.777   4.967   0.194
  106   1HB   ASP1119           HB2      ASP1119  10.540   7.091   0.780
  107   2HB   ASP1119           HB1      ASP1119  10.311   6.432   2.397
  108    H    ILE1120           HN       ILE1120  13.230   4.797   2.228
  109    HA   ILE1120           HA       ILE1120  12.729   2.226   3.389
  110    HB   ILE1120           HB       ILE1120  14.859   2.683   4.656
  111   1HG1  ILE1120          2HG1      ILE1120  14.911   5.148   2.902
  112   2HG1  ILE1120          1HG1      ILE1120  14.660   5.149   4.643
  113   1HG2  ILE1120          1HG2      ILE1120  14.842   1.445   2.567
  114   2HG2  ILE1120          3HG2      ILE1120  14.929   2.951   1.654
  115   3HG2  ILE1120          2HG2      ILE1120  16.281   2.457   2.672
  116   1HD1  ILE1120          1HD1      ILE1120  16.882   4.200   4.963
  117   2HD1  ILE1120          3HD1      ILE1120  17.135   4.223   3.219
  118   3HD1  ILE1120          2HD1      ILE1120  16.936   5.738   4.101
  119    H    THR1121           HN       THR1121  12.337   1.707   5.514
  120    HA   THR1121           HA       THR1121  11.019   3.791   7.070
  121    HB   THR1121           HB       THR1121   9.962   2.073   8.291
  122    HG1  THR1121           HG1      THR1121  12.100   0.461   7.361
  123   1HG2  THR1121          2HG2      THR1121   9.156   2.222   5.977
  124   2HG2  THR1121          1HG2      THR1121  10.337   1.007   5.485
  125   3HG2  THR1121          3HG2      THR1121   9.032   0.574   6.589
  126    H    SER1122           HN       SER1122  13.969   3.668   6.851
  127    HA   SER1122           HA       SER1122  14.617   3.160   9.678
  128   1HB   SER1122           HB2      SER1122  16.426   3.037   7.258
  129   2HB   SER1122           HB1      SER1122  16.973   2.868   8.926
  130    HG   SER1122           HG       SER1122  16.395   0.863   8.822
  131    H    PHE1123           HN       PHE1123  16.589   4.908   7.336
  132    HA   PHE1123           HA       PHE1123  15.900   7.519   8.185
  133   1HB   PHE1123           HB2      PHE1123  17.012   6.608  10.245
  134   2HB   PHE1123           HB1      PHE1123  18.490   6.442   9.308
  135    HD1  PHE1123           HD1      PHE1123  19.855   8.323   8.798
  136    HD2  PHE1123           HD2      PHE1123  16.117   8.840  10.766
  137    HE1  PHE1123           HE1      PHE1123  20.464  10.645   9.336
  138    HE2  PHE1123           HE2      PHE1123  16.719  11.165  11.306
  139    HZ   PHE1123           HZ       PHE1123  18.896  12.070  10.590
  140    HA   PRO1124           HA       PRO1124  17.808   8.604   4.336
  141   1HB   PRO1124           HB2      PRO1124  18.981  10.809   5.991
  142   2HB   PRO1124           HB1      PRO1124  18.221  10.886   4.396
  143   1HG   PRO1124           HG2      PRO1124  16.875  11.605   6.580
  144   2HG   PRO1124           HG1      PRO1124  16.077  10.724   5.266
  145   1HD   PRO1124           HD2      PRO1124  16.879   9.779   7.960
  146   2HD   PRO1124           HD1      PRO1124  15.574   9.207   6.902
  147    H    LEU1125           HN       LEU1125  19.710   8.284   3.297
  148    HA   LEU1125           HA       LEU1125  22.287   8.509   4.348
  149   1HB   LEU1125           HB2      LEU1125  22.946   6.210   4.726
  150   2HB   LEU1125           HB1      LEU1125  21.595   6.611   5.771
  151    HG   LEU1125           HG       LEU1125  21.609   4.835   3.350
  152   1HD1  LEU1125          3HD1      LEU1125  22.239   3.834   5.471
  153   2HD1  LEU1125          2HD1      LEU1125  20.746   4.421   6.203
  154   3HD1  LEU1125          1HD1      LEU1125  20.683   3.214   4.920
  155   1HD2  LEU1125          3HD2      LEU1125  19.664   6.315   3.180
  156   2HD2  LEU1125          2HD2      LEU1125  19.204   4.641   3.499
  157   3HD2  LEU1125          1HD2      LEU1125  19.172   5.830   4.801
  158    H    SER1126           HN       SER1126  23.704   8.529   2.680
  159    HA   SER1126           HA       SER1126  22.718   7.512   0.092
  160   1HB   SER1126           HB2      SER1126  24.692   9.743   0.649
  161   2HB   SER1126           HB1      SER1126  24.197   9.195  -0.954
  162    HG   SER1126           HG       SER1126  22.184   9.909   0.832
  163    H    VAL1127           HN       VAL1127  25.192   7.378   2.448
  164    HA   VAL1127           HA       VAL1127  26.596   5.342   0.879
  165    HB   VAL1127           HB       VAL1127  28.004   7.242   0.616
  166   1HG1  VAL1127          1HG1      VAL1127  26.888   8.465   2.564
  167   2HG1  VAL1127          3HG1      VAL1127  28.089   7.669   3.586
  168   3HG1  VAL1127          2HG1      VAL1127  28.610   8.757   2.299
  169   1HG2  VAL1127          1HG2      VAL1127  28.933   4.968   1.516
  170   2HG2  VAL1127          3HG2      VAL1127  29.996   6.370   1.380
  171   3HG2  VAL1127          2HG2      VAL1127  29.321   5.924   2.947
  172    H    TYR1128           HN       TYR1128  26.254   3.545   2.008
  173    HA   TYR1128           HA       TYR1128  26.832   3.598   4.871
  174   1HB   TYR1128           HB2      TYR1128  24.827   1.779   4.859
  175   2HB   TYR1128           HB1      TYR1128  24.618   3.467   5.291
  176    HD1  TYR1128           HD1      TYR1128  22.886   1.082   3.890
  177    HD2  TYR1128           HD2      TYR1128  24.524   4.811   2.668
  178    HE1  TYR1128           HE1      TYR1128  21.143   1.288   2.177
  179    HE2  TYR1128           HE2      TYR1128  22.789   5.015   0.942
  180    HH   TYR1128           HH       TYR1128  21.215   3.775  -0.244
  181    H    ALA1129           HN       ALA1129  26.607   1.184   5.679
  182    HA   ALA1129           HA       ALA1129  28.798  -0.183   4.576
  183   1HB   ALA1129           HB3      ALA1129  28.088  -0.436   6.904
  184   2HB   ALA1129           HB1      ALA1129  28.223  -1.998   6.093
  185   3HB   ALA1129           HB2      ALA1129  26.635  -1.280   6.368
  186    HA   PRO1130           HA       PRO1130  26.908  -2.401   1.235
  187   1HB   PRO1130           HB2      PRO1130  28.809  -4.253   0.781
  188   2HB   PRO1130           HB1      PRO1130  29.059  -2.544   0.403
  189   1HG   PRO1130           HG2      PRO1130  29.991  -4.112   2.779
  190   2HG   PRO1130           HG1      PRO1130  30.877  -2.923   1.808
  191   1HD   PRO1130           HD2      PRO1130  29.723  -2.337   4.211
  192   2HD   PRO1130           HD1      PRO1130  29.951  -1.141   2.920
  193    H    ALA1131           HN       ALA1131  26.114  -4.546   0.661
  194    HA   ALA1131           HA       ALA1131  24.973  -6.463   1.105
  195   1HB   ALA1131           HB3      ALA1131  27.198  -7.322   1.664
  196   2HB   ALA1131           HB1      ALA1131  25.949  -8.049   2.675
  197   3HB   ALA1131           HB2      ALA1131  26.986  -6.781   3.329
  198    H    SER1132           HN       SER1132  24.704  -3.828   2.833
  199    HA   SER1132           HA       SER1132  23.391  -4.739   5.210
  200   1HB   SER1132           HB2      SER1132  23.532  -2.036   3.863
  201   2HB   SER1132           HB1      SER1132  22.683  -2.314   5.383
  202    HG   SER1132           HG       SER1132  25.098  -3.376   5.603
  203    H    SER1133           HN       SER1133  21.133  -4.410   5.704
  204    HA   SER1133           HA       SER1133  19.395  -4.424   3.328
  205   1HB   SER1133           HB2      SER1133  18.743  -6.069   5.759
  206   2HB   SER1133           HB1      SER1133  18.153  -6.243   4.108
  207    HG   SER1133           HG       SER1133  20.577  -6.646   3.723
  208    H    VAL1134           HN       VAL1134  17.422  -3.397   3.522
  209    HA   VAL1134           HA       VAL1134  16.771  -2.194   6.112
  210    HB   VAL1134           HB       VAL1134  18.028  -0.488   4.924
  211   1HG1  VAL1134          3HG1      VAL1134  15.945  -0.813   2.782
  212   2HG1  VAL1134          2HG1      VAL1134  17.095   0.523   2.858
  213   3HG1  VAL1134          1HG1      VAL1134  17.675  -1.129   2.639
  214   1HG2  VAL1134          1HG2      VAL1134  16.259   0.246   6.397
  215   2HG2  VAL1134          3HG2      VAL1134  16.412   1.334   5.017
  216   3HG2  VAL1134          2HG2      VAL1134  15.101   0.155   5.070
  217    H    GLU1135           HN       GLU1135  14.633  -1.205   6.122
  218    HA   GLU1135           HA       GLU1135  12.743  -2.883   4.648
  219   1HB   GLU1135           HB2      GLU1135  12.419  -1.206   7.140
  220   2HB   GLU1135           HB1      GLU1135  11.129  -2.122   6.385
  221   1HG   GLU1135           HG2      GLU1135  12.308  -4.194   6.804
  222   2HG   GLU1135           HG1      GLU1135  13.665  -3.299   7.491
  223    H    TYR1136           HN       TYR1136  10.771  -1.914   3.836
  224    HA   TYR1136           HA       TYR1136  11.067   0.935   3.175
  225   1HB   TYR1136           HB2      TYR1136  10.645  -1.392   1.375
  226   2HB   TYR1136           HB1      TYR1136   9.804   0.105   0.983
  227    HD1  TYR1136           HD1      TYR1136  13.048  -1.557   1.178
  228    HD2  TYR1136           HD2      TYR1136  11.049   2.109   0.384
  229    HE1  TYR1136           HE1      TYR1136  15.083  -0.682   0.113
  230    HE2  TYR1136           HE2      TYR1136  13.074   2.989  -0.686
  231    HH   TYR1136           HH       TYR1136  15.494   2.598  -0.651
  232    H    GLN1137           HN       GLN1137   9.015   1.855   2.282
  233    HA   GLN1137           HA       GLN1137   6.532   0.651   3.064
  234   1HB   GLN1137           HB2      GLN1137   5.873   2.309   4.706
  235   2HB   GLN1137           HB1      GLN1137   7.353   1.521   5.235
  236   1HG   GLN1137           HG2      GLN1137   8.660   3.427   4.499
  237   2HG   GLN1137           HG1      GLN1137   7.202   4.213   3.897
  238   1HE2  GLN1137          1HE2      GLN1137   5.717   5.058   5.359
  239   2HE2  GLN1137          2HE2      GLN1137   6.122   5.349   7.014
  240    H    CYS1138           HN       CYS1138   4.754   2.529   2.910
  241    HA   CYS1138           HA       CYS1138   5.445   4.166   0.563
  242   1HB   CYS1138           HB2      CYS1138   3.879   1.990   0.363
  243   2HB   CYS1138           HB1      CYS1138   2.658   3.183   0.798
  244    H    GLN1139           HN       GLN1139   4.702   6.217   0.527
  245    HA   GLN1139           HA       GLN1139   3.876   7.396   2.976
  246   1HB   GLN1139           HB2      GLN1139   5.294   8.476   1.190
  247   2HB   GLN1139           HB1      GLN1139   3.828   8.670   0.240
  248   1HG   GLN1139           HG2      GLN1139   2.864  10.051   2.008
  249   2HG   GLN1139           HG1      GLN1139   4.336   9.857   2.959
  250   1HE2  GLN1139          1HE2      GLN1139   4.339  10.221  -0.509
  251   2HE2  GLN1139          2HE2      GLN1139   5.046  11.797  -0.541
  252    H    ASN1140           HN       ASN1140   2.000   8.991   3.003
  253    HA   ASN1140           HA       ASN1140  -0.253   9.204   3.235
  254   1HB   ASN1140           HB2      ASN1140   0.368   9.774   0.764
  255   2HB   ASN1140           HB1      ASN1140  -0.532   8.305   0.395
  256   1HD2  ASN1140          1HD2      ASN1140  -2.207   9.303  -0.635
  257   2HD2  ASN1140          2HD2      ASN1140  -3.349  10.317   0.170
  258    H    LEU1141           HN       LEU1141  -2.359   7.921   1.893
  259    HA   LEU1141           HA       LEU1141  -2.710   5.641   3.521
  260   1HB   LEU1141           HB2      LEU1141  -4.327   6.227   1.060
  261   2HB   LEU1141           HB1      LEU1141  -4.843   5.447   2.543
  262    HG   LEU1141           HG       LEU1141  -4.098   8.365   2.334
  263   1HD1  LEU1141          1HD1      LEU1141  -6.818   7.066   2.375
  264   2HD1  LEU1141          3HD1      LEU1141  -6.502   8.799   2.464
  265   3HD1  LEU1141          2HD1      LEU1141  -6.082   7.899   1.006
  266   1HD2  LEU1141          2HD2      LEU1141  -5.439   6.784   4.522
  267   2HD2  LEU1141          1HD2      LEU1141  -3.802   7.440   4.562
  268   3HD2  LEU1141          3HD2      LEU1141  -5.189   8.529   4.518
  269    H    TYR1142           HN       TYR1142  -0.757   5.896   0.899
  270    HA   TYR1142           HA       TYR1142  -1.455   3.621  -0.633
  271   1HB   TYR1142           HB2      TYR1142   1.176   5.069  -0.303
  272   2HB   TYR1142           HB1      TYR1142   0.923   3.759  -1.454
  273    HD1  TYR1142           HD1      TYR1142   0.038   7.232  -0.613
  274    HD2  TYR1142           HD2      TYR1142  -0.302   4.113  -3.486
  275    HE1  TYR1142           HE1      TYR1142  -0.799   8.852  -2.263
  276    HE2  TYR1142           HE2      TYR1142  -1.139   5.724  -5.144
  277    HH   TYR1142           HH       TYR1142  -0.948   9.081  -4.706
  278    H    GLN1143           HN       GLN1143  -0.963   1.518  -0.450
  279    HA   GLN1143           HA       GLN1143   0.739   0.701   1.812
  280   1HB   GLN1143           HB2      GLN1143  -1.860   0.361   1.970
  281   2HB   GLN1143           HB1      GLN1143  -1.558  -0.990   0.886
  282   1HG   GLN1143           HG2      GLN1143  -0.280  -0.600   3.584
  283   2HG   GLN1143           HG1      GLN1143  -1.639  -1.669   3.237
  284   1HE2  GLN1143          1HE2      GLN1143   1.771  -1.149   2.865
  285   2HE2  GLN1143          2HE2      GLN1143   2.166  -2.745   2.338
  286    H    LEU1144           HN       LEU1144   2.536  -0.156   0.983
  287    HA   LEU1144           HA       LEU1144   2.787  -1.047  -1.664
  288   1HB   LEU1144           HB2      LEU1144   4.997  -1.618  -1.160
  289   2HB   LEU1144           HB1      LEU1144   4.632  -0.259  -0.117
  290    HG   LEU1144           HG       LEU1144   4.005  -2.442   1.461
  291   1HD1  LEU1144          3HD1      LEU1144   6.459  -3.046  -0.181
  292   2HD1  LEU1144          2HD1      LEU1144   6.067  -3.834   1.347
  293   3HD1  LEU1144          1HD1      LEU1144   4.998  -4.024  -0.044
  294   1HD2  LEU1144          1HD2      LEU1144   5.145  -0.397   2.155
  295   2HD2  LEU1144          3HD2      LEU1144   6.024  -1.830   2.687
  296   3HD2  LEU1144          2HD2      LEU1144   6.595  -0.912   1.294
  297    H    GLU1145           HN       GLU1145   4.070  -3.330  -1.796
  298    HA   GLU1145           HA       GLU1145   2.653  -5.471  -0.487
  299   1HB   GLU1145           HB2      GLU1145   1.194  -4.732  -2.432
  300   2HB   GLU1145           HB1      GLU1145   2.489  -5.257  -3.497
  301   1HG   GLU1145           HG2      GLU1145   1.145  -7.065  -1.509
  302   2HG   GLU1145           HG1      GLU1145   0.616  -6.886  -3.180
  303    H    GLY1146           HN       GLY1146   3.980  -7.167  -0.265
  304   1HA   GLY1146           HA1      GLY1146   6.329  -7.341  -2.042
  305   2HA   GLY1146           HA2      GLY1146   5.602  -8.708  -1.210
  306    H    ASN1147           HN       ASN1147   8.288  -8.341  -0.972
  307    HA   ASN1147           HA       ASN1147   8.530  -7.836   1.873
  308   1HB   ASN1147           HB2      ASN1147   9.645  -9.733   0.347
  309   2HB   ASN1147           HB1      ASN1147  10.919  -8.520   0.239
  310   1HD2  ASN1147          1HD2      ASN1147  11.972  -7.852   2.140
  311   2HD2  ASN1147          2HD2      ASN1147  11.976  -8.844   3.555
  312    H    LYS1148           HN       LYS1148   8.471  -5.663   2.216
  313    HA   LYS1148           HA       LYS1148   9.740  -3.715   0.625
  314   1HB   LYS1148           HB2      LYS1148   9.438  -2.263   2.696
  315   2HB   LYS1148           HB1      LYS1148   7.987  -2.962   1.990
  316   1HG   LYS1148           HG2      LYS1148   7.757  -3.206   4.313
  317   2HG   LYS1148           HG1      LYS1148   8.193  -4.805   3.708
  318   1HD   LYS1148           HD2      LYS1148  10.518  -4.426   4.363
  319   2HD   LYS1148           HD1      LYS1148  10.093  -2.821   4.963
  320   1HE   LYS1148           HE2      LYS1148   9.017  -5.443   5.997
  321   2HE   LYS1148           HE1      LYS1148  10.241  -4.446   6.783
  322   1HZ   LYS1148           HZ1      LYS1148   7.436  -3.633   6.245
  323   2HZ   LYS1148           HZ3      LYS1148   8.061  -4.089   7.750
  324   3HZ   LYS1148           HZ2      LYS1148   8.609  -2.676   6.999
  325    H    ARG1149           HN       ARG1149  11.162  -6.045   2.468
  326    HA   ARG1149           HA       ARG1149  13.470  -4.343   3.132
  327   1HB   ARG1149           HB2      ARG1149  12.481  -5.611   5.014
  328   2HB   ARG1149           HB1      ARG1149  12.821  -7.109   4.160
  329   1HG   ARG1149           HG2      ARG1149  15.192  -6.698   4.286
  330   2HG   ARG1149           HG1      ARG1149  14.908  -5.126   5.034
  331   1HD   ARG1149           HD2      ARG1149  13.862  -6.229   6.951
  332   2HD   ARG1149           HD1      ARG1149  14.146  -7.800   6.202
  333    HE   ARG1149           HE       ARG1149  16.587  -6.427   6.411
  334   1HH1  ARG1149          1HH1      ARG1149  14.197  -7.973   8.421
  335   2HH1  ARG1149          2HH1      ARG1149  15.328  -8.397   9.662
  336   1HH2  ARG1149          1HH2      ARG1149  18.083  -6.981   8.040
  337   2HH2  ARG1149          2HH2      ARG1149  17.537  -7.833   9.446
  338    H    ILE1150           HN       ILE1150  15.226  -4.483   1.909
  339    HA   ILE1150           HA       ILE1150  15.824  -7.018   0.560
  340    HB   ILE1150           HB       ILE1150  16.197  -6.074  -1.555
  341   1HG1  ILE1150          2HG1      ILE1150  17.358  -4.034  -0.865
  342   2HG1  ILE1150          1HG1      ILE1150  16.095  -3.660  -2.032
  343   1HG2  ILE1150          1HG2      ILE1150  13.703  -4.811  -0.428
  344   2HG2  ILE1150          3HG2      ILE1150  14.054  -5.014  -2.145
  345   3HG2  ILE1150          2HG2      ILE1150  13.850  -6.429  -1.113
  346   1HD1  ILE1150          1HD1      ILE1150  14.646  -2.910  -0.219
  347   2HD1  ILE1150          3HD1      ILE1150  15.921  -3.273   0.944
  348   3HD1  ILE1150          2HD1      ILE1150  16.163  -2.012  -0.265
  349    H    THR1151           HN       THR1151  18.072  -6.493  -0.740
  350    HA   THR1151           HA       THR1151  19.886  -5.133   1.123
  351    HB   THR1151           HB       THR1151  20.393  -7.899   0.009
  352    HG1  THR1151           HG1      THR1151  19.017  -8.253   1.655
  353   1HG2  THR1151          1HG2      THR1151  22.431  -6.573   0.309
  354   2HG2  THR1151          3HG2      THR1151  21.968  -6.232   1.976
  355   3HG2  THR1151          2HG2      THR1151  22.346  -7.884   1.486
  356    H    CYS1152           HN       CYS1152  21.552  -4.059   0.158
  357    HA   CYS1152           HA       CYS1152  21.458  -3.676  -2.667
  358   1HB   CYS1152           HB2      CYS1152  22.872  -1.907  -2.326
  359   2HB   CYS1152           HB1      CYS1152  22.267  -2.087  -0.683
  360    H    ARG1153           HN       ARG1153  23.232  -3.999  -4.138
  361    HA   ARG1153           HA       ARG1153  25.212  -5.993  -3.357
  362   1HB   ARG1153           HB2      ARG1153  24.706  -7.261  -5.503
  363   2HB   ARG1153           HB1      ARG1153  23.562  -7.453  -4.183
  364   1HG   ARG1153           HG2      ARG1153  23.102  -5.432  -6.343
  365   2HG   ARG1153           HG1      ARG1153  22.651  -7.125  -6.554
  366   1HD   ARG1153           HD2      ARG1153  21.665  -5.228  -4.429
  367   2HD   ARG1153           HD1      ARG1153  20.736  -5.907  -5.766
  368    HE   ARG1153           HE       ARG1153  21.406  -7.202  -3.278
  369   1HH1  ARG1153          1HH1      ARG1153  20.428  -7.648  -6.593
  370   2HH1  ARG1153          2HH1      ARG1153  19.730  -9.208  -6.312
  371   1HH2  ARG1153          1HH2      ARG1153  20.490  -9.255  -2.899
  372   2HH2  ARG1153          2HH2      ARG1153  19.765 -10.122  -4.212
  373    H    ASN1154           HN       ASN1154  27.103  -5.187  -3.914
  374    HA   ASN1154           HA       ASN1154  28.754  -4.105  -5.043
  375   1HB   ASN1154           HB2      ASN1154  26.983  -4.672  -7.433
  376   2HB   ASN1154           HB1      ASN1154  28.667  -4.160  -7.514
  377   1HD2  ASN1154          1HD2      ASN1154  26.490  -6.751  -6.737
  378   2HD2  ASN1154          2HD2      ASN1154  27.679  -8.004  -6.682
  379    H    GLY1155           HN       GLY1155  26.952  -2.464  -3.771
  380   1HA   GLY1155           HA1      GLY1155  27.409   0.015  -5.055
  381   2HA   GLY1155           HA2      GLY1155  26.406  -0.238  -3.635
  382    H    GLN1156           HN       GLN1156  24.576  -2.080  -4.902
  383    HA   GLN1156           HA       GLN1156  22.866  -0.134  -6.167
  384   1HB   GLN1156           HB2      GLN1156  24.247  -0.967  -8.052
  385   2HB   GLN1156           HB1      GLN1156  23.687  -2.598  -7.713
  386   1HG   GLN1156           HG2      GLN1156  21.395  -1.919  -8.197
  387   2HG   GLN1156           HG1      GLN1156  21.951  -0.279  -8.531
  388   1HE2  GLN1156          1HE2      GLN1156  23.113   0.135 -10.408
  389   2HE2  GLN1156          2HE2      GLN1156  23.142  -0.972 -11.734
  390    H    TRP1157           HN       TRP1157  21.259  -0.454  -4.726
  391    HA   TRP1157           HA       TRP1157  20.497  -2.892  -3.587
  392   1HB   TRP1157           HB2      TRP1157  18.971  -0.323  -4.001
  393   2HB   TRP1157           HB1      TRP1157  18.322  -1.687  -3.098
  394    HD1  TRP1157           HD1      TRP1157  21.032   1.012  -2.895
  395    HE1  TRP1157           HE1      TRP1157  21.797   1.214  -0.444
  396    HE3  TRP1157           HE3      TRP1157  18.494  -2.961  -0.944
  397    HZ2  TRP1157           HZ2      TRP1157  21.384  -0.164   1.997
  398    HZ3  TRP1157           HZ3      TRP1157  18.728  -3.457   1.452
  399    HH2  TRP1157           HH2      TRP1157  20.142  -2.089   2.891
  400    H    SER1158           HN       SER1158  18.172  -3.720  -3.812
  401    HA   SER1158           HA       SER1158  17.691  -4.291  -6.644
  402   1HB   SER1158           HB2      SER1158  16.778  -5.767  -4.180
  403   2HB   SER1158           HB1      SER1158  16.484  -6.284  -5.842
  404    HG   SER1158           HG       SER1158  19.028  -5.948  -5.766
  405    H    GLU1159           HN       GLU1159  16.705  -2.183  -4.568
  406    HA   GLU1159           HA       GLU1159  14.883  -0.936  -4.105
  407   1HB   GLU1159           HB2      GLU1159  15.025  -0.320  -6.322
  408   2HB   GLU1159           HB1      GLU1159  14.517  -1.894  -6.896
  409   1HG   GLU1159           HG2      GLU1159  12.237  -1.443  -6.116
  410   2HG   GLU1159           HG1      GLU1159  12.756   0.140  -5.537
  411    HA   PRO1160           HA       PRO1160  11.825  -3.478  -2.178
  412   1HB   PRO1160           HB2      PRO1160   9.779  -1.638  -2.016
  413   2HB   PRO1160           HB1      PRO1160  11.135  -1.729  -0.888
  414   1HG   PRO1160           HG2      PRO1160  10.748   0.069  -3.246
  415   2HG   PRO1160           HG1      PRO1160  11.396   0.450  -1.642
  416   1HD   PRO1160           HD2      PRO1160  13.005   0.104  -3.748
  417   2HD   PRO1160           HD1      PRO1160  13.468  -0.459  -2.127
  418    HA   PRO1161           HA       PRO1161   9.076  -5.242  -5.115
  419   1HB   PRO1161           HB2      PRO1161   6.838  -4.892  -3.195
  420   2HB   PRO1161           HB1      PRO1161   7.420  -6.356  -3.994
  421   1HG   PRO1161           HG2      PRO1161   7.937  -5.922  -1.421
  422   2HG   PRO1161           HG1      PRO1161   9.162  -6.641  -2.483
  423   1HD   PRO1161           HD2      PRO1161   8.951  -3.839  -1.454
  424   2HD   PRO1161           HD1      PRO1161  10.392  -4.855  -1.676
  425    H    LYS1162           HN       LYS1162   6.281  -3.643  -3.759
  426    HA   LYS1162           HA       LYS1162   6.390  -1.335  -5.438
  427   1HB   LYS1162           HB2      LYS1162   4.746  -1.931  -7.090
  428   2HB   LYS1162           HB1      LYS1162   6.051  -3.108  -7.131
  429   1HG   LYS1162           HG2      LYS1162   4.693  -4.679  -5.854
  430   2HG   LYS1162           HG1      LYS1162   3.380  -3.501  -5.799
  431   1HD   LYS1162           HD2      LYS1162   2.933  -5.101  -7.545
  432   2HD   LYS1162           HD1      LYS1162   3.300  -3.536  -8.274
  433   1HE   LYS1162           HE2      LYS1162   4.407  -5.349  -9.475
  434   2HE   LYS1162           HE1      LYS1162   5.582  -4.270  -8.724
  435   1HZ   LYS1162           HZ3      LYS1162   5.832  -5.861  -6.921
  436   2HZ   LYS1162           HZ2      LYS1162   4.709  -6.897  -7.646
  437   3HZ   LYS1162           HZ1      LYS1162   6.185  -6.584  -8.410
  438    H    CYS1163           HN       CYS1163   4.639   0.083  -5.183
  439    HA   CYS1163           HA       CYS1163   3.097  -0.365  -2.773
  440   1HB   CYS1163           HB2      CYS1163   3.543   2.002  -4.573
  441   2HB   CYS1163           HB1      CYS1163   2.301   2.026  -3.327
  442    H    LEU1164           HN       LEU1164   0.832  -0.165  -2.635
  443    HA   LEU1164           HA       LEU1164  -0.617  -0.558  -5.170
  444   1HB   LEU1164           HB2      LEU1164  -1.210  -1.892  -2.526
  445   2HB   LEU1164           HB1      LEU1164  -2.156  -2.063  -3.990
  446    HG   LEU1164           HG       LEU1164   0.623  -3.097  -3.469
  447   1HD1  LEU1164          3HD1      LEU1164  -1.193  -4.451  -2.585
  448   2HD1  LEU1164          2HD1      LEU1164  -1.968  -4.465  -4.169
  449   3HD1  LEU1164          1HD1      LEU1164  -0.409  -5.260  -3.943
  450   1HD2  LEU1164          3HD2      LEU1164  -0.911  -3.094  -6.064
  451   2HD2  LEU1164          2HD2      LEU1164   0.562  -2.187  -5.726
  452   3HD2  LEU1164          1HD2      LEU1164   0.601  -3.949  -5.763
  453    H    HIS1165           HN       HIS1165  -2.070   0.968  -5.527
  454    HA   HIS1165           HA       HIS1165  -2.631   3.065  -3.800
  455   1HB   HIS1165           HB2      HIS1165  -4.349   2.004  -6.054
  456   2HB   HIS1165           HB1      HIS1165  -4.513   3.591  -5.310
  457    HD1  HIS1165           HD1      HIS1165  -3.019   5.429  -6.161
  458    HD2  HIS1165           HD2      HIS1165  -1.937   1.682  -7.595
  459    HE1  HIS1165           HE1      HIS1165  -1.275   5.860  -7.922
  460    HE2  HIS1165           HE2      HIS1165  -0.577   3.573  -8.717
  461    HA   PRO1166           HA       PRO1166  -5.216   1.097  -0.739
  462   1HB   PRO1166           HB2      PRO1166  -6.341   3.465   0.171
  463   2HB   PRO1166           HB1      PRO1166  -4.816   2.784   0.743
  464   1HG   PRO1166           HG2      PRO1166  -5.297   4.928  -1.282
  465   2HG   PRO1166           HG1      PRO1166  -4.042   4.825  -0.033
  466   1HD   PRO1166           HD2      PRO1166  -3.497   4.280  -2.594
  467   2HD   PRO1166           HD1      PRO1166  -2.750   3.349  -1.281
  468    H    CYS1167           HN       CYS1167  -7.489   0.775  -0.370
  469    HA   CYS1167           HA       CYS1167  -9.038   0.761  -2.689
  470   1HB   CYS1167           HB2      CYS1167 -10.957   0.429  -0.974
  471   2HB   CYS1167           HB1      CYS1167  -9.713  -0.806  -1.115
  472    H    VAL1168           HN       VAL1168  -9.280   2.687  -3.666
  473    HA   VAL1168           HA       VAL1168 -10.429   4.905  -2.134
  474    HB   VAL1168           HB       VAL1168  -9.246   4.883  -4.917
  475   1HG1  VAL1168          2HG1      VAL1168 -11.038   6.546  -4.656
  476   2HG1  VAL1168          1HG1      VAL1168 -10.202   7.212  -3.254
  477   3HG1  VAL1168          3HG1      VAL1168  -9.457   7.305  -4.850
  478   1HG2  VAL1168          1HG2      VAL1168  -8.184   5.963  -2.309
  479   2HG2  VAL1168          3HG2      VAL1168  -7.551   4.589  -3.216
  480   3HG2  VAL1168          2HG2      VAL1168  -7.443   6.215  -3.890
  481    H    ILE1169           HN       ILE1169 -12.502   3.936  -1.995
  482    HA   ILE1169           HA       ILE1169 -13.946   3.529  -4.488
  483    HB   ILE1169           HB       ILE1169 -14.086   2.333  -1.963
  484   1HG1  ILE1169          2HG1      ILE1169 -15.879   2.150  -4.386
  485   2HG1  ILE1169          1HG1      ILE1169 -14.446   1.185  -4.049
  486   1HG2  ILE1169          2HG2      ILE1169 -15.537   4.139  -1.196
  487   2HG2  ILE1169          1HG2      ILE1169 -16.643   3.821  -2.533
  488   3HG2  ILE1169          3HG2      ILE1169 -16.402   2.605  -1.277
  489   1HD1  ILE1169          2HD1      ILE1169 -15.587   0.172  -2.140
  490   2HD1  ILE1169          1HD1      ILE1169 -17.029   1.117  -2.511
  491   3HD1  ILE1169          3HD1      ILE1169 -16.452  -0.097  -3.653
  492    H    SER1170           HN       SER1170 -16.209   4.417  -4.593
  493    HA   SER1170           HA       SER1170 -16.070   7.278  -4.048
  494   1HB   SER1170           HB2      SER1170 -18.084   5.677  -5.641
  495   2HB   SER1170           HB1      SER1170 -18.044   7.436  -5.525
  496    HG   SER1170           HG       SER1170 -16.965   6.859  -7.378
  497    H    ARG1171           HN       ARG1171 -17.721   8.466  -3.030
  498    HA   ARG1171           HA       ARG1171 -19.146   6.975  -0.940
  499   1HB   ARG1171           HB2      ARG1171 -19.418   9.171   0.128
  500   2HB   ARG1171           HB1      ARG1171 -17.728   8.830  -0.217
  501   1HG   ARG1171           HG2      ARG1171 -17.846  10.257  -2.200
  502   2HG   ARG1171           HG1      ARG1171 -19.538  10.610  -1.837
  503   1HD   ARG1171           HD2      ARG1171 -17.188  11.245  -0.056
  504   2HD   ARG1171           HD1      ARG1171 -18.041  12.401  -1.079
  505    HE   ARG1171           HE       ARG1171 -19.899  11.161   0.609
  506   1HH1  ARG1171          1HH1      ARG1171 -17.205  13.364   0.779
  507   2HH1  ARG1171          2HH1      ARG1171 -17.799  14.185   2.183
  508   1HH2  ARG1171          1HH2      ARG1171 -20.689  12.237   2.458
  509   2HH2  ARG1171          2HH2      ARG1171 -19.778  13.544   3.138
  510    H    GLU1172           HN       GLU1172 -19.658   8.793  -3.830
  511    HA   GLU1172           HA       GLU1172 -22.422   9.394  -3.349
  512   1HB   GLU1172           HB2      GLU1172 -20.829   9.409  -5.920
  513   2HB   GLU1172           HB1      GLU1172 -22.445  10.073  -5.721
  514   1HG   GLU1172           HG2      GLU1172 -21.584  11.689  -4.104
  515   2HG   GLU1172           HG1      GLU1172 -19.963  11.023  -4.307
  516    H    ILE1173           HN       ILE1173 -21.561   6.574  -3.109
  517    HA   ILE1173           HA       ILE1173 -23.569   5.434  -4.910
  518    HB   ILE1173           HB       ILE1173 -20.817   4.282  -4.454
  519   1HG1  ILE1173          2HG1      ILE1173 -21.078   6.139  -6.126
  520   2HG1  ILE1173          1HG1      ILE1173 -20.469   4.629  -6.799
  521   1HG2  ILE1173          1HG2      ILE1173 -22.552   2.540  -4.422
  522   2HG2  ILE1173          3HG2      ILE1173 -23.121   3.098  -5.996
  523   3HG2  ILE1173          2HG2      ILE1173 -21.505   2.413  -5.836
  524   1HD1  ILE1173          1HD1      ILE1173 -22.703   4.124  -7.652
  525   2HD1  ILE1173          3HD1      ILE1173 -23.298   5.644  -6.983
  526   3HD1  ILE1173          2HD1      ILE1173 -22.095   5.658  -8.273
  527    H    MET1174           HN       MET1174 -21.315   4.280  -2.371
  528    HA   MET1174           HA       MET1174 -23.219   2.496  -1.285
  529   1HB   MET1174           HB2      MET1174 -21.618   2.298   0.609
  530   2HB   MET1174           HB1      MET1174 -20.874   2.057  -0.965
  531   1HG   MET1174           HG2      MET1174 -19.468   3.743  -0.664
  532   2HG   MET1174           HG1      MET1174 -20.753   4.822  -0.124
  533   1HE   MET1174           HE1      MET1174 -21.931   3.248   2.372
  534   2HE   MET1174           HE3      MET1174 -20.993   3.958   3.686
  535   3HE   MET1174           HE2      MET1174 -21.601   4.981   2.385
  536    H    GLU1175           HN       GLU1175 -21.924   5.580  -0.036
  537    HA   GLU1175           HA       GLU1175 -23.945   5.705   2.002
  538   1HB   GLU1175           HB2      GLU1175 -22.671   7.341   2.918
  539   2HB   GLU1175           HB1      GLU1175 -21.449   6.788   1.777
  540   1HG   GLU1175           HG2      GLU1175 -21.955   8.543   0.259
  541   2HG   GLU1175           HG1      GLU1175 -23.384   9.010   1.179
  542    H    ASN1176           HN       ASN1176 -24.260   5.914  -1.147
  543    HA   ASN1176           HA       ASN1176 -25.977   8.285  -1.215
  544   1HB   ASN1176           HB2      ASN1176 -24.185   7.964  -2.942
  545   2HB   ASN1176           HB1      ASN1176 -25.102   6.577  -3.515
  546   1HD2  ASN1176          1HD2      ASN1176 -24.937  10.016  -3.335
  547   2HD2  ASN1176          2HD2      ASN1176 -26.232  10.348  -4.430
  548    H    TYR1177           HN       TYR1177 -26.070   5.033  -2.691
  549    HA   TYR1177           HA       TYR1177 -28.754   4.963  -3.285
  550   1HB   TYR1177           HB2      TYR1177 -26.906   2.710  -2.495
  551   2HB   TYR1177           HB1      TYR1177 -28.539   2.453  -3.100
  552    HD1  TYR1177           HD1      TYR1177 -28.891   4.154  -5.323
  553    HD2  TYR1177           HD2      TYR1177 -25.332   2.186  -4.079
  554    HE1  TYR1177           HE1      TYR1177 -28.051   4.228  -7.633
  555    HE2  TYR1177           HE2      TYR1177 -24.479   2.257  -6.380
  556    HH   TYR1177           HH       TYR1177 -25.365   2.432  -8.669
  557    H    ASN1178           HN       ASN1178 -27.428   3.131  -0.539
  558    HA   ASN1178           HA       ASN1178 -29.024   4.188   1.441
  559   1HB   ASN1178           HB2      ASN1178 -30.660   2.174   1.605
  560   2HB   ASN1178           HB1      ASN1178 -31.027   3.480   0.480
  561   1HD2  ASN1178          1HD2      ASN1178 -28.660   0.889   0.133
  562   2HD2  ASN1178          2HD2      ASN1178 -29.390   0.167  -1.255
  563    H    ILE1179           HN       ILE1179 -26.398   2.923   0.936
  564    HA   ILE1179           HA       ILE1179 -26.560   0.906   3.081
  565    HB   ILE1179           HB       ILE1179 -24.781  -0.356   2.123
  566   1HG1  ILE1179          2HG1      ILE1179 -24.647   1.663  -0.119
  567   2HG1  ILE1179          1HG1      ILE1179 -23.511   1.601   1.225
  568   1HG2  ILE1179          1HG2      ILE1179 -26.782   0.370  -0.009
  569   2HG2  ILE1179          3HG2      ILE1179 -25.777  -1.080   0.003
  570   3HG2  ILE1179          2HG2      ILE1179 -26.992  -0.840   1.257
  571   1HD1  ILE1179          1HD1      ILE1179 -22.832  -0.642   0.544
  572   2HD1  ILE1179          3HD1      ILE1179 -23.961  -0.568  -0.809
  573   3HD1  ILE1179          2HD1      ILE1179 -22.588   0.538  -0.744
  574    H    ALA1180           HN       ALA1180 -24.272   0.575   4.090
  575    HA   ALA1180           HA       ALA1180 -22.776   3.074   4.274
  576   1HB   ALA1180           HB3      ALA1180 -24.535   3.319   5.952
  577   2HB   ALA1180           HB2      ALA1180 -24.046   1.797   6.694
  578   3HB   ALA1180           HB1      ALA1180 -22.949   3.177   6.707
  579    H    LEU1181           HN       LEU1181 -21.546   2.105   6.821
  580    HA   LEU1181           HA       LEU1181 -19.906  -0.057   5.665
  581   1HB   LEU1181           HB2      LEU1181 -19.213   2.419   7.119
  582   2HB   LEU1181           HB1      LEU1181 -18.304   0.990   7.574
  583    HG   LEU1181           HG       LEU1181 -17.189   2.379   5.842
  584   1HD1  LEU1181          1HD1      LEU1181 -16.668   0.009   6.053
  585   2HD1  LEU1181          3HD1      LEU1181 -17.992  -0.388   4.958
  586   3HD1  LEU1181          2HD1      LEU1181 -16.602   0.523   4.367
  587   1HD2  LEU1181          2HD2      LEU1181 -19.510   1.507   4.131
  588   2HD2  LEU1181          1HD2      LEU1181 -19.159   3.154   4.655
  589   3HD2  LEU1181          3HD2      LEU1181 -18.057   2.326   3.555
  590    H    ARG1182           HN       ARG1182 -18.728  -1.360   7.398
  591    HA   ARG1182           HA       ARG1182 -20.633  -2.606   9.047
  592   1HB   ARG1182           HB2      ARG1182 -18.669  -3.809  10.032
  593   2HB   ARG1182           HB1      ARG1182 -18.770  -3.892   8.279
  594   1HG   ARG1182           HG2      ARG1182 -17.080  -2.135   8.099
  595   2HG   ARG1182           HG1      ARG1182 -16.973  -2.066   9.859
  596   1HD   ARG1182           HD2      ARG1182 -16.255  -4.405   9.905
  597   2HD   ARG1182           HD1      ARG1182 -16.357  -4.471   8.146
  598    HE   ARG1182           HE       ARG1182 -14.657  -2.364   8.875
  599   1HH1  ARG1182          1HH1      ARG1182 -14.769  -5.846   8.929
  600   2HH1  ARG1182          2HH1      ARG1182 -13.051  -6.032   8.819
  601   1HH2  ARG1182          1HH2      ARG1182 -12.393  -2.599   8.729
  602   2HH2  ARG1182          2HH2      ARG1182 -11.700  -4.186   8.705
  603    H    TRP1183           HN       TRP1183 -19.074   0.284   9.427
  604    HA   TRP1183           HA       TRP1183 -19.308   0.215  12.361
  605   1HB   TRP1183           HB2      TRP1183 -17.895   2.390  10.840
  606   2HB   TRP1183           HB1      TRP1183 -17.650   1.867  12.504
  607    HD1  TRP1183           HD1      TRP1183 -16.832   0.807   8.899
  608    HE1  TRP1183           HE1      TRP1183 -14.808  -0.780   8.959
  609    HE3  TRP1183           HE3      TRP1183 -16.326   0.313  13.964
  610    HZ2  TRP1183           HZ2      TRP1183 -13.205  -2.054  10.880
  611    HZ3  TRP1183           HZ3      TRP1183 -14.514  -1.109  14.832
  612    HH2  TRP1183           HH2      TRP1183 -12.985  -2.269  13.320
  613    H    THR1184           HN       THR1184 -20.623   1.395   9.474
  614    HA   THR1184           HA       THR1184 -22.199   2.941   8.934
  615    HB   THR1184           HB       THR1184 -24.102   3.140  10.538
  616    HG1  THR1184           HG1      THR1184 -23.166   2.923  12.527
  617   1HG2  THR1184          1HG2      THR1184 -23.998   1.330   8.892
  618   2HG2  THR1184          3HG2      THR1184 -23.105   0.334  10.042
  619   3HG2  THR1184          2HG2      THR1184 -24.774   0.796  10.383
  620    H    ALA1185           HN       ALA1185 -20.806   4.728   8.822
  621    HA   ALA1185           HA       ALA1185 -21.268   6.683  10.966
  622   1HB   ALA1185           HB3      ALA1185 -18.614   6.230   9.610
  623   2HB   ALA1185           HB1      ALA1185 -19.020   5.760  11.259
  624   3HB   ALA1185           HB2      ALA1185 -18.971   7.465  10.816
  625    H    LYS1186           HN       LYS1186 -19.573   6.594   7.829
  626    HA   LYS1186           HA       LYS1186 -21.313   7.952   6.237
  627   1HB   LYS1186           HB2      LYS1186 -21.265   9.776   7.907
  628   2HB   LYS1186           HB1      LYS1186 -19.528   9.921   7.685
  629   1HG   LYS1186           HG2      LYS1186 -19.872  10.568   5.358
  630   2HG   LYS1186           HG1      LYS1186 -21.618  10.416   5.574
  631   1HD   LYS1186           HD2      LYS1186 -21.542  12.163   7.298
  632   2HD   LYS1186           HD1      LYS1186 -19.804  12.329   7.043
  633   1HE   LYS1186           HE2      LYS1186 -21.022  14.068   5.854
  634   2HE   LYS1186           HE1      LYS1186 -20.207  12.988   4.724
  635   1HZ   LYS1186           HZ2      LYS1186 -22.304  11.844   4.360
  636   2HZ   LYS1186           HZ1      LYS1186 -23.086  12.881   5.443
  637   3HZ   LYS1186           HZ3      LYS1186 -22.451  13.489   3.997
  638    H    GLN1187           HN       GLN1187 -20.433   7.108   4.466
  639    HA   GLN1187           HA       GLN1187 -19.014   6.860   2.705
  640   1HB   GLN1187           HB2      GLN1187 -18.428   9.237   2.999
  641   2HB   GLN1187           HB1      GLN1187 -17.215   8.788   4.190
  642   1HG   GLN1187           HG2      GLN1187 -16.008   7.529   2.465
  643   2HG   GLN1187           HG1      GLN1187 -17.209   8.037   1.277
  644   1HE2  GLN1187          1HE2      GLN1187 -14.333   8.526   1.362
  645   2HE2  GLN1187          2HE2      GLN1187 -14.138  10.241   1.327
  646    H    LYS1188           HN       LYS1188 -16.372   7.406   4.962
  647    HA   LYS1188           HA       LYS1188 -14.581   6.024   5.429
  648   1HB   LYS1188           HB2      LYS1188 -16.438   5.665   7.166
  649   2HB   LYS1188           HB1      LYS1188 -16.746   4.142   6.347
  650   1HG   LYS1188           HG2      LYS1188 -14.029   4.866   7.400
  651   2HG   LYS1188           HG1      LYS1188 -15.252   4.084   8.402
  652   1HD   LYS1188           HD2      LYS1188 -15.359   2.219   6.826
  653   2HD   LYS1188           HD1      LYS1188 -14.144   3.004   5.812
  654   1HE   LYS1188           HE2      LYS1188 -12.532   2.877   7.648
  655   2HE   LYS1188           HE1      LYS1188 -13.745   2.093   8.660
  656   1HZ   LYS1188           HZ1      LYS1188 -13.808   0.253   7.096
  657   2HZ   LYS1188           HZ3      LYS1188 -12.642   1.004   6.127
  658   3HZ   LYS1188           HZ2      LYS1188 -12.239   0.482   7.684
  659    H    LEU1189           HN       LEU1189 -13.759   5.440   3.396
  660    HA   LEU1189           HA       LEU1189 -14.258   2.665   2.651
  661   1HB   LEU1189           HB2      LEU1189 -14.122   3.946   0.204
  662   2HB   LEU1189           HB1      LEU1189 -15.531   3.192   0.925
  663    HG   LEU1189           HG       LEU1189 -15.371   5.761   2.057
  664   1HD1  LEU1189          2HD1      LEU1189 -14.985   5.835  -0.929
  665   2HD1  LEU1189          1HD1      LEU1189 -15.402   7.210   0.093
  666   3HD1  LEU1189          3HD1      LEU1189 -13.841   6.412   0.282
  667   1HD2  LEU1189          2HD2      LEU1189 -17.361   4.388   1.512
  668   2HD2  LEU1189          1HD2      LEU1189 -17.488   6.072   0.996
  669   3HD2  LEU1189          3HD2      LEU1189 -17.134   4.811  -0.185
  670    H    TYR1190           HN       TYR1190 -12.124   5.124   3.218
  671    HA   TYR1190           HA       TYR1190 -10.146   4.185   1.287
  672   1HB   TYR1190           HB2      TYR1190 -10.260   6.579   3.103
  673   2HB   TYR1190           HB1      TYR1190  -8.788   6.120   2.254
  674    HD1  TYR1190           HD1      TYR1190 -11.741   5.322   0.383
  675    HD2  TYR1190           HD2      TYR1190  -9.058   8.496   1.339
  676    HE1  TYR1190           HE1      TYR1190 -12.491   6.562  -1.605
  677    HE2  TYR1190           HE2      TYR1190  -9.808   9.736  -0.644
  678    HH   TYR1190           HH       TYR1190 -10.855   9.277  -2.816
  679    H    SER1191           HN       SER1191  -9.246   2.359   1.937
  680    HA   SER1191           HA       SER1191  -7.916   2.348   4.566
  681   1HB   SER1191           HB2      SER1191  -9.458   0.189   3.205
  682   2HB   SER1191           HB1      SER1191  -8.151  -0.238   4.299
  683    HG   SER1191           HG       SER1191 -10.533   0.179   5.040
  684    H    ARG1192           HN       ARG1192  -5.914   1.184   4.678
  685    HA   ARG1192           HA       ARG1192  -4.277   1.549   2.397
  686   1HB   ARG1192           HB2      ARG1192  -3.833   0.127   5.025
  687   2HB   ARG1192           HB1      ARG1192  -2.588   0.308   3.806
  688   1HG   ARG1192           HG2      ARG1192  -2.773   2.747   3.989
  689   2HG   ARG1192           HG1      ARG1192  -3.997   2.542   5.245
  690   1HD   ARG1192           HD2      ARG1192  -1.146   1.565   5.382
  691   2HD   ARG1192           HD1      ARG1192  -1.786   2.992   6.199
  692    HE   ARG1192           HE       ARG1192  -3.313   0.751   6.930
  693   1HH1  ARG1192          1HH1      ARG1192  -0.128   2.091   7.382
  694   2HH1  ARG1192          2HH1      ARG1192   0.104   1.348   8.929
  695   1HH2  ARG1192          1HH2      ARG1192  -3.016  -0.230   8.966
  696   2HH2  ARG1192          2HH2      ARG1192  -1.537   0.028   9.829
  697    H    THR1193           HN       THR1193  -4.029   0.219   0.715
  698    HA   THR1193           HA       THR1193  -5.476  -1.936   0.084
  699    HB   THR1193           HB       THR1193  -2.551  -1.516  -0.559
  700    HG1  THR1193           HG1      THR1193  -3.410  -0.718  -2.499
  701   1HG2  THR1193          1HG2      THR1193  -3.236  -3.917  -0.780
  702   2HG2  THR1193          3HG2      THR1193  -4.440  -3.403  -1.963
  703   3HG2  THR1193          2HG2      THR1193  -2.722  -3.161  -2.288
  704    H    GLY1194           HN       GLY1194  -5.873  -3.831   0.943
  705   1HA   GLY1194           HA1      GLY1194  -3.820  -5.050   2.683
  706   2HA   GLY1194           HA2      GLY1194  -4.824  -6.003   1.595
  707    H    GLU1195           HN       GLU1195  -6.098  -3.268   3.305
  708    HA   GLU1195           HA       GLU1195  -7.186  -4.827   5.476
  709   1HB   GLU1195           HB2      GLU1195  -7.521  -1.934   4.662
  710   2HB   GLU1195           HB1      GLU1195  -8.311  -2.643   6.065
  711   1HG   GLU1195           HG2      GLU1195  -5.338  -2.460   5.617
  712   2HG   GLU1195           HG1      GLU1195  -6.294  -1.427   6.680
  713    H    SER1196           HN       SER1196  -9.454  -5.066   5.896
  714    HA   SER1196           HA       SER1196 -10.982  -5.414   3.430
  715   1HB   SER1196           HB2      SER1196 -12.477  -6.813   4.788
  716   2HB   SER1196           HB1      SER1196 -10.801  -7.340   4.944
  717    HG   SER1196           HG       SER1196 -10.778  -5.982   6.897
  718    H    VAL1197           HN       VAL1197 -12.684  -4.207   2.896
  719    HA   VAL1197           HA       VAL1197 -13.766  -2.358   4.922
  720    HB   VAL1197           HB       VAL1197 -13.492  -1.870   1.950
  721   1HG1  VAL1197          3HG1      VAL1197 -14.591  -0.094   4.128
  722   2HG1  VAL1197          2HG1      VAL1197 -14.330   0.380   2.449
  723   3HG1  VAL1197          1HG1      VAL1197 -15.521  -0.861   2.840
  724   1HG2  VAL1197          2HG2      VAL1197 -12.078  -0.606   4.296
  725   2HG2  VAL1197          1HG2      VAL1197 -11.364  -1.706   3.117
  726   3HG2  VAL1197          3HG2      VAL1197 -11.919  -0.110   2.611
  727    H    GLU1198           HN       GLU1198 -15.540  -3.484   5.545
  728    HA   GLU1198           HA       GLU1198 -17.336  -4.591   3.532
  729   1HB   GLU1198           HB2      GLU1198 -17.311  -6.160   5.169
  730   2HB   GLU1198           HB1      GLU1198 -16.856  -5.006   6.412
  731   1HG   GLU1198           HG2      GLU1198 -19.136  -4.262   6.632
  732   2HG   GLU1198           HG1      GLU1198 -19.632  -5.289   5.282
  733    H    PHE1199           HN       PHE1199 -18.886  -3.337   2.696
  734    HA   PHE1199           HA       PHE1199 -19.853  -1.058   4.256
  735   1HB   PHE1199           HB2      PHE1199 -20.770  -1.720   1.473
  736   2HB   PHE1199           HB1      PHE1199 -20.706  -0.154   2.265
  737    HD1  PHE1199           HD1      PHE1199 -18.890   1.268   1.953
  738    HD2  PHE1199           HD2      PHE1199 -18.590  -2.825   0.834
  739    HE1  PHE1199           HE1      PHE1199 -16.756   1.742   0.817
  740    HE2  PHE1199           HE2      PHE1199 -16.464  -2.369  -0.292
  741    HZ   PHE1199           HZ       PHE1199 -15.536  -0.085  -0.302
  742    H    VAL1200           HN       VAL1200 -21.580  -1.394   5.544
  743    HA   VAL1200           HA       VAL1200 -23.299  -3.641   5.281
  744    HB   VAL1200           HB       VAL1200 -24.708  -2.582   6.980
  745   1HG1  VAL1200          1HG1      VAL1200 -21.761  -2.334   7.565
  746   2HG1  VAL1200          3HG1      VAL1200 -23.043  -2.422   8.773
  747   3HG1  VAL1200          2HG1      VAL1200 -22.737  -3.796   7.711
  748   1HG2  VAL1200          1HG2      VAL1200 -24.589  -0.282   6.200
  749   2HG2  VAL1200          3HG2      VAL1200 -24.131  -0.388   7.900
  750   3HG2  VAL1200          2HG2      VAL1200 -22.889  -0.199   6.662
  751    H    CYS1201           HN       CYS1201 -25.877  -2.541   5.599
  752    HA   CYS1201           HA       CYS1201 -26.249  -1.242   2.983
  753   1HB   CYS1201           HB2      CYS1201 -27.897  -3.454   4.203
  754   2HB   CYS1201           HB1      CYS1201 -28.423  -2.496   2.824
  755    H    LYS1202           HN       LYS1202 -26.137  -0.294   5.848
  756    HA   LYS1202           HA       LYS1202 -27.112   1.329   7.094
  757   1HB   LYS1202           HB2      LYS1202 -27.207   2.797   5.334
  758   2HB   LYS1202           HB1      LYS1202 -28.258   1.763   4.381
  759   1HG   LYS1202           HG2      LYS1202 -30.014   2.351   6.223
  760   2HG   LYS1202           HG1      LYS1202 -28.948   3.732   6.500
  761   1HD   LYS1202           HD2      LYS1202 -29.094   4.252   4.067
  762   2HD   LYS1202           HD1      LYS1202 -30.287   2.955   3.908
  763   1HE   LYS1202           HE2      LYS1202 -31.769   4.101   5.454
  764   2HE   LYS1202           HE1      LYS1202 -30.569   5.370   5.698
  765   1HZ   LYS1202           HZ2      LYS1202 -31.902   4.742   3.119
  766   2HZ   LYS1202           HZ1      LYS1202 -32.290   6.040   4.133
  767   3HZ   LYS1202           HZ3      LYS1202 -30.776   5.978   3.377
  768    H    ARG1203           HN       ARG1203 -28.302   0.823   8.735
  769    HA   ARG1203           HA       ARG1203 -29.811  -0.448   9.955
  770   1HB   ARG1203           HB2      ARG1203 -31.976   0.833   9.876
  771   2HB   ARG1203           HB1      ARG1203 -30.529   1.779  10.165
  772   1HG   ARG1203           HG2      ARG1203 -30.495   2.521   7.883
  773   2HG   ARG1203           HG1      ARG1203 -31.875   1.491   7.497
  774   1HD   ARG1203           HD2      ARG1203 -33.235   2.767   9.120
  775   2HD   ARG1203           HD1      ARG1203 -31.857   3.832   9.399
  776    HE   ARG1203           HE       ARG1203 -32.518   3.706   6.640
  777   1HH1  ARG1203          1HH1      ARG1203 -33.516   5.112   9.669
  778   2HH1  ARG1203          2HH1      ARG1203 -34.267   6.487   8.930
  779   1HH2  ARG1203          1HH2      ARG1203 -33.504   5.513   5.660
  780   2HH2  ARG1203          2HH2      ARG1203 -34.260   6.715   6.652
  781    H    GLY1204           HN       GLY1204 -29.428  -2.131   7.872
  782   1HA   GLY1204           HA1      GLY1204 -32.189  -3.011   7.323
  783   2HA   GLY1204           HA2      GLY1204 -30.819  -4.091   7.517
  784    H    TYR1205           HN       TYR1205 -32.883  -2.860   5.332
  785    HA   TYR1205           HA       TYR1205 -33.003  -2.824   3.071
  786   1HB   TYR1205           HB2      TYR1205 -30.228  -1.791   3.515
  787   2HB   TYR1205           HB1      TYR1205 -30.770  -2.134   1.880
  788    HD1  TYR1205           HD1      TYR1205 -31.172   0.042   4.793
  789    HD2  TYR1205           HD2      TYR1205 -32.494  -0.772   0.842
  790    HE1  TYR1205           HE1      TYR1205 -32.250   2.250   4.707
  791    HE2  TYR1205           HE2      TYR1205 -33.583   1.427   0.741
  792    HH   TYR1205           HH       TYR1205 -32.999   3.870   3.027
  793    H    ARG1206           HN       ARG1206 -33.283  -4.641   1.997
  794    HA   ARG1206           HA       ARG1206 -31.607  -6.923   2.471
  795   1HB   ARG1206           HB2      ARG1206 -33.161  -8.093   0.936
  796   2HB   ARG1206           HB1      ARG1206 -33.976  -7.273   2.260
  797   1HG   ARG1206           HG2      ARG1206 -35.334  -6.650   0.558
  798   2HG   ARG1206           HG1      ARG1206 -34.158  -5.338   0.463
  799   1HD   ARG1206           HD2      ARG1206 -32.947  -6.554  -1.284
  800   2HD   ARG1206           HD1      ARG1206 -34.129  -7.860  -1.191
  801    HE   ARG1206           HE       ARG1206 -35.507  -5.485  -1.691
  802   1HH1  ARG1206          1HH1      ARG1206 -33.206  -7.576  -3.265
  803   2HH1  ARG1206          2HH1      ARG1206 -33.745  -7.178  -4.864
  804   1HH2  ARG1206          1HH2      ARG1206 -36.222  -4.957  -3.790
  805   2HH2  ARG1206          2HH2      ARG1206 -35.458  -5.689  -5.161
  806    H    LEU1207           HN       LEU1207 -30.124  -7.849   1.206
  807    HA   LEU1207           HA       LEU1207 -28.748  -6.364  -0.716
  808   1HB   LEU1207           HB2      LEU1207 -27.902  -8.330   0.634
  809   2HB   LEU1207           HB1      LEU1207 -28.736  -9.371  -0.503
  810    HG   LEU1207           HG       LEU1207 -27.333  -8.283  -2.327
  811   1HD1  LEU1207          3HD1      LEU1207 -26.645  -6.308  -1.062
  812   2HD1  LEU1207          2HD1      LEU1207 -25.760  -7.336   0.067
  813   3HD1  LEU1207          1HD1      LEU1207 -25.248  -7.232  -1.618
  814   1HD2  LEU1207          1HD2      LEU1207 -25.933  -9.867  -0.177
  815   2HD2  LEU1207          3HD2      LEU1207 -26.900 -10.530  -1.494
  816   3HD2  LEU1207          2HD2      LEU1207 -25.391  -9.688  -1.846
  817    H    SER1208           HN       SER1208 -29.056  -6.018  -2.820
  818    HA   SER1208           HA       SER1208 -31.388  -6.990  -4.129
  819   1HB   SER1208           HB2      SER1208 -30.519  -4.772  -4.632
  820   2HB   SER1208           HB1      SER1208 -29.008  -5.468  -5.216
  821    HG   SER1208           HG       SER1208 -30.149  -5.201  -7.031
  822    H    SER1209           HN       SER1209 -28.485  -8.446  -3.541
  823    HA   SER1209           HA       SER1209 -27.625 -10.449  -4.193
  824   1HB   SER1209           HB2      SER1209 -29.901 -11.244  -4.608
  825   2HB   SER1209           HB1      SER1209 -29.887 -10.492  -6.203
  826    HG   SER1209           HG       SER1209 -29.370 -12.650  -6.438
  827    H    ARG1210           HN       ARG1210 -28.726  -8.629  -7.061
  828    HA   ARG1210           HA       ARG1210 -26.594  -9.394  -8.720
  829   1HB   ARG1210           HB2      ARG1210 -27.276  -7.537 -10.153
  830   2HB   ARG1210           HB1      ARG1210 -28.680  -8.423  -9.574
  831   1HG   ARG1210           HG2      ARG1210 -29.065  -6.699  -7.879
  832   2HG   ARG1210           HG1      ARG1210 -27.670  -5.803  -8.487
  833   1HD   ARG1210           HD2      ARG1210 -29.745  -4.889  -9.378
  834   2HD   ARG1210           HD1      ARG1210 -28.757  -5.582 -10.664
  835    HE   ARG1210           HE       ARG1210 -30.504  -7.567  -9.827
  836   1HH1  ARG1210          1HH1      ARG1210 -30.687  -4.412 -11.295
  837   2HH1  ARG1210          2HH1      ARG1210 -32.155  -4.753 -12.149
  838   1HH2  ARG1210          1HH2      ARG1210 -32.436  -8.024 -10.947
  839   2HH2  ARG1210          2HH2      ARG1210 -33.149  -6.806 -11.951
  840    H    SER1211           HN       SER1211 -26.647  -7.380  -6.025
  841    HA   SER1211           HA       SER1211 -24.761  -5.410  -6.696
  842   1HB   SER1211           HB2      SER1211 -25.409  -6.676  -4.023
  843   2HB   SER1211           HB1      SER1211 -24.408  -5.238  -4.225
  844    HG   SER1211           HG       SER1211 -26.464  -4.532  -3.835
  845    H    HIS1212           HN       HIS1212 -22.551  -5.273  -5.665
  846    HA   HIS1212           HA       HIS1212 -21.105  -7.739  -6.280
  847   1HB   HIS1212           HB2      HIS1212 -20.227  -4.862  -6.037
  848   2HB   HIS1212           HB1      HIS1212 -19.086  -6.194  -6.199
  849    HD1  HIS1212           HD1      HIS1212 -21.789  -4.396  -8.110
  850    HD2  HIS1212           HD2      HIS1212 -18.771  -7.177  -8.752
  851    HE1  HIS1212           HE1      HIS1212 -21.637  -4.658 -10.607
  852    HE2  HIS1212           HE2      HIS1212 -19.741  -6.277 -10.974
  853    H    THR1213           HN       THR1213 -22.078  -8.462  -4.117
  854    HA   THR1213           HA       THR1213 -21.833  -9.022  -1.929
  855    HB   THR1213           HB       THR1213 -19.578  -9.471  -1.148
  856    HG1  THR1213           HG1      THR1213 -17.856  -8.861  -2.758
  857   1HG2  THR1213          3HG2      THR1213 -20.555 -11.034  -2.752
  858   2HG2  THR1213          2HG2      THR1213 -19.895 -10.090  -4.087
  859   3HG2  THR1213          1HG2      THR1213 -18.810 -10.919  -2.973
  860    H    LEU1214           HN       LEU1214 -20.600  -8.346   0.215
  861    HA   LEU1214           HA       LEU1214 -20.946  -5.434   0.468
  862   1HB   LEU1214           HB2      LEU1214 -21.221  -7.639   2.509
  863   2HB   LEU1214           HB1      LEU1214 -21.346  -5.929   2.876
  864    HG   LEU1214           HG       LEU1214 -23.139  -7.070   0.783
  865   1HD1  LEU1214          1HD1      LEU1214 -23.294  -8.662   2.622
  866   2HD1  LEU1214          3HD1      LEU1214 -23.595  -7.341   3.750
  867   3HD1  LEU1214          2HD1      LEU1214 -24.768  -7.702   2.483
  868   1HD2  LEU1214          2HD2      LEU1214 -22.970  -4.628   1.341
  869   2HD2  LEU1214          1HD2      LEU1214 -24.590  -5.322   1.472
  870   3HD2  LEU1214          3HD2      LEU1214 -23.637  -5.019   2.926
  871    H    ARG1215           HN       ARG1215 -19.096  -8.116   1.896
  872    HA   ARG1215           HA       ARG1215 -17.036  -6.302   2.816
  873   1HB   ARG1215           HB2      ARG1215 -17.758  -8.278   4.151
  874   2HB   ARG1215           HB1      ARG1215 -17.100  -9.324   2.900
  875   1HG   ARG1215           HG2      ARG1215 -14.870  -8.375   3.303
  876   2HG   ARG1215           HG1      ARG1215 -15.547  -7.379   4.595
  877   1HD   ARG1215           HD2      ARG1215 -15.529 -10.394   4.500
  878   2HD   ARG1215           HD1      ARG1215 -14.477  -9.383   5.490
  879    HE   ARG1215           HE       ARG1215 -17.119  -8.716   6.087
  880   1HH1  ARG1215          1HH1      ARG1215 -14.952 -11.427   6.403
  881   2HH1  ARG1215          2HH1      ARG1215 -15.727 -12.047   7.822
  882   1HH2  ARG1215          1HH2      ARG1215 -18.145  -9.525   7.956
  883   2HH2  ARG1215          2HH2      ARG1215 -17.542 -10.965   8.705
  884    H    THR1216           HN       THR1216 -15.265  -5.767   1.715
  885    HA   THR1216           HA       THR1216 -14.359  -7.538  -0.451
  886    HB   THR1216           HB       THR1216 -15.507  -5.799  -1.601
  887    HG1  THR1216           HG1      THR1216 -12.863  -4.840  -1.729
  888   1HG2  THR1216          1HG2      THR1216 -15.644  -4.171   0.216
  889   2HG2  THR1216          3HG2      THR1216 -13.919  -3.838   0.055
  890   3HG2  THR1216          2HG2      THR1216 -15.024  -3.420  -1.254
  891    H    THR1217           HN       THR1217 -12.160  -6.630  -1.298
  892    HA   THR1217           HA       THR1217 -10.468  -6.056   1.048
  893    HB   THR1217           HB       THR1217  -9.985  -7.873  -1.301
  894    HG1  THR1217           HG1      THR1217  -9.168  -9.080   0.733
  895   1HG2  THR1217          1HG2      THR1217  -8.030  -6.345  -1.038
  896   2HG2  THR1217          3HG2      THR1217  -7.863  -6.916   0.624
  897   3HG2  THR1217          2HG2      THR1217  -7.652  -8.039  -0.719
  898    H    CYS1218           HN       CYS1218  -8.987  -4.457   0.901
  899    HA   CYS1218           HA       CYS1218  -9.198  -2.604  -1.270
  900   1HB   CYS1218           HB2      CYS1218  -7.241  -2.665   1.039
  901   2HB   CYS1218           HB1      CYS1218  -7.529  -1.296  -0.032
  902    H    TRP1219           HN       TRP1219  -8.166  -2.829  -3.159
  903    HA   TRP1219           HA       TRP1219  -5.391  -3.553  -3.236
  904   1HB   TRP1219           HB2      TRP1219  -7.045  -5.694  -3.203
  905   2HB   TRP1219           HB1      TRP1219  -6.971  -5.383  -4.935
  906    HD1  TRP1219           HD1      TRP1219  -4.582  -5.684  -6.138
  907    HE1  TRP1219           HE1      TRP1219  -2.497  -7.026  -5.448
  908    HE3  TRP1219           HE3      TRP1219  -5.680  -6.444  -1.200
  909    HZ2  TRP1219           HZ2      TRP1219  -1.455  -8.240  -3.143
  910    HZ3  TRP1219           HZ3      TRP1219  -4.082  -7.709   0.178
  911    HH2  TRP1219           HH2      TRP1219  -2.011  -8.590  -0.774
  912    H    ASP1220           HN       ASP1220  -4.456  -2.493  -4.825
  913    HA   ASP1220           HA       ASP1220  -4.068  -1.416  -6.789
  914   1HB   ASP1220           HB2      ASP1220  -5.042  -3.423  -7.850
  915   2HB   ASP1220           HB1      ASP1220  -6.641  -2.693  -7.732
  916    H    GLY1221           HN       GLY1221  -6.669  -0.802  -4.817
  917   1HA   GLY1221           HA1      GLY1221  -7.038   1.826  -6.093
  918   2HA   GLY1221           HA2      GLY1221  -7.262   1.489  -4.386
  919    H    LYS1222           HN       LYS1222  -8.621  -0.975  -6.219
  920    HA   LYS1222           HA       LYS1222 -11.264   0.333  -6.103
  921   1HB   LYS1222           HB2      LYS1222 -10.445  -0.233  -8.406
  922   2HB   LYS1222           HB1      LYS1222 -10.462  -1.927  -7.932
  923   1HG   LYS1222           HG2      LYS1222 -12.972  -1.207  -7.256
  924   2HG   LYS1222           HG1      LYS1222 -12.683  -0.139  -8.630
  925   1HD   LYS1222           HD2      LYS1222 -12.281  -3.128  -8.652
  926   2HD   LYS1222           HD1      LYS1222 -13.706  -2.296  -9.279
  927   1HE   LYS1222           HE2      LYS1222 -12.301  -1.100 -10.886
  928   2HE   LYS1222           HE1      LYS1222 -10.877  -1.930 -10.261
  929   1HZ   LYS1222           HZ2      LYS1222 -13.206  -3.243 -11.554
  930   2HZ   LYS1222           HZ1      LYS1222 -11.703  -2.972 -12.279
  931   3HZ   LYS1222           HZ3      LYS1222 -11.830  -4.031 -10.965
  932    H    LEU1223           HN       LEU1223 -13.066  -0.963  -5.494
  933    HA   LEU1223           HA       LEU1223 -12.568  -3.629  -4.500
  934   1HB   LEU1223           HB2      LEU1223 -13.423  -3.111  -2.231
  935   2HB   LEU1223           HB1      LEU1223 -11.824  -2.495  -2.593
  936    HG   LEU1223           HG       LEU1223 -14.326  -0.818  -2.665
  937   1HD1  LEU1223          3HD1      LEU1223 -12.245  -1.171  -0.531
  938   2HD1  LEU1223          2HD1      LEU1223 -13.500   0.071  -0.523
  939   3HD1  LEU1223          1HD1      LEU1223 -13.941  -1.636  -0.435
  940   1HD2  LEU1223          2HD2      LEU1223 -11.401  -0.153  -2.829
  941   2HD2  LEU1223          1HD2      LEU1223 -12.649   0.147  -4.041
  942   3HD2  LEU1223          3HD2      LEU1223 -12.668   1.037  -2.518
  943    H    GLU1224           HN       GLU1224 -14.478  -4.757  -3.845
  944    HA   GLU1224           HA       GLU1224 -16.586  -4.632  -5.555
  945   1HB   GLU1224           HB2      GLU1224 -16.461  -5.679  -2.737
  946   2HB   GLU1224           HB1      GLU1224 -17.897  -5.861  -3.733
  947   1HG   GLU1224           HG2      GLU1224 -16.605  -7.868  -3.850
  948   2HG   GLU1224           HG1      GLU1224 -16.541  -7.053  -5.413
  949    H    TYR1225           HN       TYR1225 -18.948  -4.278  -4.977
  950    HA   TYR1225           HA       TYR1225 -19.366  -1.919  -3.296
  951   1HB   TYR1225           HB2      TYR1225 -19.248  -1.900  -6.177
  952   2HB   TYR1225           HB1      TYR1225 -20.859  -1.448  -5.637
  953    HD1  TYR1225           HD1      TYR1225 -20.727   0.252  -3.501
  954    HD2  TYR1225           HD2      TYR1225 -17.829  -0.156  -6.586
  955    HE1  TYR1225           HE1      TYR1225 -19.973   2.554  -3.090
  956    HE2  TYR1225           HE2      TYR1225 -17.070   2.145  -6.186
  957    HH   TYR1225           HH       TYR1225 -17.935   4.220  -5.230
  958    HA   PRO1226           HA       PRO1226 -23.109  -4.351  -2.705
  959   1HB   PRO1226           HB2      PRO1226 -23.617  -2.908  -0.306
  960   2HB   PRO1226           HB1      PRO1226 -22.910  -4.516  -0.459
  961   1HG   PRO1226           HG2      PRO1226 -21.581  -2.267   0.474
  962   2HG   PRO1226           HG1      PRO1226 -20.802  -3.736  -0.135
  963   1HD   PRO1226           HD2      PRO1226 -21.294  -1.135  -1.525
  964   2HD   PRO1226           HD1      PRO1226 -19.891  -2.224  -1.625
  965    H    THR1227           HN       THR1227 -25.414  -3.813  -2.349
  966    HA   THR1227           HA       THR1227 -26.355  -1.129  -2.477
  967    HB   THR1227           HB       THR1227 -26.567  -2.710  -5.055
  968    HG1  THR1227           HG1      THR1227 -24.794  -1.696  -5.572
  969   1HG2  THR1227          2HG2      THR1227 -28.564  -1.380  -4.589
  970   2HG2  THR1227          1HG2      THR1227 -27.564   0.050  -4.338
  971   3HG2  THR1227          3HG2      THR1227 -27.653  -0.694  -5.934
  972    H    CYS1228           HN       CYS1228 -27.543  -2.132  -0.729
  973    HA   CYS1228           HA       CYS1228 -29.405  -4.250  -1.323
  974   1HB   CYS1228           HB2      CYS1228 -28.842  -2.582   1.116
  975   2HB   CYS1228           HB1      CYS1228 -30.232  -3.662   1.044
  976    H    ALA1229           HN       ALA1229 -31.724  -3.666  -0.152
  977    HA   ALA1229           HA       ALA1229 -32.724  -1.130  -1.138
  978   1HB   ALA1229           HB3      ALA1229 -33.800  -3.730  -2.219
  979   2HB   ALA1229           HB2      ALA1229 -34.432  -2.119  -2.558
  980   3HB   ALA1229           HB1      ALA1229 -32.820  -2.570  -3.115
  981    H    LYS1230           HN       LYS1230 -34.576  -0.467  -0.198
  982    HA   LYS1230           HA       LYS1230 -35.956  -0.181   1.569
  983   1HB   LYS1230           HB2      LYS1230 -37.760  -1.839   1.728
  984   2HB   LYS1230           HB1      LYS1230 -37.399  -1.409   0.064
  985   1HG   LYS1230           HG2      LYS1230 -36.015  -3.493  -0.073
  986   2HG   LYS1230           HG1      LYS1230 -36.664  -3.939   1.506
  987   1HD   LYS1230           HD2      LYS1230 -38.925  -3.894   0.618
  988   2HD   LYS1230           HD1      LYS1230 -38.315  -3.375  -0.954
  989   1HE   LYS1230           HE2      LYS1230 -37.051  -5.468  -1.145
  990   2HE   LYS1230           HE1      LYS1230 -37.686  -5.987   0.416
  991   1HZ   LYS1230           HZ3      LYS1230 -39.918  -5.924  -0.511
  992   2HZ   LYS1230           HZ2      LYS1230 -39.308  -5.429  -2.009
  993   3HZ   LYS1230           HZ1      LYS1230 -38.928  -6.964  -1.407
  994    H    ARG1231           HN       ARG1231 -34.896   0.035   3.386
  995    HA   ARG1231           HA       ARG1231 -33.420  -1.678   4.858
  996   1HB   ARG1231           HB2      ARG1231 -33.581  -0.167   6.598
  997   2HB   ARG1231           HB1      ARG1231 -34.052   0.823   5.237
  998   1HG   ARG1231           HG2      ARG1231 -36.360   0.654   5.791
  999   2HG   ARG1231           HG1      ARG1231 -36.026  -0.550   7.038
 1000   1HD   ARG1231           HD2      ARG1231 -34.982   2.277   7.084
 1001   2HD   ARG1231           HD1      ARG1231 -36.442   1.746   7.916
 1002    HE   ARG1231           HE       ARG1231 -33.925   0.387   8.524
 1003   1HH1  ARG1231          1HH1      ARG1231 -36.456   2.582   9.483
 1004   2HH1  ARG1231          2HH1      ARG1231 -36.026   2.548  11.161
 1005   1HH2  ARG1231          1HH2      ARG1231 -33.353   0.337  10.730
 1006   2HH2  ARG1231          2HH2      ARG1231 -34.262   1.273  11.869

  No H/Q in entry =        1006
  Start of MODEL   14
    1    H1   GLU1103           HT3      GLU1103  40.046  -3.619   4.666
    2    H2   GLU1103           HT2      GLU1103  39.219  -5.047   5.037
    3    H3   GLU1103           HT1      GLU1103  39.932  -4.855   3.516
    4    HA   GLU1103           HA       GLU1103  37.565  -4.563   3.358
    5   1HB   GLU1103           HB2      GLU1103  36.599  -2.503   4.484
    6   2HB   GLU1103           HB1      GLU1103  36.976  -3.857   5.540
    7   1HG   GLU1103           HG2      GLU1103  37.676  -1.874   6.632
    8   2HG   GLU1103           HG1      GLU1103  39.125  -2.725   6.101
    9    H    ALA1104           HN       ALA1104  36.509  -2.334   2.501
   10    HA   ALA1104           HA       ALA1104  38.584  -0.884   1.005
   11   1HB   ALA1104           HB3      ALA1104  37.663  -2.623  -0.450
   12   2HB   ALA1104           HB1      ALA1104  37.248  -1.009  -1.027
   13   3HB   ALA1104           HB2      ALA1104  36.041  -1.982  -0.187
   14    H    GLU1105           HN       GLU1105  37.935   1.205   0.221
   15    HA   GLU1105           HA       GLU1105  36.048   2.493   2.022
   16   1HB   GLU1105           HB2      GLU1105  37.935   3.670  -0.027
   17   2HB   GLU1105           HB1      GLU1105  36.963   4.596   1.109
   18   1HG   GLU1105           HG2      GLU1105  38.165   3.576   2.973
   19   2HG   GLU1105           HG1      GLU1105  39.135   2.642   1.836
   20    H    PHE1106           HN       PHE1106  36.273   1.478  -1.268
   21    HA   PHE1106           HA       PHE1106  34.032   3.140  -2.109
   22   1HB   PHE1106           HB2      PHE1106  35.653   1.100  -3.647
   23   2HB   PHE1106           HB1      PHE1106  34.420   2.152  -4.335
   24    HD1  PHE1106           HD1      PHE1106  34.829   4.523  -4.632
   25    HD2  PHE1106           HD2      PHE1106  37.821   1.951  -3.039
   26    HE1  PHE1106           HE1      PHE1106  36.528   6.257  -5.034
   27    HE2  PHE1106           HE2      PHE1106  39.526   3.679  -3.437
   28    HZ   PHE1106           HZ       PHE1106  38.880   5.836  -4.436
   29    H    GLY1107           HN       GLY1107  32.591   1.646  -3.784
   30   1HA   GLY1107           HA1      GLY1107  31.914  -0.944  -2.943
   31   2HA   GLY1107           HA2      GLY1107  30.901   0.109  -3.912
   32    H    LYS1108           HN       LYS1108  30.705   2.214  -1.947
   33    HA   LYS1108           HA       LYS1108  29.333   0.912   0.287
   34   1HB   LYS1108           HB2      LYS1108  29.763   3.871  -0.145
   35   2HB   LYS1108           HB1      LYS1108  29.268   3.074   1.339
   36   1HG   LYS1108           HG2      LYS1108  31.462   1.943   1.427
   37   2HG   LYS1108           HG1      LYS1108  31.955   2.862   0.003
   38   1HD   LYS1108           HD2      LYS1108  31.026   4.110   2.585
   39   2HD   LYS1108           HD1      LYS1108  32.721   3.837   2.171
   40   1HE   LYS1108           HE2      LYS1108  32.471   5.259   0.199
   41   2HE   LYS1108           HE1      LYS1108  30.774   5.524   0.601
   42   1HZ   LYS1108           HZ1      LYS1108  33.088   6.329   2.280
   43   2HZ   LYS1108           HZ3      LYS1108  32.155   7.368   1.324
   44   3HZ   LYS1108           HZ2      LYS1108  31.461   6.589   2.656
   45    H    CYS1109           HN       CYS1109  27.160   1.093   0.658
   46    HA   CYS1109           HA       CYS1109  25.551   1.592  -1.651
   47   1HB   CYS1109           HB2      CYS1109  24.628   1.063   1.174
   48   2HB   CYS1109           HB1      CYS1109  23.689   0.875  -0.303
   49    H    GLY1110           HN       GLY1110  23.550   2.898  -1.463
   50   1HA   GLY1110           HA1      GLY1110  23.784   5.499  -1.580
   51   2HA   GLY1110           HA2      GLY1110  23.845   5.311   0.168
   52    HA   PRO1111           HA       PRO1111  19.440   6.101  -0.111
   53   1HB   PRO1111           HB2      PRO1111  18.786   7.137  -2.642
   54   2HB   PRO1111           HB1      PRO1111  19.139   8.070  -1.186
   55   1HG   PRO1111           HG2      PRO1111  20.906   7.399  -3.482
   56   2HG   PRO1111           HG1      PRO1111  20.876   8.854  -2.471
   57   1HD   PRO1111           HD2      PRO1111  22.785   6.986  -2.196
   58   2HD   PRO1111           HD1      PRO1111  22.137   7.867  -0.796
   59    HA   PRO1112           HA       PRO1112  18.775   2.051  -2.063
   60   1HB   PRO1112           HB2      PRO1112  16.474   1.580  -0.604
   61   2HB   PRO1112           HB1      PRO1112  18.111   1.159  -0.089
   62   1HG   PRO1112           HG2      PRO1112  16.438   3.522   0.645
   63   2HG   PRO1112           HG1      PRO1112  17.521   2.552   1.661
   64   1HD   PRO1112           HD2      PRO1112  18.247   4.961   0.732
   65   2HD   PRO1112           HD1      PRO1112  19.418   3.634   0.887
   66    HA   PRO1113           HA       PRO1113  16.040   3.897  -5.248
   67   1HB   PRO1113           HB2      PRO1113  16.238   1.001  -5.990
   68   2HB   PRO1113           HB1      PRO1113  16.296   2.428  -7.030
   69   1HG   PRO1113           HG2      PRO1113  18.530   1.134  -6.346
   70   2HG   PRO1113           HG1      PRO1113  18.496   2.901  -6.484
   71   1HD   PRO1113           HD2      PRO1113  18.642   1.202  -4.065
   72   2HD   PRO1113           HD1      PRO1113  19.200   2.866  -4.311
   73    HA   PRO1114           HA       PRO1114  12.539   2.196  -2.904
   74   1HB   PRO1114           HB2      PRO1114  10.981   4.339  -2.989
   75   2HB   PRO1114           HB1      PRO1114  12.450   4.340  -2.002
   76   1HG   PRO1114           HG2      PRO1114  12.025   5.452  -4.759
   77   2HG   PRO1114           HG1      PRO1114  12.769   6.240  -3.354
   78   1HD   PRO1114           HD2      PRO1114  14.214   5.034  -5.328
   79   2HD   PRO1114           HD1      PRO1114  14.771   5.132  -3.644
   80    H    ILE1115           HN       ILE1115  10.051   2.588  -3.373
   81    HA   ILE1115           HA       ILE1115   9.582   1.708  -6.141
   82    HB   ILE1115           HB       ILE1115   7.313   1.003  -4.998
   83   1HG1  ILE1115          2HG1      ILE1115   9.254   1.140  -2.677
   84   2HG1  ILE1115          1HG1      ILE1115   7.752   2.043  -2.843
   85   1HG2  ILE1115          2HG2      ILE1115   9.914  -0.476  -4.651
   86   2HG2  ILE1115          1HG2      ILE1115   8.315  -1.198  -4.469
   87   3HG2  ILE1115          3HG2      ILE1115   8.822  -0.558  -6.034
   88   1HD1  ILE1115          3HD1      ILE1115   7.936  -0.948  -2.607
   89   2HD1  ILE1115          2HD1      ILE1115   7.589   0.157  -1.276
   90   3HD1  ILE1115          1HD1      ILE1115   6.464   0.024  -2.631
   91    H    ASP1116           HN       ASP1116   7.088   2.156  -6.675
   92    HA   ASP1116           HA       ASP1116   6.837   4.932  -7.028
   93   1HB   ASP1116           HB2      ASP1116   5.728   3.299  -8.500
   94   2HB   ASP1116           HB1      ASP1116   4.686   2.804  -7.169
   95    H    ASN1117           HN       ASN1117   6.749   6.230  -5.286
   96    HA   ASN1117           HA       ASN1117   5.876   7.303  -3.473
   97   1HB   ASN1117           HB2      ASN1117   3.579   5.348  -3.768
   98   2HB   ASN1117           HB1      ASN1117   3.578   6.787  -2.746
   99   1HD2  ASN1117          1HD2      ASN1117   1.856   6.035  -4.994
  100   2HD2  ASN1117          2HD2      ASN1117   1.974   7.330  -6.131
  101    H    GLY1118           HN       GLY1118   7.681   5.062  -3.262
  102   1HA   GLY1118           HA1      GLY1118   8.003   3.154  -1.796
  103   2HA   GLY1118           HA2      GLY1118   6.847   3.879  -0.692
  104    H    ASP1119           HN       ASP1119   9.146   3.023   0.339
  105    HA   ASP1119           HA       ASP1119  11.408   4.534   0.457
  106   1HB   ASP1119           HB2      ASP1119   9.855   6.468   0.941
  107   2HB   ASP1119           HB1      ASP1119   9.437   5.671   2.454
  108    H    ILE1120           HN       ILE1120  12.513   4.378   2.723
  109    HA   ILE1120           HA       ILE1120  12.383   1.711   3.570
  110    HB   ILE1120           HB       ILE1120  13.369   3.275   5.741
  111   1HG1  ILE1120          2HG1      ILE1120  13.468   5.071   3.959
  112   2HG1  ILE1120          1HG1      ILE1120  14.993   4.695   4.745
  113   1HG2  ILE1120          3HG2      ILE1120  14.122   1.051   5.159
  114   2HG2  ILE1120          2HG2      ILE1120  14.774   1.649   3.632
  115   3HG2  ILE1120          1HG2      ILE1120  15.481   2.176   5.160
  116   1HD1  ILE1120          1HD1      ILE1120  15.643   3.344   2.822
  117   2HD1  ILE1120          3HD1      ILE1120  14.114   3.737   2.036
  118   3HD1  ILE1120          2HD1      ILE1120  15.287   5.011   2.368
  119    H    THR1121           HN       THR1121  11.607   0.776   5.505
  120    HA   THR1121           HA       THR1121   9.078   1.838   6.349
  121    HB   THR1121           HB       THR1121   8.974  -0.176   7.805
  122    HG1  THR1121           HG1      THR1121  10.785  -1.160   8.253
  123   1HG2  THR1121          3HG2      THR1121   9.769  -0.679   4.931
  124   2HG2  THR1121          2HG2      THR1121   8.912  -1.821   5.968
  125   3HG2  THR1121          1HG2      THR1121   8.151  -0.296   5.516
  126    H    SER1122           HN       SER1122  11.743   3.163   7.032
  127    HA   SER1122           HA       SER1122  11.071   3.709   9.824
  128   1HB   SER1122           HB2      SER1122  12.914   2.020   9.804
  129   2HB   SER1122           HB1      SER1122  13.906   3.168   8.910
  130    HG   SER1122           HG       SER1122  14.118   3.097  11.301
  131    H    PHE1123           HN       PHE1123  13.851   4.614   7.826
  132    HA   PHE1123           HA       PHE1123  12.801   7.254   7.303
  133   1HB   PHE1123           HB2      PHE1123  13.702   7.381   9.639
  134   2HB   PHE1123           HB1      PHE1123  15.288   6.962   9.000
  135    HD1  PHE1123           HD1      PHE1123  16.663   8.579   7.961
  136    HD2  PHE1123           HD2      PHE1123  12.649   9.535   9.002
  137    HE1  PHE1123           HE1      PHE1123  17.121  10.957   7.529
  138    HE2  PHE1123           HE2      PHE1123  13.099  11.914   8.571
  139    HZ   PHE1123           HZ       PHE1123  15.337  12.629   7.834
  140    HA   PRO1124           HA       PRO1124  15.363   6.601   3.738
  141   1HB   PRO1124           HB2      PRO1124  15.470   9.158   2.809
  142   2HB   PRO1124           HB1      PRO1124  14.050   8.121   2.634
  143   1HG   PRO1124           HG2      PRO1124  14.599  10.260   4.658
  144   2HG   PRO1124           HG1      PRO1124  13.107   9.928   3.758
  145   1HD   PRO1124           HD2      PRO1124  13.445   9.144   6.317
  146   2HD   PRO1124           HD1      PRO1124  12.503   8.189   5.156
  147    H    LEU1125           HN       LEU1125  17.497   6.495   3.392
  148    HA   LEU1125           HA       LEU1125  19.254   8.282   4.949
  149   1HB   LEU1125           HB2      LEU1125  19.495   5.397   4.183
  150   2HB   LEU1125           HB1      LEU1125  20.944   6.329   4.487
  151    HG   LEU1125           HG       LEU1125  20.086   4.952   6.418
  152   1HD1  LEU1125          2HD1      LEU1125  20.362   7.928   6.801
  153   2HD1  LEU1125          1HD1      LEU1125  20.515   6.714   8.072
  154   3HD1  LEU1125          3HD1      LEU1125  21.674   6.749   6.742
  155   1HD2  LEU1125          2HD2      LEU1125  17.665   5.552   5.967
  156   2HD2  LEU1125          1HD2      LEU1125  18.199   5.635   7.651
  157   3HD2  LEU1125          3HD2      LEU1125  18.023   7.115   6.709
  158    H    SER1126           HN       SER1126  21.618   7.689   3.790
  159    HA   SER1126           HA       SER1126  21.408   8.222   0.927
  160   1HB   SER1126           HB2      SER1126  23.009   9.938   2.848
  161   2HB   SER1126           HB1      SER1126  23.028  10.075   1.089
  162    HG   SER1126           HG       SER1126  20.581  10.234   2.446
  163    H    VAL1127           HN       VAL1127  22.856   6.928   3.669
  164    HA   VAL1127           HA       VAL1127  24.770   5.424   2.070
  165    HB   VAL1127           HB       VAL1127  25.641   6.701   4.663
  166   1HG1  VAL1127          1HG1      VAL1127  26.707   4.570   3.833
  167   2HG1  VAL1127          3HG1      VAL1127  27.307   5.502   2.462
  168   3HG1  VAL1127          2HG1      VAL1127  27.809   5.923   4.100
  169   1HG2  VAL1127          2HG2      VAL1127  25.209   8.446   2.974
  170   2HG2  VAL1127          1HG2      VAL1127  26.921   8.306   3.383
  171   3HG2  VAL1127          3HG2      VAL1127  26.317   7.625   1.872
  172    H    TYR1128           HN       TYR1128  24.292   3.368   2.496
  173    HA   TYR1128           HA       TYR1128  23.366   2.676   5.206
  174   1HB   TYR1128           HB2      TYR1128  22.477   1.801   2.512
  175   2HB   TYR1128           HB1      TYR1128  22.505   0.575   3.773
  176    HD1  TYR1128           HD1      TYR1128  20.506   2.951   2.207
  177    HD2  TYR1128           HD2      TYR1128  21.379   1.384   6.064
  178    HE1  TYR1128           HE1      TYR1128  18.309   3.710   3.005
  179    HE2  TYR1128           HE2      TYR1128  19.184   2.140   6.875
  180    HH   TYR1128           HH       TYR1128  16.712   3.177   4.787
  181    H    ALA1129           HN       ALA1129  26.066   2.776   3.916
  182    HA   ALA1129           HA       ALA1129  28.017   1.572   3.892
  183   1HB   ALA1129           HB3      ALA1129  27.327   1.293   6.273
  184   2HB   ALA1129           HB2      ALA1129  26.600  -0.251   5.827
  185   3HB   ALA1129           HB1      ALA1129  28.339  -0.013   5.657
  186    HA   PRO1130           HA       PRO1130  27.562  -1.719   0.975
  187   1HB   PRO1130           HB2      PRO1130  29.849  -3.122   1.270
  188   2HB   PRO1130           HB1      PRO1130  29.813  -1.505   0.561
  189   1HG   PRO1130           HG2      PRO1130  30.531  -2.337   3.347
  190   2HG   PRO1130           HG1      PRO1130  31.333  -1.160   2.290
  191   1HD   PRO1130           HD2      PRO1130  29.622  -0.444   4.281
  192   2HD   PRO1130           HD1      PRO1130  29.826   0.504   2.795
  193    H    ALA1131           HN       ALA1131  26.880  -3.818   0.735
  194    HA   ALA1131           HA       ALA1131  26.013  -5.841   1.296
  195   1HB   ALA1131           HB3      ALA1131  28.343  -6.358   1.845
  196   2HB   ALA1131           HB1      ALA1131  27.218  -7.207   2.904
  197   3HB   ALA1131           HB2      ALA1131  28.078  -5.785   3.491
  198    H    SER1132           HN       SER1132  24.496  -3.760   2.167
  199    HA   SER1132           HA       SER1132  23.565  -4.685   4.809
  200   1HB   SER1132           HB2      SER1132  22.702  -2.407   5.194
  201   2HB   SER1132           HB1      SER1132  24.451  -2.409   4.952
  202    HG   SER1132           HG       SER1132  24.069  -1.769   2.788
  203    H    SER1133           HN       SER1133  21.265  -4.537   5.195
  204    HA   SER1133           HA       SER1133  19.586  -4.375   2.799
  205   1HB   SER1133           HB2      SER1133  18.935  -6.576   4.686
  206   2HB   SER1133           HB1      SER1133  18.757  -6.498   2.935
  207    HG   SER1133           HG       SER1133  20.484  -7.686   2.918
  208    H    VAL1134           HN       VAL1134  17.307  -4.074   3.279
  209    HA   VAL1134           HA       VAL1134  16.582  -3.514   6.026
  210    HB   VAL1134           HB       VAL1134  17.659  -1.406   4.963
  211   1HG1  VAL1134          2HG1      VAL1134  14.936  -1.348   3.694
  212   2HG1  VAL1134          1HG1      VAL1134  15.998   0.055   3.828
  213   3HG1  VAL1134          3HG1      VAL1134  16.498  -1.343   2.873
  214   1HG2  VAL1134          1HG2      VAL1134  16.537  -1.452   7.123
  215   2HG2  VAL1134          3HG2      VAL1134  16.209   0.046   6.252
  216   3HG2  VAL1134          2HG2      VAL1134  14.985  -1.222   6.317
  217    H    GLU1135           HN       GLU1135  14.308  -2.215   5.769
  218    HA   GLU1135           HA       GLU1135  12.654  -3.952   4.056
  219   1HB   GLU1135           HB2      GLU1135  12.420  -4.335   6.513
  220   2HB   GLU1135           HB1      GLU1135  11.867  -2.675   6.681
  221   1HG   GLU1135           HG2      GLU1135   9.958  -3.165   5.237
  222   2HG   GLU1135           HG1      GLU1135  10.509  -4.832   5.083
  223    H    TYR1136           HN       TYR1136  10.835  -3.024   3.031
  224    HA   TYR1136           HA       TYR1136  10.837  -0.084   2.996
  225   1HB   TYR1136           HB2      TYR1136  11.349  -1.937   0.820
  226   2HB   TYR1136           HB1      TYR1136  10.019  -0.840   0.453
  227    HD1  TYR1136           HD1      TYR1136  13.473  -0.747   1.883
  228    HD2  TYR1136           HD2      TYR1136  10.524   1.197  -0.486
  229    HE1  TYR1136           HE1      TYR1136  15.079   1.039   1.359
  230    HE2  TYR1136           HE2      TYR1136  12.121   2.983  -1.017
  231    HH   TYR1136           HH       TYR1136  14.150   3.975  -0.061
  232    H    GLN1137           HN       GLN1137   8.871   0.848   2.020
  233    HA   GLN1137           HA       GLN1137   6.466  -0.702   1.946
  234   1HB   GLN1137           HB2      GLN1137   5.326   0.353   3.817
  235   2HB   GLN1137           HB1      GLN1137   6.768  -0.477   4.388
  236   1HG   GLN1137           HG2      GLN1137   7.940   1.557   4.672
  237   2HG   GLN1137           HG1      GLN1137   6.708   2.467   3.798
  238   1HE2  GLN1137          1HE2      GLN1137   7.528   0.889   6.784
  239   2HE2  GLN1137          2HE2      GLN1137   6.260   1.579   7.732
  240    H    CYS1138           HN       CYS1138   4.574   1.224   2.265
  241    HA   CYS1138           HA       CYS1138   5.381   3.324   0.362
  242   1HB   CYS1138           HB2      CYS1138   2.621   2.120   0.451
  243   2HB   CYS1138           HB1      CYS1138   3.347   3.098  -0.822
  244    H    GLN1139           HN       GLN1139   4.594   5.371   0.695
  245    HA   GLN1139           HA       GLN1139   3.864   6.047   3.356
  246   1HB   GLN1139           HB2      GLN1139   3.720   8.354   2.500
  247   2HB   GLN1139           HB1      GLN1139   5.210   7.557   2.015
  248   1HG   GLN1139           HG2      GLN1139   4.266   7.132  -0.196
  249   2HG   GLN1139           HG1      GLN1139   2.773   7.935   0.290
  250   1HE2  GLN1139          1HE2      GLN1139   6.116   8.357  -0.548
  251   2HE2  GLN1139          2HE2      GLN1139   6.057  10.069  -0.767
  252    H    ASN1140           HN       ASN1140   2.014   7.928   3.375
  253    HA   ASN1140           HA       ASN1140  -0.231   8.156   3.708
  254   1HB   ASN1140           HB2      ASN1140   0.347   8.461   1.105
  255   2HB   ASN1140           HB1      ASN1140  -0.808   7.135   0.989
  256   1HD2  ASN1140          1HD2      ASN1140  -2.230   8.066   3.406
  257   2HD2  ASN1140          2HD2      ASN1140  -3.169   9.420   2.890
  258    H    LEU1141           HN       LEU1141  -2.374   6.786   2.447
  259    HA   LEU1141           HA       LEU1141  -2.545   4.508   4.172
  260   1HB   LEU1141           HB2      LEU1141  -4.441   5.476   2.034
  261   2HB   LEU1141           HB1      LEU1141  -4.804   4.257   3.243
  262    HG   LEU1141           HG       LEU1141  -4.092   7.110   3.920
  263   1HD1  LEU1141          2HD1      LEU1141  -6.811   5.834   3.665
  264   2HD1  LEU1141          1HD1      LEU1141  -6.486   7.446   4.303
  265   3HD1  LEU1141          3HD1      LEU1141  -6.141   7.080   2.613
  266   1HD2  LEU1141          1HD2      LEU1141  -5.335   4.891   5.541
  267   2HD2  LEU1141          3HD2      LEU1141  -3.688   5.502   5.703
  268   3HD2  LEU1141          2HD2      LEU1141  -5.057   6.543   6.093
  269    H    TYR1142           HN       TYR1142  -0.743   4.670   1.601
  270    HA   TYR1142           HA       TYR1142  -1.712   2.481   0.011
  271   1HB   TYR1142           HB2      TYR1142   0.938   3.936   0.064
  272   2HB   TYR1142           HB1      TYR1142   0.563   2.640  -1.068
  273    HD1  TYR1142           HD1      TYR1142  -0.463   6.039  -0.001
  274    HD2  TYR1142           HD2      TYR1142  -0.642   3.071  -3.043
  275    HE1  TYR1142           HE1      TYR1142  -1.476   7.677  -1.531
  276    HE2  TYR1142           HE2      TYR1142  -1.654   4.701  -4.582
  277    HH   TYR1142           HH       TYR1142  -2.935   6.797  -4.464
  278    H    GLN1143           HN       GLN1143  -0.622   0.438  -0.254
  279    HA   GLN1143           HA       GLN1143   0.975  -0.381   2.078
  280   1HB   GLN1143           HB2      GLN1143  -1.605  -1.070   1.911
  281   2HB   GLN1143           HB1      GLN1143  -0.925  -2.354   0.923
  282   1HG   GLN1143           HG2      GLN1143  -0.081  -1.714   3.740
  283   2HG   GLN1143           HG1      GLN1143  -1.208  -2.989   3.282
  284   1HE2  GLN1143          1HE2      GLN1143   2.096  -1.959   3.319
  285   2HE2  GLN1143          2HE2      GLN1143   2.792  -3.480   2.886
  286    H    LEU1144           HN       LEU1144   2.799  -1.382   1.554
  287    HA   LEU1144           HA       LEU1144   3.559  -1.783  -1.137
  288   1HB   LEU1144           HB2      LEU1144   5.111  -1.270   0.739
  289   2HB   LEU1144           HB1      LEU1144   4.857  -2.890   1.353
  290    HG   LEU1144           HG       LEU1144   5.897  -2.521  -1.437
  291   1HD1  LEU1144          2HD1      LEU1144   7.298  -1.096  -0.040
  292   2HD1  LEU1144          1HD1      LEU1144   7.556  -2.436   1.079
  293   3HD1  LEU1144          3HD1      LEU1144   8.176  -2.532  -0.570
  294   1HD2  LEU1144          1HD2      LEU1144   5.218  -4.755  -0.619
  295   2HD2  LEU1144          3HD2      LEU1144   6.936  -4.658  -1.004
  296   3HD2  LEU1144          2HD2      LEU1144   6.405  -4.613   0.677
  297    H    GLU1145           HN       GLU1145   4.122  -3.713  -2.197
  298    HA   GLU1145           HA       GLU1145   2.897  -6.174  -1.178
  299   1HB   GLU1145           HB2      GLU1145   1.308  -5.149  -2.755
  300   2HB   GLU1145           HB1      GLU1145   2.562  -5.097  -3.986
  301   1HG   GLU1145           HG2      GLU1145   1.045  -6.951  -4.358
  302   2HG   GLU1145           HG1      GLU1145   2.672  -7.528  -3.997
  303    H    GLY1146           HN       GLY1146   4.179  -7.906  -1.387
  304   1HA   GLY1146           HA1      GLY1146   6.352  -7.835  -3.371
  305   2HA   GLY1146           HA2      GLY1146   5.710  -9.285  -2.612
  306    H    ASN1147           HN       ASN1147   8.373  -9.080  -2.641
  307    HA   ASN1147           HA       ASN1147   9.045  -9.092   0.117
  308   1HB   ASN1147           HB2      ASN1147  11.413  -9.370  -0.761
  309   2HB   ASN1147           HB1      ASN1147  10.251 -10.599  -1.256
  310   1HD2  ASN1147          1HD2      ASN1147  12.272  -7.995  -2.271
  311   2HD2  ASN1147          2HD2      ASN1147  12.054  -8.207  -3.971
  312    H    LYS1148           HN       LYS1148   8.581  -7.044   0.908
  313    HA   LYS1148           HA       LYS1148   9.607  -4.644  -0.166
  314   1HB   LYS1148           HB2      LYS1148   8.834  -3.605   1.847
  315   2HB   LYS1148           HB1      LYS1148   7.657  -4.819   1.370
  316   1HG   LYS1148           HG2      LYS1148   9.742  -5.133   3.519
  317   2HG   LYS1148           HG1      LYS1148   8.027  -4.811   3.777
  318   1HD   LYS1148           HD2      LYS1148   7.487  -6.948   2.687
  319   2HD   LYS1148           HD1      LYS1148   9.212  -7.265   2.488
  320   1HE   LYS1148           HE2      LYS1148   9.499  -7.216   4.918
  321   2HE   LYS1148           HE1      LYS1148   7.776  -6.898   5.117
  322   1HZ   LYS1148           HZ3      LYS1148   8.950  -9.337   3.895
  323   2HZ   LYS1148           HZ2      LYS1148   8.292  -9.233   5.450
  324   3HZ   LYS1148           HZ1      LYS1148   7.297  -9.032   4.097
  325    H    ARG1149           HN       ARG1149  11.026  -7.116   1.752
  326    HA   ARG1149           HA       ARG1149  13.122  -5.403   2.795
  327   1HB   ARG1149           HB2      ARG1149  12.359  -7.254   4.187
  328   2HB   ARG1149           HB1      ARG1149  12.760  -8.403   2.918
  329   1HG   ARG1149           HG2      ARG1149  15.081  -8.040   3.188
  330   2HG   ARG1149           HG1      ARG1149  14.810  -6.636   4.222
  331   1HD   ARG1149           HD2      ARG1149  15.460  -8.568   5.549
  332   2HD   ARG1149           HD1      ARG1149  13.805  -8.084   5.920
  333    HE   ARG1149           HE       ARG1149  13.693 -10.042   3.941
  334   1HH1  ARG1149          1HH1      ARG1149  14.658  -9.735   7.275
  335   2HH1  ARG1149          2HH1      ARG1149  14.293 -11.381   7.666
  336   1HH2  ARG1149          1HH2      ARG1149  13.208 -12.212   4.448
  337   2HH2  ARG1149          2HH2      ARG1149  13.469 -12.789   6.060
  338    H    ILE1150           HN       ILE1150  14.600  -4.708   1.399
  339    HA   ILE1150           HA       ILE1150  15.539  -6.601  -0.649
  340    HB   ILE1150           HB       ILE1150  15.936  -4.861  -2.150
  341   1HG1  ILE1150          2HG1      ILE1150  17.055  -3.328  -0.544
  342   2HG1  ILE1150          1HG1      ILE1150  15.936  -2.498  -1.618
  343   1HG2  ILE1150          2HG2      ILE1150  13.410  -4.237  -0.628
  344   2HG2  ILE1150          1HG2      ILE1150  13.788  -3.606  -2.232
  345   3HG2  ILE1150          3HG2      ILE1150  13.594  -5.343  -1.990
  346   1HD1  ILE1150          2HD1      ILE1150  14.267  -2.470   0.184
  347   2HD1  ILE1150          1HD1      ILE1150  15.445  -3.230   1.255
  348   3HD1  ILE1150          3HD1      ILE1150  15.753  -1.618   0.608
  349    H    THR1151           HN       THR1151  17.822  -5.463  -1.487
  350    HA   THR1151           HA       THR1151  19.552  -4.867   0.746
  351    HB   THR1151           HB       THR1151  20.005  -7.414  -0.820
  352    HG1  THR1151           HG1      THR1151  18.584  -8.119   0.610
  353   1HG2  THR1151          1HG2      THR1151  22.071  -6.308  -0.120
  354   2HG2  THR1151          3HG2      THR1151  21.480  -6.240   1.539
  355   3HG2  THR1151          2HG2      THR1151  21.815  -7.799   0.786
  356    H    CYS1152           HN       CYS1152  21.365  -3.795   0.105
  357    HA   CYS1152           HA       CYS1152  21.522  -3.060  -2.685
  358   1HB   CYS1152           HB2      CYS1152  22.000  -1.159  -1.554
  359   2HB   CYS1152           HB1      CYS1152  22.602  -2.024  -0.144
  360    H    ARG1153           HN       ARG1153  23.217  -3.373  -4.039
  361    HA   ARG1153           HA       ARG1153  25.161  -5.422  -3.223
  362   1HB   ARG1153           HB2      ARG1153  25.399  -5.780  -5.730
  363   2HB   ARG1153           HB1      ARG1153  23.895  -6.318  -4.997
  364   1HG   ARG1153           HG2      ARG1153  24.021  -3.594  -6.184
  365   2HG   ARG1153           HG1      ARG1153  23.889  -4.995  -7.249
  366   1HD   ARG1153           HD2      ARG1153  22.009  -4.259  -5.007
  367   2HD   ARG1153           HD1      ARG1153  21.687  -4.115  -6.735
  368    HE   ARG1153           HE       ARG1153  21.928  -6.637  -5.241
  369   1HH1  ARG1153          1HH1      ARG1153  20.975  -4.865  -8.086
  370   2HH1  ARG1153          2HH1      ARG1153  20.110  -6.195  -8.781
  371   1HH2  ARG1153          1HH2      ARG1153  20.791  -8.392  -6.149
  372   2HH2  ARG1153          2HH2      ARG1153  20.005  -8.200  -7.680
  373    H    ASN1154           HN       ASN1154  26.977  -4.452  -2.653
  374    HA   ASN1154           HA       ASN1154  28.858  -3.182  -2.724
  375   1HB   ASN1154           HB2      ASN1154  28.024  -2.597  -5.573
  376   2HB   ASN1154           HB1      ASN1154  29.597  -2.227  -4.872
  377   1HD2  ASN1154          1HD2      ASN1154  28.893  -3.923  -7.141
  378   2HD2  ASN1154          2HD2      ASN1154  29.537  -5.486  -6.783
  379    H    GLY1155           HN       GLY1155  27.310  -1.068  -5.020
  380   1HA   GLY1155           HA1      GLY1155  27.614   1.340  -4.190
  381   2HA   GLY1155           HA2      GLY1155  26.618   0.795  -2.850
  382    H    GLN1156           HN       GLN1156  24.623  -0.595  -3.928
  383    HA   GLN1156           HA       GLN1156  22.869   1.318  -4.939
  384   1HB   GLN1156           HB2      GLN1156  24.226   1.175  -6.988
  385   2HB   GLN1156           HB1      GLN1156  23.926  -0.555  -7.067
  386   1HG   GLN1156           HG2      GLN1156  21.539  -0.128  -7.355
  387   2HG   GLN1156           HG1      GLN1156  21.842   1.606  -7.280
  388   1HE2  GLN1156          1HE2      GLN1156  21.021   1.959  -9.332
  389   2HE2  GLN1156          2HE2      GLN1156  21.865   1.481 -10.761
  390    H    TRP1157           HN       TRP1157  21.038   0.594  -4.076
  391    HA   TRP1157           HA       TRP1157  20.616  -2.171  -3.460
  392   1HB   TRP1157           HB2      TRP1157  18.700   0.159  -3.340
  393   2HB   TRP1157           HB1      TRP1157  18.407  -1.433  -2.659
  394    HD1  TRP1157           HD1      TRP1157  20.879   1.506  -2.189
  395    HE1  TRP1157           HE1      TRP1157  21.486   1.600   0.302
  396    HE3  TRP1157           HE3      TRP1157  18.398  -2.655  -0.626
  397    HZ2  TRP1157           HZ2      TRP1157  20.994   0.052   2.648
  398    HZ3  TRP1157           HZ3      TRP1157  18.513  -3.296   1.740
  399    HH2  TRP1157           HH2      TRP1157  19.782  -1.977   3.338
  400    H    SER1158           HN       SER1158  18.151  -2.794  -3.843
  401    HA   SER1158           HA       SER1158  17.605  -2.618  -6.729
  402   1HB   SER1158           HB2      SER1158  17.290  -4.956  -4.841
  403   2HB   SER1158           HB1      SER1158  16.541  -4.895  -6.435
  404    HG   SER1158           HG       SER1158  19.090  -5.483  -5.762
  405    H    GLU1159           HN       GLU1159  15.801  -1.539  -7.120
  406    HA   GLU1159           HA       GLU1159  14.036  -0.475  -5.336
  407   1HB   GLU1159           HB2      GLU1159  14.023   0.238  -7.625
  408   2HB   GLU1159           HB1      GLU1159  13.550  -1.362  -8.179
  409   1HG   GLU1159           HG2      GLU1159  11.383  -1.107  -7.099
  410   2HG   GLU1159           HG1      GLU1159  11.856   0.487  -6.515
  411    HA   PRO1160           HA       PRO1160  11.790  -3.895  -3.604
  412   1HB   PRO1160           HB2      PRO1160   9.612  -1.933  -3.203
  413   2HB   PRO1160           HB1      PRO1160  10.454  -2.935  -2.019
  414   1HG   PRO1160           HG2      PRO1160  10.885  -0.300  -2.183
  415   2HG   PRO1160           HG1      PRO1160  12.188  -1.432  -1.783
  416   1HD   PRO1160           HD2      PRO1160  11.623  -0.022  -4.359
  417   2HD   PRO1160           HD1      PRO1160  13.177  -0.409  -3.593
  418    HA   PRO1161           HA       PRO1161   8.932  -5.540  -6.524
  419   1HB   PRO1161           HB2      PRO1161   6.826  -5.580  -4.418
  420   2HB   PRO1161           HB1      PRO1161   7.382  -6.879  -5.477
  421   1HG   PRO1161           HG2      PRO1161   8.119  -6.813  -2.924
  422   2HG   PRO1161           HG1      PRO1161   9.266  -7.301  -4.185
  423   1HD   PRO1161           HD2      PRO1161   9.074  -4.726  -2.686
  424   2HD   PRO1161           HD1      PRO1161  10.512  -5.599  -3.253
  425    H    LYS1162           HN       LYS1162   6.376  -4.031  -4.571
  426    HA   LYS1162           HA       LYS1162   6.171  -1.661  -6.107
  427   1HB   LYS1162           HB2      LYS1162   5.528  -3.511  -7.767
  428   2HB   LYS1162           HB1      LYS1162   4.051  -3.665  -6.826
  429   1HG   LYS1162           HG2      LYS1162   3.486  -1.355  -7.277
  430   2HG   LYS1162           HG1      LYS1162   4.997  -1.142  -8.166
  431   1HD   LYS1162           HD2      LYS1162   4.254  -2.915  -9.740
  432   2HD   LYS1162           HD1      LYS1162   2.705  -2.962  -8.895
  433   1HE   LYS1162           HE2      LYS1162   3.882  -0.531 -10.228
  434   2HE   LYS1162           HE1      LYS1162   2.649  -1.573 -10.935
  435   1HZ   LYS1162           HZ1      LYS1162   2.360  -0.007  -8.427
  436   2HZ   LYS1162           HZ3      LYS1162   1.672   0.387  -9.922
  437   3HZ   LYS1162           HZ2      LYS1162   1.175  -1.007  -9.104
  438    H    CYS1163           HN       CYS1163   4.091  -0.505  -5.753
  439    HA   CYS1163           HA       CYS1163   3.100  -1.066  -3.054
  440   1HB   CYS1163           HB2      CYS1163   3.091   1.407  -4.779
  441   2HB   CYS1163           HB1      CYS1163   2.135   1.292  -3.306
  442    H    LEU1164           HN       LEU1164   0.767  -0.499  -2.659
  443    HA   LEU1164           HA       LEU1164  -0.941  -1.144  -4.960
  444   1HB   LEU1164           HB2      LEU1164  -1.151  -2.363  -2.206
  445   2HB   LEU1164           HB1      LEU1164  -2.348  -2.548  -3.471
  446    HG   LEU1164           HG       LEU1164   0.475  -3.603  -3.486
  447   1HD1  LEU1164          2HD1      LEU1164  -2.199  -4.989  -3.478
  448   2HD1  LEU1164          1HD1      LEU1164  -0.627  -5.782  -3.575
  449   3HD1  LEU1164          3HD1      LEU1164  -1.074  -4.887  -2.122
  450   1HD2  LEU1164          3HD2      LEU1164  -0.139  -2.824  -5.720
  451   2HD2  LEU1164          2HD2      LEU1164  -0.062  -4.584  -5.656
  452   3HD2  LEU1164          1HD2      LEU1164  -1.626  -3.769  -5.643
  453    H    HIS1165           HN       HIS1165  -2.427   0.363  -5.238
  454    HA   HIS1165           HA       HIS1165  -2.842   2.530  -3.537
  455   1HB   HIS1165           HB2      HIS1165  -4.793   1.430  -5.573
  456   2HB   HIS1165           HB1      HIS1165  -4.760   3.072  -4.937
  457    HD1  HIS1165           HD1      HIS1165  -2.994   0.798  -7.326
  458    HD2  HIS1165           HD2      HIS1165  -2.846   4.758  -6.074
  459    HE1  HIS1165           HE1      HIS1165  -1.495   1.967  -8.971
  460    HE2  HIS1165           HE2      HIS1165  -1.346   4.341  -8.140
  461    HA   PRO1166           HA       PRO1166  -5.280   0.838  -0.244
  462   1HB   PRO1166           HB2      PRO1166  -6.599   3.169   0.441
  463   2HB   PRO1166           HB1      PRO1166  -4.974   2.739   0.984
  464   1HG   PRO1166           HG2      PRO1166  -5.812   4.521  -1.269
  465   2HG   PRO1166           HG1      PRO1166  -4.511   4.750  -0.083
  466   1HD   PRO1166           HD2      PRO1166  -3.984   3.927  -2.573
  467   2HD   PRO1166           HD1      PRO1166  -3.085   3.278  -1.184
  468    H    CYS1167           HN       CYS1167  -7.644   0.959   0.512
  469    HA   CYS1167           HA       CYS1167  -9.281   0.236  -1.735
  470   1HB   CYS1167           HB2      CYS1167 -10.862   0.412   0.612
  471   2HB   CYS1167           HB1      CYS1167 -10.257  -1.039  -0.185
  472    H    VAL1168           HN       VAL1168  -8.535   2.955  -1.809
  473    HA   VAL1168           HA       VAL1168 -10.659   4.599  -0.855
  474    HB   VAL1168           HB       VAL1168  -8.520   5.626  -1.194
  475   1HG1  VAL1168          2HG1      VAL1168  -7.655   4.173  -2.941
  476   2HG1  VAL1168          1HG1      VAL1168  -8.784   4.873  -4.101
  477   3HG1  VAL1168          3HG1      VAL1168  -7.502   5.867  -3.409
  478   1HG2  VAL1168          1HG2      VAL1168 -10.497   6.616  -3.242
  479   2HG2  VAL1168          3HG2      VAL1168 -10.442   7.061  -1.537
  480   3HG2  VAL1168          2HG2      VAL1168  -9.129   7.534  -2.614
  481    H    ILE1169           HN       ILE1169 -12.552   3.587  -1.616
  482    HA   ILE1169           HA       ILE1169 -12.987   3.235  -4.437
  483    HB   ILE1169           HB       ILE1169 -15.334   3.321  -2.635
  484   1HG1  ILE1169          2HG1      ILE1169 -13.162   1.233  -2.413
  485   2HG1  ILE1169          1HG1      ILE1169 -13.824   2.229  -1.119
  486   1HG2  ILE1169          3HG2      ILE1169 -14.372   1.397  -4.748
  487   2HG2  ILE1169          2HG2      ILE1169 -15.932   1.325  -3.930
  488   3HG2  ILE1169          1HG2      ILE1169 -15.544   2.696  -4.971
  489   1HD1  ILE1169          1HD1      ILE1169 -15.302   0.077  -2.626
  490   2HD1  ILE1169          3HD1      ILE1169 -14.651  -0.054  -0.992
  491   3HD1  ILE1169          2HD1      ILE1169 -15.968   1.070  -1.330
  492    H    SER1170           HN       SER1170 -15.765   4.150  -4.304
  493    HA   SER1170           HA       SER1170 -15.221   7.002  -4.790
  494   1HB   SER1170           HB2      SER1170 -17.451   5.256  -5.850
  495   2HB   SER1170           HB1      SER1170 -17.229   6.963  -6.230
  496    HG   SER1170           HG       SER1170 -15.952   6.306  -7.748
  497    H    ARG1171           HN       ARG1171 -16.132   8.532  -3.591
  498    HA   ARG1171           HA       ARG1171 -18.025   7.753  -1.505
  499   1HB   ARG1171           HB2      ARG1171 -17.575   9.980  -0.572
  500   2HB   ARG1171           HB1      ARG1171 -16.084   9.091  -0.851
  501   1HG   ARG1171           HG2      ARG1171 -15.713  10.353  -2.909
  502   2HG   ARG1171           HG1      ARG1171 -17.207  11.248  -2.626
  503   1HD   ARG1171           HD2      ARG1171 -14.786  11.225  -0.827
  504   2HD   ARG1171           HD1      ARG1171 -15.253  12.531  -1.915
  505    HE   ARG1171           HE       ARG1171 -17.406  12.033  -0.219
  506   1HH1  ARG1171          1HH1      ARG1171 -14.126  13.192  -0.017
  507   2HH1  ARG1171          2HH1      ARG1171 -14.428  14.193   1.364
  508   1HH2  ARG1171          1HH2      ARG1171 -17.813  13.348   1.599
  509   2HH2  ARG1171          2HH2      ARG1171 -16.523  14.280   2.283
  510    H    GLU1172           HN       GLU1172 -18.523   8.262  -4.523
  511    HA   GLU1172           HA       GLU1172 -20.839  10.038  -4.126
  512   1HB   GLU1172           HB2      GLU1172 -19.008  11.002  -5.564
  513   2HB   GLU1172           HB1      GLU1172 -19.303   9.698  -6.707
  514   1HG   GLU1172           HG2      GLU1172 -21.594  10.483  -7.014
  515   2HG   GLU1172           HG1      GLU1172 -21.299  11.790  -5.867
  516    H    ILE1173           HN       ILE1173 -20.037   6.942  -4.417
  517    HA   ILE1173           HA       ILE1173 -22.466   6.299  -5.943
  518    HB   ILE1173           HB       ILE1173 -19.773   4.973  -6.077
  519   1HG1  ILE1173          2HG1      ILE1173 -20.988   5.137  -8.588
  520   2HG1  ILE1173          1HG1      ILE1173 -21.400   6.650  -7.782
  521   1HG2  ILE1173          3HG2      ILE1173 -22.396   3.806  -6.986
  522   2HG2  ILE1173          2HG2      ILE1173 -20.798   3.164  -7.370
  523   3HG2  ILE1173          1HG2      ILE1173 -21.362   3.185  -5.698
  524   1HD1  ILE1173          1HD1      ILE1173 -19.042   7.060  -7.346
  525   2HD1  ILE1173          3HD1      ILE1173 -18.632   5.544  -8.149
  526   3HD1  ILE1173          2HD1      ILE1173 -19.359   6.862  -9.071
  527    H    MET1174           HN       MET1174 -20.206   5.236  -3.409
  528    HA   MET1174           HA       MET1174 -21.928   3.171  -2.456
  529   1HB   MET1174           HB2      MET1174 -19.447   4.502  -1.396
  530   2HB   MET1174           HB1      MET1174 -20.364   3.383  -0.397
  531   1HG   MET1174           HG2      MET1174 -19.114   1.786  -1.279
  532   2HG   MET1174           HG1      MET1174 -20.057   2.005  -2.751
  533   1HE   MET1174           HE1      MET1174 -19.181   2.805  -4.930
  534   2HE   MET1174           HE3      MET1174 -19.222   4.441  -4.272
  535   3HE   MET1174           HE2      MET1174 -17.793   3.874  -5.137
  536    H    GLU1175           HN       GLU1175 -20.823   6.178  -0.922
  537    HA   GLU1175           HA       GLU1175 -22.873   6.194   1.027
  538   1HB   GLU1175           HB2      GLU1175 -21.829   8.065   1.858
  539   2HB   GLU1175           HB1      GLU1175 -20.516   7.421   0.877
  540   1HG   GLU1175           HG2      GLU1175 -21.032   8.954  -0.906
  541   2HG   GLU1175           HG1      GLU1175 -22.436   9.555  -0.024
  542    H    ASN1176           HN       ASN1176 -23.269   6.473  -2.160
  543    HA   ASN1176           HA       ASN1176 -25.190   8.672  -2.045
  544   1HB   ASN1176           HB2      ASN1176 -23.551   7.447  -4.174
  545   2HB   ASN1176           HB1      ASN1176 -25.149   8.004  -4.648
  546   1HD2  ASN1176          1HD2      ASN1176 -24.424   9.693  -5.887
  547   2HD2  ASN1176          2HD2      ASN1176 -23.664  11.094  -5.220
  548    H    TYR1177           HN       TYR1177 -25.039   5.236  -3.126
  549    HA   TYR1177           HA       TYR1177 -27.939   5.348  -3.392
  550   1HB   TYR1177           HB2      TYR1177 -27.756   3.058  -4.388
  551   2HB   TYR1177           HB1      TYR1177 -26.982   4.348  -5.292
  552    HD1  TYR1177           HD1      TYR1177 -25.472   2.729  -2.320
  553    HD2  TYR1177           HD2      TYR1177 -25.546   2.998  -6.565
  554    HE1  TYR1177           HE1      TYR1177 -23.405   1.401  -2.440
  555    HE2  TYR1177           HE2      TYR1177 -23.482   1.677  -6.693
  556    HH   TYR1177           HH       TYR1177 -21.575   1.113  -5.296
  557    H    ASN1178           HN       ASN1178 -26.871   5.452  -0.786
  558    HA   ASN1178           HA       ASN1178 -27.784   4.810   1.201
  559   1HB   ASN1178           HB2      ASN1178 -28.855   2.387  -0.239
  560   2HB   ASN1178           HB1      ASN1178 -29.265   2.892   1.397
  561   1HD2  ASN1178          1HD2      ASN1178 -30.923   2.525  -0.987
  562   2HD2  ASN1178          2HD2      ASN1178 -31.751   4.022  -1.206
  563    H    ILE1179           HN       ILE1179 -25.018   4.024   0.392
  564    HA   ILE1179           HA       ILE1179 -24.832   1.951   2.453
  565    HB   ILE1179           HB       ILE1179 -23.470   0.481   1.317
  566   1HG1  ILE1179          2HG1      ILE1179 -23.106   2.289  -1.049
  567   2HG1  ILE1179          1HG1      ILE1179 -22.062   2.434   0.362
  568   1HG2  ILE1179          1HG2      ILE1179 -25.377   1.526  -0.764
  569   2HG2  ILE1179          3HG2      ILE1179 -24.596  -0.055  -0.790
  570   3HG2  ILE1179          2HG2      ILE1179 -25.739   0.342   0.492
  571   1HD1  ILE1179          3HD1      ILE1179 -22.461  -0.078  -1.234
  572   2HD1  ILE1179          2HD1      ILE1179 -21.101   1.030  -1.403
  573   3HD1  ILE1179          1HD1      ILE1179 -21.341   0.152   0.108
  574    H    ALA1180           HN       ALA1180 -23.137   2.078   3.796
  575    HA   ALA1180           HA       ALA1180 -21.080   4.104   3.237
  576   1HB   ALA1180           HB1      ALA1180 -21.226   4.890   5.555
  577   2HB   ALA1180           HB3      ALA1180 -22.750   5.120   4.698
  578   3HB   ALA1180           HB2      ALA1180 -22.575   3.790   5.842
  579    H    LEU1181           HN       LEU1181 -20.149   3.618   6.072
  580    HA   LEU1181           HA       LEU1181 -18.895   0.994   5.604
  581   1HB   LEU1181           HB2      LEU1181 -17.801   3.603   6.480
  582   2HB   LEU1181           HB1      LEU1181 -17.163   2.182   7.284
  583    HG   LEU1181           HG       LEU1181 -15.815   2.957   5.331
  584   1HD1  LEU1181          3HD1      LEU1181 -17.027   0.208   5.126
  585   2HD1  LEU1181          2HD1      LEU1181 -15.522   0.725   4.365
  586   3HD1  LEU1181          1HD1      LEU1181 -15.649   0.674   6.123
  587   1HD2  LEU1181          2HD2      LEU1181 -17.717   3.662   3.920
  588   2HD2  LEU1181          1HD2      LEU1181 -16.609   2.570   3.086
  589   3HD2  LEU1181          3HD2      LEU1181 -18.148   1.966   3.701
  590    H    ARG1182           HN       ARG1182 -18.023   0.036   7.736
  591    HA   ARG1182           HA       ARG1182 -20.222  -0.389   9.452
  592   1HB   ARG1182           HB2      ARG1182 -18.621  -1.669  10.850
  593   2HB   ARG1182           HB1      ARG1182 -18.572  -2.125   9.152
  594   1HG   ARG1182           HG2      ARG1182 -16.560  -0.785   8.841
  595   2HG   ARG1182           HG1      ARG1182 -16.612  -0.308  10.540
  596   1HD   ARG1182           HD2      ARG1182 -16.362  -2.645  11.208
  597   2HD   ARG1182           HD1      ARG1182 -16.319  -3.128   9.513
  598    HE   ARG1182           HE       ARG1182 -14.314  -1.215   9.987
  599   1HH1  ARG1182          1HH1      ARG1182 -15.103  -4.528  10.715
  600   2HH1  ARG1182          2HH1      ARG1182 -13.450  -5.027  10.853
  601   1HH2  ARG1182          1HH2      ARG1182 -12.134  -1.861  10.165
  602   2HH2  ARG1182          2HH2      ARG1182 -11.762  -3.511  10.541
  603    H    TRP1183           HN       TRP1183 -18.350   2.260   9.214
  604    HA   TRP1183           HA       TRP1183 -18.541   2.909  12.080
  605   1HB   TRP1183           HB2      TRP1183 -16.885   4.417  10.060
  606   2HB   TRP1183           HB1      TRP1183 -16.730   4.410  11.816
  607    HD1  TRP1183           HD1      TRP1183 -16.063   2.132   8.775
  608    HE1  TRP1183           HE1      TRP1183 -14.220   0.453   9.414
  609    HE3  TRP1183           HE3      TRP1183 -15.528   3.342  13.715
  610    HZ2  TRP1183           HZ2      TRP1183 -12.733  -0.253  11.687
  611    HZ3  TRP1183           HZ3      TRP1183 -13.866   2.114  15.053
  612    HH2  TRP1183           HH2      TRP1183 -12.497   0.352  14.059
  613    H    THR1184           HN       THR1184 -19.616   3.645   8.910
  614    HA   THR1184           HA       THR1184 -20.961   5.245   8.012
  615    HB   THR1184           HB       THR1184 -22.972   5.776   9.280
  616    HG1  THR1184           HG1      THR1184 -21.853   4.431  11.513
  617   1HG2  THR1184          3HG2      THR1184 -22.815   3.557   8.274
  618   2HG2  THR1184          2HG2      THR1184 -22.058   2.936   9.741
  619   3HG2  THR1184          1HG2      THR1184 -23.729   3.498   9.780
  620    H    ALA1185           HN       ALA1185 -19.194   6.769   7.868
  621    HA   ALA1185           HA       ALA1185 -19.762   9.189   9.395
  622   1HB   ALA1185           HB3      ALA1185 -16.983   8.033   9.198
  623   2HB   ALA1185           HB1      ALA1185 -17.985   8.064  10.648
  624   3HB   ALA1185           HB2      ALA1185 -17.420   9.574   9.935
  625    H    LYS1186           HN       LYS1186 -20.347   8.557   6.703
  626    HA   LYS1186           HA       LYS1186 -20.316   9.568   4.678
  627   1HB   LYS1186           HB2      LYS1186 -18.561  11.496   6.175
  628   2HB   LYS1186           HB1      LYS1186 -18.895  11.693   4.461
  629   1HG   LYS1186           HG2      LYS1186 -20.412  13.077   5.646
  630   2HG   LYS1186           HG1      LYS1186 -21.333  11.706   5.026
  631   1HD   LYS1186           HD2      LYS1186 -22.035  12.103   7.275
  632   2HD   LYS1186           HD1      LYS1186 -21.077  10.621   7.262
  633   1HE   LYS1186           HE2      LYS1186 -20.492  12.024   9.168
  634   2HE   LYS1186           HE1      LYS1186 -19.132  11.862   8.057
  635   1HZ   LYS1186           HZ3      LYS1186 -20.969  14.191   8.210
  636   2HZ   LYS1186           HZ2      LYS1186 -19.390  14.139   8.812
  637   3HZ   LYS1186           HZ1      LYS1186 -19.662  14.036   7.146
  638    H    GLN1187           HN       GLN1187 -19.479   8.172   3.325
  639    HA   GLN1187           HA       GLN1187 -17.997   7.227   1.881
  640   1HB   GLN1187           HB2      GLN1187 -17.040   9.444   1.543
  641   2HB   GLN1187           HB1      GLN1187 -16.071   9.275   2.998
  642   1HG   GLN1187           HG2      GLN1187 -14.862   7.408   1.954
  643   2HG   GLN1187           HG1      GLN1187 -15.808   7.640   0.485
  644   1HE2  GLN1187          1HE2      GLN1187 -13.993   8.080  -0.750
  645   2HE2  GLN1187          2HE2      GLN1187 -13.121   9.564  -0.617
  646    H    LYS1188           HN       LYS1188 -15.344   7.945   4.019
  647    HA   LYS1188           HA       LYS1188 -13.939   6.585   5.193
  648   1HB   LYS1188           HB2      LYS1188 -15.994   6.739   6.659
  649   2HB   LYS1188           HB1      LYS1188 -16.471   5.170   6.028
  650   1HG   LYS1188           HG2      LYS1188 -15.410   4.894   8.167
  651   2HG   LYS1188           HG1      LYS1188 -14.380   4.207   6.908
  652   1HD   LYS1188           HD2      LYS1188 -13.006   6.231   6.925
  653   2HD   LYS1188           HD1      LYS1188 -14.037   6.921   8.181
  654   1HE   LYS1188           HE2      LYS1188 -13.427   5.093   9.687
  655   2HE   LYS1188           HE1      LYS1188 -12.398   4.402   8.433
  656   1HZ   LYS1188           HZ2      LYS1188 -11.043   6.403   8.494
  657   2HZ   LYS1188           HZ1      LYS1188 -12.029   7.064   9.699
  658   3HZ   LYS1188           HZ3      LYS1188 -11.110   5.680  10.022
  659    H    LEU1189           HN       LEU1189 -15.156   5.580   2.470
  660    HA   LEU1189           HA       LEU1189 -14.820   2.716   2.707
  661   1HB   LEU1189           HB2      LEU1189 -14.951   3.136   0.045
  662   2HB   LEU1189           HB1      LEU1189 -16.342   2.925   1.089
  663    HG   LEU1189           HG       LEU1189 -15.565   5.692   1.049
  664   1HD1  LEU1189          2HD1      LEU1189 -16.130   4.440  -1.634
  665   2HD1  LEU1189          1HD1      LEU1189 -16.069   6.170  -1.293
  666   3HD1  LEU1189          3HD1      LEU1189 -14.612   5.187  -1.135
  667   1HD2  LEU1189          3HD2      LEU1189 -17.751   4.702   1.683
  668   2HD2  LEU1189          2HD2      LEU1189 -17.874   6.002   0.498
  669   3HD2  LEU1189          1HD2      LEU1189 -18.024   4.322  -0.017
  670    H    TYR1190           HN       TYR1190 -12.574   2.766   3.443
  671    HA   TYR1190           HA       TYR1190 -10.766   2.130   1.426
  672   1HB   TYR1190           HB2      TYR1190  -9.178   4.069   1.635
  673   2HB   TYR1190           HB1      TYR1190 -10.671   4.416   0.770
  674    HD1  TYR1190           HD1      TYR1190 -12.543   5.584   2.046
  675    HD2  TYR1190           HD2      TYR1190  -8.541   5.365   3.468
  676    HE1  TYR1190           HE1      TYR1190 -12.968   7.506   3.527
  677    HE2  TYR1190           HE2      TYR1190  -8.955   7.279   4.959
  678    HH   TYR1190           HH       TYR1190 -12.070   8.465   5.603
  679    H    SER1191           HN       SER1191  -8.488   1.996   2.204
  680    HA   SER1191           HA       SER1191  -7.742   2.139   4.901
  681   1HB   SER1191           HB2      SER1191  -9.111  -0.347   4.059
  682   2HB   SER1191           HB1      SER1191  -7.659  -0.539   5.031
  683    HG   SER1191           HG       SER1191  -8.741   0.120   6.713
  684    H    ARG1192           HN       ARG1192  -5.839   0.363   5.250
  685    HA   ARG1192           HA       ARG1192  -4.010   0.853   3.095
  686   1HB   ARG1192           HB2      ARG1192  -2.412  -0.373   4.567
  687   2HB   ARG1192           HB1      ARG1192  -3.164   1.010   5.338
  688   1HG   ARG1192           HG2      ARG1192  -4.649  -0.423   6.570
  689   2HG   ARG1192           HG1      ARG1192  -4.048  -1.842   5.709
  690   1HD   ARG1192           HD2      ARG1192  -1.831  -1.495   6.664
  691   2HD   ARG1192           HD1      ARG1192  -2.412  -0.059   7.508
  692    HE   ARG1192           HE       ARG1192  -4.040  -2.183   8.262
  693   1HH1  ARG1192          1HH1      ARG1192  -0.701  -1.227   8.549
  694   2HH1  ARG1192          2HH1      ARG1192  -0.458  -2.062  10.048
  695   1HH2  ARG1192          1HH2      ARG1192  -3.728  -3.286  10.234
  696   2HH2  ARG1192          2HH2      ARG1192  -2.178  -3.232  11.005
  697    H    THR1193           HN       THR1193  -4.023  -0.380   1.341
  698    HA   THR1193           HA       THR1193  -5.422  -2.528   0.688
  699    HB   THR1193           HB       THR1193  -2.546  -1.995  -0.044
  700    HG1  THR1193           HG1      THR1193  -3.803  -1.580  -2.108
  701   1HG2  THR1193          1HG2      THR1193  -3.054  -4.426  -0.265
  702   2HG2  THR1193          3HG2      THR1193  -4.365  -4.007  -1.369
  703   3HG2  THR1193          2HG2      THR1193  -2.693  -3.633  -1.797
  704    H    GLY1194           HN       GLY1194  -5.700  -4.569   1.296
  705   1HA   GLY1194           HA1      GLY1194  -3.577  -5.830   2.918
  706   2HA   GLY1194           HA2      GLY1194  -4.638  -6.724   1.836
  707    H    GLU1195           HN       GLU1195  -5.698  -4.125   3.930
  708    HA   GLU1195           HA       GLU1195  -6.723  -5.932   5.940
  709   1HB   GLU1195           HB2      GLU1195  -6.900  -2.933   5.602
  710   2HB   GLU1195           HB1      GLU1195  -7.638  -3.803   6.942
  711   1HG   GLU1195           HG2      GLU1195  -4.701  -3.737   6.287
  712   2HG   GLU1195           HG1      GLU1195  -5.499  -2.828   7.570
  713    H    SER1196           HN       SER1196  -8.923  -6.211   6.458
  714    HA   SER1196           HA       SER1196 -10.659  -6.184   4.147
  715   1HB   SER1196           HB2      SER1196 -12.240  -7.394   5.611
  716   2HB   SER1196           HB1      SER1196 -10.643  -8.142   5.612
  717    HG   SER1196           HG       SER1196 -11.443  -7.963   7.724
  718    H    VAL1197           HN       VAL1197 -12.324  -4.842   3.761
  719    HA   VAL1197           HA       VAL1197 -12.906  -2.793   5.799
  720    HB   VAL1197           HB       VAL1197 -13.048  -2.521   2.791
  721   1HG1  VAL1197          1HG1      VAL1197 -14.774  -1.212   3.940
  722   2HG1  VAL1197          3HG1      VAL1197 -13.531  -0.460   4.938
  723   3HG1  VAL1197          2HG1      VAL1197 -13.554  -0.179   3.197
  724   1HG2  VAL1197          1HG2      VAL1197 -10.760  -2.564   3.615
  725   2HG2  VAL1197          3HG2      VAL1197 -11.195  -0.942   3.075
  726   3HG2  VAL1197          2HG2      VAL1197 -11.148  -1.314   4.798
  727    H    GLU1198           HN       GLU1198 -14.783  -3.221   6.735
  728    HA   GLU1198           HA       GLU1198 -16.890  -4.616   5.307
  729   1HB   GLU1198           HB2      GLU1198 -16.667  -5.431   7.477
  730   2HB   GLU1198           HB1      GLU1198 -16.422  -3.830   8.160
  731   1HG   GLU1198           HG2      GLU1198 -18.737  -3.297   7.915
  732   2HG   GLU1198           HG1      GLU1198 -19.035  -4.792   7.026
  733    H    PHE1199           HN       PHE1199 -18.622  -3.697   4.419
  734    HA   PHE1199           HA       PHE1199 -19.046  -0.821   4.866
  735   1HB   PHE1199           HB2      PHE1199 -19.697  -2.617   2.532
  736   2HB   PHE1199           HB1      PHE1199 -20.374  -1.001   2.694
  737    HD1  PHE1199           HD1      PHE1199 -19.248   0.793   1.793
  738    HD2  PHE1199           HD2      PHE1199 -17.104  -2.777   2.670
  739    HE1  PHE1199           HE1      PHE1199 -17.236   1.750   0.742
  740    HE2  PHE1199           HE2      PHE1199 -15.095  -1.830   1.628
  741    HZ   PHE1199           HZ       PHE1199 -15.158   0.432   0.667
  742    H    VAL1200           HN       VAL1200 -21.311  -0.076   4.673
  743    HA   VAL1200           HA       VAL1200 -23.220  -2.022   5.789
  744    HB   VAL1200           HB       VAL1200 -24.242  -0.205   7.090
  745   1HG1  VAL1200          3HG1      VAL1200 -21.288  -0.527   7.604
  746   2HG1  VAL1200          2HG1      VAL1200 -22.477   0.045   8.774
  747   3HG1  VAL1200          1HG1      VAL1200 -22.567  -1.607   8.159
  748   1HG2  VAL1200          2HG2      VAL1200 -23.620   1.669   5.663
  749   2HG2  VAL1200          1HG2      VAL1200 -23.115   1.948   7.330
  750   3HG2  VAL1200          3HG2      VAL1200 -21.929   1.465   6.118
  751    H    CYS1201           HN       CYS1201 -25.555  -1.080   5.547
  752    HA   CYS1201           HA       CYS1201 -25.769   0.012   2.815
  753   1HB   CYS1201           HB2      CYS1201 -27.779  -1.782   4.175
  754   2HB   CYS1201           HB1      CYS1201 -27.771  -1.271   2.497
  755    H    LYS1202           HN       LYS1202 -25.620   1.515   5.286
  756    HA   LYS1202           HA       LYS1202 -26.641   3.238   6.365
  757   1HB   LYS1202           HB2      LYS1202 -26.862   4.063   4.042
  758   2HB   LYS1202           HB1      LYS1202 -28.420   3.257   3.919
  759   1HG   LYS1202           HG2      LYS1202 -29.252   4.670   5.768
  760   2HG   LYS1202           HG1      LYS1202 -27.708   5.525   5.766
  761   1HD   LYS1202           HD2      LYS1202 -28.088   6.179   3.430
  762   2HD   LYS1202           HD1      LYS1202 -29.646   5.348   3.462
  763   1HE   LYS1202           HE2      LYS1202 -30.404   6.847   5.243
  764   2HE   LYS1202           HE1      LYS1202 -28.847   7.677   5.207
  765   1HZ   LYS1202           HZ3      LYS1202 -29.293   8.333   2.924
  766   2HZ   LYS1202           HZ2      LYS1202 -30.787   7.539   2.961
  767   3HZ   LYS1202           HZ1      LYS1202 -30.518   8.883   3.953
  768    H    ARG1203           HN       ARG1203 -27.670   2.731   8.156
  769    HA   ARG1203           HA       ARG1203 -29.300   0.880   8.952
  770   1HB   ARG1203           HB2      ARG1203 -29.953   3.762   9.524
  771   2HB   ARG1203           HB1      ARG1203 -30.278   2.378  10.555
  772   1HG   ARG1203           HG2      ARG1203 -27.883   2.025  10.851
  773   2HG   ARG1203           HG1      ARG1203 -27.552   3.409   9.805
  774   1HD   ARG1203           HD2      ARG1203 -29.036   3.484  12.431
  775   2HD   ARG1203           HD1      ARG1203 -27.375   4.013  12.167
  776    HE   ARG1203           HE       ARG1203 -29.024   5.404  10.393
  777   1HH1  ARG1203          1HH1      ARG1203 -28.444   5.156  13.821
  778   2HH1  ARG1203          2HH1      ARG1203 -28.922   6.788  14.149
  779   1HH2  ARG1203          1HH2      ARG1203 -29.654   7.554  10.817
  780   2HH2  ARG1203          2HH2      ARG1203 -29.609   8.151  12.443
  781    H    GLY1204           HN       GLY1204 -30.705  -0.093   7.546
  782   1HA   GLY1204           HA1      GLY1204 -32.901   1.542   6.466
  783   2HA   GLY1204           HA2      GLY1204 -33.267   0.105   7.407
  784    H    TYR1205           HN       TYR1205 -31.633   1.238   4.478
  785    HA   TYR1205           HA       TYR1205 -32.744  -0.604   2.760
  786   1HB   TYR1205           HB2      TYR1205 -29.986   0.560   2.430
  787   2HB   TYR1205           HB1      TYR1205 -31.108   0.079   1.161
  788    HD1  TYR1205           HD1      TYR1205 -30.268   2.663   3.615
  789    HD2  TYR1205           HD2      TYR1205 -33.029   1.484   0.601
  790    HE1  TYR1205           HE1      TYR1205 -31.181   4.945   3.563
  791    HE2  TYR1205           HE2      TYR1205 -33.946   3.763   0.539
  792    HH   TYR1205           HH       TYR1205 -34.089   5.730   2.007
  793    H    ARG1206           HN       ARG1206 -32.305  -2.616   2.064
  794    HA   ARG1206           HA       ARG1206 -30.177  -4.074   3.487
  795   1HB   ARG1206           HB2      ARG1206 -31.596  -6.047   3.373
  796   2HB   ARG1206           HB1      ARG1206 -32.446  -4.726   4.165
  797   1HG   ARG1206           HG2      ARG1206 -34.118  -5.305   2.792
  798   2HG   ARG1206           HG1      ARG1206 -33.224  -4.352   1.607
  799   1HD   ARG1206           HD2      ARG1206 -33.861  -6.513   0.682
  800   2HD   ARG1206           HD1      ARG1206 -32.108  -6.373   0.814
  801    HE   ARG1206           HE       ARG1206 -33.041  -7.601   3.135
  802   1HH1  ARG1206          1HH1      ARG1206 -32.847  -8.253  -0.283
  803   2HH1  ARG1206          2HH1      ARG1206 -32.752  -9.970  -0.079
  804   1HH2  ARG1206          1HH2      ARG1206 -32.916  -9.861   3.411
  805   2HH2  ARG1206          2HH2      ARG1206 -32.791 -10.884   2.019
  806    H    LEU1207           HN       LEU1207 -28.879  -5.444   2.387
  807    HA   LEU1207           HA       LEU1207 -27.898  -5.095  -0.031
  808   1HB   LEU1207           HB2      LEU1207 -28.484  -7.752   1.251
  809   2HB   LEU1207           HB1      LEU1207 -27.551  -7.611  -0.224
  810    HG   LEU1207           HG       LEU1207 -26.783  -6.249   2.356
  811   1HD1  LEU1207          2HD1      LEU1207 -26.806  -8.679   2.655
  812   2HD1  LEU1207          1HD1      LEU1207 -25.790  -8.862   1.226
  813   3HD1  LEU1207          3HD1      LEU1207 -25.162  -8.042   2.655
  814   1HD2  LEU1207          1HD2      LEU1207 -25.860  -5.261   0.313
  815   2HD2  LEU1207          3HD2      LEU1207 -24.606  -6.034   1.286
  816   3HD2  LEU1207          2HD2      LEU1207 -25.224  -6.837  -0.159
  817    H    SER1208           HN       SER1208 -28.432  -5.188  -2.117
  818    HA   SER1208           HA       SER1208 -31.136  -5.760  -2.865
  819   1HB   SER1208           HB2      SER1208 -29.876  -3.945  -3.939
  820   2HB   SER1208           HB1      SER1208 -28.730  -5.118  -4.589
  821    HG   SER1208           HG       SER1208 -31.279  -4.480  -5.427
  822    H    SER1209           HN       SER1209 -28.777  -7.796  -2.111
  823    HA   SER1209           HA       SER1209 -28.569 -10.055  -2.366
  824   1HB   SER1209           HB2      SER1209 -30.982 -10.197  -2.780
  825   2HB   SER1209           HB1      SER1209 -30.723  -9.790  -4.476
  826    HG   SER1209           HG       SER1209 -29.812 -12.103  -3.111
  827    H    ARG1210           HN       ARG1210 -29.105  -8.560  -5.565
  828    HA   ARG1210           HA       ARG1210 -27.190 -10.155  -6.894
  829   1HB   ARG1210           HB2      ARG1210 -28.191  -7.408  -7.671
  830   2HB   ARG1210           HB1      ARG1210 -27.416  -8.574  -8.735
  831   1HG   ARG1210           HG2      ARG1210 -29.298 -10.107  -8.417
  832   2HG   ARG1210           HG1      ARG1210 -30.077  -8.921  -7.368
  833   1HD   ARG1210           HD2      ARG1210 -30.149  -7.328  -9.222
  834   2HD   ARG1210           HD1      ARG1210 -29.368  -8.511 -10.271
  835    HE   ARG1210           HE       ARG1210 -31.672  -9.679  -9.208
  836   1HH1  ARG1210          1HH1      ARG1210 -30.780  -7.095 -11.368
  837   2HH1  ARG1210          2HH1      ARG1210 -32.234  -7.203 -12.304
  838   1HH2  ARG1210          1HH2      ARG1210 -33.586  -9.829 -10.434
  839   2HH2  ARG1210          2HH2      ARG1210 -33.829  -8.757 -11.773
  840    H    SER1211           HN       SER1211 -26.766  -7.862  -4.570
  841    HA   SER1211           HA       SER1211 -24.564  -6.367  -5.474
  842   1HB   SER1211           HB2      SER1211 -26.003  -5.934  -3.417
  843   2HB   SER1211           HB1      SER1211 -25.060  -7.186  -2.610
  844    HG   SER1211           HG       SER1211 -23.720  -5.630  -2.200
  845    H    HIS1212           HN       HIS1212 -22.426  -6.583  -4.018
  846    HA   HIS1212           HA       HIS1212 -21.364  -9.226  -4.673
  847   1HB   HIS1212           HB2      HIS1212 -19.939  -6.672  -3.893
  848   2HB   HIS1212           HB1      HIS1212 -19.151  -8.176  -4.362
  849    HD1  HIS1212           HD1      HIS1212 -20.661  -5.125  -5.738
  850    HD2  HIS1212           HD2      HIS1212 -19.520  -8.868  -7.136
  851    HE1  HIS1212           HE1      HIS1212 -20.589  -4.914  -8.243
  852    HE2  HIS1212           HE2      HIS1212 -19.813  -7.165  -9.062
  853    H    THR1213           HN       THR1213 -20.587  -6.933  -2.067
  854    HA   THR1213           HA       THR1213 -21.467  -8.567   0.049
  855    HB   THR1213           HB       THR1213 -19.757 -10.115  -0.349
  856    HG1  THR1213           HG1      THR1213 -19.823  -9.229   1.846
  857   1HG2  THR1213          1HG2      THR1213 -17.847  -7.801  -0.688
  858   2HG2  THR1213          3HG2      THR1213 -17.412  -9.509  -0.749
  859   3HG2  THR1213          2HG2      THR1213 -18.473  -8.825  -1.980
  860    H    LEU1214           HN       LEU1214 -20.530  -7.847   2.178
  861    HA   LEU1214           HA       LEU1214 -20.382  -4.940   2.155
  862   1HB   LEU1214           HB2      LEU1214 -20.675  -6.957   4.376
  863   2HB   LEU1214           HB1      LEU1214 -20.492  -5.240   4.671
  864    HG   LEU1214           HG       LEU1214 -22.819  -5.811   4.826
  865   1HD1  LEU1214          3HD1      LEU1214 -22.302  -3.651   3.831
  866   2HD1  LEU1214          2HD1      LEU1214 -22.258  -4.388   2.230
  867   3HD1  LEU1214          1HD1      LEU1214 -23.772  -4.330   3.132
  868   1HD2  LEU1214          3HD2      LEU1214 -22.794  -7.863   3.520
  869   2HD2  LEU1214          2HD2      LEU1214 -24.057  -6.771   2.952
  870   3HD2  LEU1214          1HD2      LEU1214 -22.556  -6.931   2.042
  871    H    ARG1215           HN       ARG1215 -18.578  -7.597   3.685
  872    HA   ARG1215           HA       ARG1215 -16.268  -5.826   3.991
  873   1HB   ARG1215           HB2      ARG1215 -17.152  -7.286   5.884
  874   2HB   ARG1215           HB1      ARG1215 -16.523  -8.661   4.988
  875   1HG   ARG1215           HG2      ARG1215 -14.273  -7.622   5.070
  876   2HG   ARG1215           HG1      ARG1215 -14.945  -6.349   6.093
  877   1HD   ARG1215           HD2      ARG1215 -14.909  -9.298   6.727
  878   2HD   ARG1215           HD1      ARG1215 -13.847  -8.077   7.427
  879    HE   ARG1215           HE       ARG1215 -16.467  -7.271   7.898
  880   1HH1  ARG1215          1HH1      ARG1215 -14.344  -9.889   8.783
  881   2HH1  ARG1215          2HH1      ARG1215 -15.107 -10.162  10.314
  882   1HH2  ARG1215          1HH2      ARG1215 -17.478  -7.624   9.912
  883   2HH2  ARG1215          2HH2      ARG1215 -16.890  -8.874  10.955
  884    H    THR1216           HN       THR1216 -14.712  -5.834   2.508
  885    HA   THR1216           HA       THR1216 -14.200  -8.321   1.016
  886    HB   THR1216           HB       THR1216 -15.452  -6.734  -0.405
  887    HG1  THR1216           HG1      THR1216 -12.926  -6.668  -1.554
  888   1HG2  THR1216          1HG2      THR1216 -13.045  -4.954  -0.032
  889   2HG2  THR1216          3HG2      THR1216 -14.370  -4.668  -1.161
  890   3HG2  THR1216          2HG2      THR1216 -14.671  -4.641   0.576
  891    H    THR1217           HN       THR1217 -12.092  -7.526  -0.499
  892    HA   THR1217           HA       THR1217 -10.043  -6.898   1.521
  893    HB   THR1217           HB       THR1217  -9.940  -8.673  -0.911
  894    HG1  THR1217           HG1      THR1217  -9.034 -10.082   0.807
  895   1HG2  THR1217          2HG2      THR1217  -7.935  -7.193  -0.873
  896   2HG2  THR1217          1HG2      THR1217  -7.568  -7.798   0.744
  897   3HG2  THR1217          3HG2      THR1217  -7.551  -8.899  -0.635
  898    H    CYS1218           HN       CYS1218  -8.553  -5.353   1.134
  899    HA   CYS1218           HA       CYS1218  -9.065  -3.498  -1.017
  900   1HB   CYS1218           HB2      CYS1218  -6.902  -3.447   1.090
  901   2HB   CYS1218           HB1      CYS1218  -7.394  -2.105   0.063
  902    H    TRP1219           HN       TRP1219  -7.947  -3.342  -2.901
  903    HA   TRP1219           HA       TRP1219  -5.249  -4.268  -3.088
  904   1HB   TRP1219           HB2      TRP1219  -7.026  -6.301  -3.255
  905   2HB   TRP1219           HB1      TRP1219  -6.919  -5.834  -4.951
  906    HD1  TRP1219           HD1      TRP1219  -4.234  -5.680  -5.881
  907    HE1  TRP1219           HE1      TRP1219  -2.345  -7.361  -5.419
  908    HE3  TRP1219           HE3      TRP1219  -6.143  -7.951  -1.719
  909    HZ2  TRP1219           HZ2      TRP1219  -1.736  -9.374  -3.561
  910    HZ3  TRP1219           HZ3      TRP1219  -4.843  -9.751  -0.657
  911    HH2  TRP1219           HH2      TRP1219  -2.683 -10.448  -1.561
  912    H    ASP1220           HN       ASP1220  -4.362  -2.820  -4.323
  913    HA   ASP1220           HA       ASP1220  -3.858  -1.518  -6.113
  914   1HB   ASP1220           HB2      ASP1220  -4.390  -3.524  -7.446
  915   2HB   ASP1220           HB1      ASP1220  -6.075  -3.018  -7.519
  916    H    GLY1221           HN       GLY1221  -6.813  -1.426  -4.562
  917   1HA   GLY1221           HA1      GLY1221  -7.309   1.262  -5.647
  918   2HA   GLY1221           HA2      GLY1221  -7.816   0.691  -4.067
  919    H    LYS1222           HN       LYS1222  -8.937  -1.785  -4.928
  920    HA   LYS1222           HA       LYS1222 -11.437  -0.752  -6.020
  921   1HB   LYS1222           HB2      LYS1222  -9.661  -2.144  -7.643
  922   2HB   LYS1222           HB1      LYS1222 -10.833  -3.355  -7.142
  923   1HG   LYS1222           HG2      LYS1222 -11.561  -0.711  -8.362
  924   2HG   LYS1222           HG1      LYS1222 -11.397  -2.217  -9.267
  925   1HD   LYS1222           HD2      LYS1222 -13.157  -3.230  -7.898
  926   2HD   LYS1222           HD1      LYS1222 -13.321  -1.723  -6.994
  927   1HE   LYS1222           HE2      LYS1222 -13.820  -2.083  -9.947
  928   2HE   LYS1222           HE1      LYS1222 -15.056  -1.927  -8.700
  929   1HZ   LYS1222           HZ2      LYS1222 -13.047   0.142  -9.407
  930   2HZ   LYS1222           HZ1      LYS1222 -14.682   0.165  -9.841
  931   3HZ   LYS1222           HZ3      LYS1222 -14.235   0.292  -8.214
  932    H    LEU1223           HN       LEU1223 -13.094  -1.472  -4.873
  933    HA   LEU1223           HA       LEU1223 -12.775  -4.019  -3.427
  934   1HB   LEU1223           HB2      LEU1223 -14.297  -1.632  -2.392
  935   2HB   LEU1223           HB1      LEU1223 -13.962  -3.128  -1.547
  936    HG   LEU1223           HG       LEU1223 -12.542  -1.430  -0.650
  937   1HD1  LEU1223          3HD1      LEU1223 -10.977  -3.239  -2.479
  938   2HD1  LEU1223          2HD1      LEU1223 -10.339  -2.388  -1.071
  939   3HD1  LEU1223          1HD1      LEU1223 -11.562  -3.642  -0.865
  940   1HD2  LEU1223          3HD2      LEU1223 -12.673  -0.036  -2.783
  941   2HD2  LEU1223          2HD2      LEU1223 -11.165  -0.013  -1.875
  942   3HD2  LEU1223          1HD2      LEU1223 -11.299  -0.991  -3.336
  943    H    GLU1224           HN       GLU1224 -14.943  -4.852  -2.640
  944    HA   GLU1224           HA       GLU1224 -16.779  -4.846  -4.910
  945   1HB   GLU1224           HB2      GLU1224 -16.680  -6.622  -2.461
  946   2HB   GLU1224           HB1      GLU1224 -17.778  -6.823  -3.819
  947   1HG   GLU1224           HG2      GLU1224 -14.776  -7.021  -3.932
  948   2HG   GLU1224           HG1      GLU1224 -15.908  -8.372  -3.944
  949    H    TYR1225           HN       TYR1225 -16.856  -2.492  -3.558
  950    HA   TYR1225           HA       TYR1225 -18.463  -2.134  -1.396
  951   1HB   TYR1225           HB2      TYR1225 -19.136   0.051  -2.422
  952   2HB   TYR1225           HB1      TYR1225 -17.404  -0.248  -2.388
  953    HD1  TYR1225           HD1      TYR1225 -20.139   0.727  -4.388
  954    HD2  TYR1225           HD2      TYR1225 -16.370  -1.229  -4.575
  955    HE1  TYR1225           HE1      TYR1225 -20.021   1.207  -6.796
  956    HE2  TYR1225           HE2      TYR1225 -16.240  -0.762  -6.986
  957    HH   TYR1225           HH       TYR1225 -18.311   1.424  -8.549
  958    HA   PRO1226           HA       PRO1226 -22.306  -4.097  -2.576
  959   1HB   PRO1226           HB2      PRO1226 -23.696  -3.242  -0.377
  960   2HB   PRO1226           HB1      PRO1226 -22.595  -4.624  -0.372
  961   1HG   PRO1226           HG2      PRO1226 -22.078  -1.789   0.475
  962   2HG   PRO1226           HG1      PRO1226 -21.644  -3.297   1.304
  963   1HD   PRO1226           HD2      PRO1226 -19.843  -1.943  -0.119
  964   2HD   PRO1226           HD1      PRO1226 -19.874  -3.719  -0.147
  965    H    THR1227           HN       THR1227 -24.757  -3.238  -2.133
  966    HA   THR1227           HA       THR1227 -24.994  -0.451  -2.997
  967    HB   THR1227           HB       THR1227 -26.338  -2.742  -4.442
  968    HG1  THR1227           HG1      THR1227 -24.890  -2.395  -6.033
  969   1HG2  THR1227          2HG2      THR1227 -26.424   0.235  -4.950
  970   2HG2  THR1227          1HG2      THR1227 -27.155  -1.004  -5.971
  971   3HG2  THR1227          3HG2      THR1227 -27.749  -0.750  -4.330
  972    H    CYS1228           HN       CYS1228 -26.791  -3.391  -2.258
  973    HA   CYS1228           HA       CYS1228 -28.678  -3.810  -1.072
  974   1HB   CYS1228           HB2      CYS1228 -28.072  -1.472   0.696
  975   2HB   CYS1228           HB1      CYS1228 -28.624  -3.090   1.119
  976    H    ALA1229           HN       ALA1229 -30.599  -2.546   0.174
  977    HA   ALA1229           HA       ALA1229 -31.608  -0.144  -0.703
  978   1HB   ALA1229           HB1      ALA1229 -32.369  -2.426  -2.502
  979   2HB   ALA1229           HB3      ALA1229 -33.195  -0.868  -2.464
  980   3HB   ALA1229           HB2      ALA1229 -31.502  -0.957  -2.956
  981    H    LYS1230           HN       LYS1230 -33.415   0.304   0.391
  982    HA   LYS1230           HA       LYS1230 -35.642  -1.133   0.887
  983   1HB   LYS1230           HB2      LYS1230 -33.795  -2.631   2.078
  984   2HB   LYS1230           HB1      LYS1230 -34.118  -1.517   3.399
  985   1HG   LYS1230           HG2      LYS1230 -36.567  -2.072   3.086
  986   2HG   LYS1230           HG1      LYS1230 -36.028  -3.384   2.035
  987   1HD   LYS1230           HD2      LYS1230 -34.698  -4.303   3.881
  988   2HD   LYS1230           HD1      LYS1230 -35.261  -2.999   4.929
  989   1HE   LYS1230           HE2      LYS1230 -36.528  -5.046   5.315
  990   2HE   LYS1230           HE1      LYS1230 -37.560  -3.772   4.669
  991   1HZ   LYS1230           HZ2      LYS1230 -37.373  -4.785   2.480
  992   2HZ   LYS1230           HZ1      LYS1230 -36.392  -6.011   3.106
  993   3HZ   LYS1230           HZ3      LYS1230 -38.005  -5.886   3.600
  994    H    ARG1231           HN       ARG1231 -34.687  -0.383   3.949
  995    HA   ARG1231           HA       ARG1231 -35.512   1.196   5.390
  996   1HB   ARG1231           HB2      ARG1231 -33.312   2.039   4.759
  997   2HB   ARG1231           HB1      ARG1231 -34.013   2.885   3.389
  998   1HG   ARG1231           HG2      ARG1231 -33.582   4.442   5.173
  999   2HG   ARG1231           HG1      ARG1231 -35.324   4.275   4.943
 1000   1HD   ARG1231           HD2      ARG1231 -35.430   2.735   6.836
 1001   2HD   ARG1231           HD1      ARG1231 -33.689   2.886   7.062
 1002    HE   ARG1231           HE       ARG1231 -34.908   5.433   7.141
 1003   1HH1  ARG1231          1HH1      ARG1231 -34.543   2.521   9.019
 1004   2HH1  ARG1231          2HH1      ARG1231 -34.728   3.326  10.541
 1005   1HH2  ARG1231          1HH2      ARG1231 -35.151   6.502   9.141
 1006   2HH2  ARG1231          2HH2      ARG1231 -35.074   5.589  10.610

  No H/Q in entry =        1006
  Start of MODEL   15
    1    H1   GLU1103           HT3      GLU1103  40.198  -3.204  -9.917
    2    H2   GLU1103           HT2      GLU1103  39.671  -4.073 -11.269
    3    H3   GLU1103           HT1      GLU1103  41.303  -3.659 -11.115
    4    HA   GLU1103           HA       GLU1103  40.803  -1.338 -11.329
    5   1HB   GLU1103           HB2      GLU1103  39.618  -3.111 -13.468
    6   2HB   GLU1103           HB1      GLU1103  39.859  -1.382 -13.676
    7   1HG   GLU1103           HG2      GLU1103  41.681  -2.509 -14.703
    8   2HG   GLU1103           HG1      GLU1103  42.281  -1.730 -13.240
    9    H    ALA1104           HN       ALA1104  39.465   0.054 -10.415
   10    HA   ALA1104           HA       ALA1104  37.581   1.124  -9.730
   11   1HB   ALA1104           HB3      ALA1104  36.341  -0.216 -12.131
   12   2HB   ALA1104           HB1      ALA1104  37.209   1.319 -12.143
   13   3HB   ALA1104           HB2      ALA1104  35.689   1.172 -11.260
   14    H    GLU1105           HN       GLU1105  37.234   0.121  -7.778
   15    HA   GLU1105           HA       GLU1105  35.222  -2.032  -7.786
   16   1HB   GLU1105           HB2      GLU1105  37.510  -1.628  -5.851
   17   2HB   GLU1105           HB1      GLU1105  36.243  -2.833  -5.667
   18   1HG   GLU1105           HG2      GLU1105  38.189  -2.690  -7.960
   19   2HG   GLU1105           HG1      GLU1105  38.314  -3.774  -6.574
   20    H    PHE1106           HN       PHE1106  34.432  -2.164  -5.273
   21    HA   PHE1106           HA       PHE1106  33.081  -1.239  -3.701
   22   1HB   PHE1106           HB2      PHE1106  34.746   1.235  -4.212
   23   2HB   PHE1106           HB1      PHE1106  33.662   1.001  -2.844
   24    HD1  PHE1106           HD1      PHE1106  34.229  -0.541  -1.053
   25    HD2  PHE1106           HD2      PHE1106  36.882   0.138  -4.312
   26    HE1  PHE1106           HE1      PHE1106  36.058  -1.579   0.224
   27    HE2  PHE1106           HE2      PHE1106  38.715  -0.900  -3.040
   28    HZ   PHE1106           HZ       PHE1106  38.304  -1.760  -0.769
   29    H    GLY1107           HN       GLY1107  31.489   0.639  -3.313
   30   1HA   GLY1107           HA1      GLY1107  29.770   0.795  -5.530
   31   2HA   GLY1107           HA2      GLY1107  30.630   2.314  -5.365
   32    H    LYS1108           HN       LYS1108  30.587   3.232  -3.050
   33    HA   LYS1108           HA       LYS1108  28.653   2.549  -1.191
   34   1HB   LYS1108           HB2      LYS1108  29.747   5.279  -1.888
   35   2HB   LYS1108           HB1      LYS1108  28.763   4.946  -0.469
   36   1HG   LYS1108           HG2      LYS1108  30.508   3.265   0.208
   37   2HG   LYS1108           HG1      LYS1108  31.514   3.911  -1.091
   38   1HD   LYS1108           HD2      LYS1108  30.358   5.556   1.155
   39   2HD   LYS1108           HD1      LYS1108  31.996   4.901   1.139
   40   1HE   LYS1108           HE2      LYS1108  30.840   6.836  -0.865
   41   2HE   LYS1108           HE1      LYS1108  31.968   7.237   0.428
   42   1HZ   LYS1108           HZ2      LYS1108  33.602   5.779  -0.597
   43   2HZ   LYS1108           HZ1      LYS1108  32.520   5.404  -1.842
   44   3HZ   LYS1108           HZ3      LYS1108  33.109   6.983  -1.679
   45    H    CYS1109           HN       CYS1109  26.540   2.629  -1.144
   46    HA   CYS1109           HA       CYS1109  25.088   3.575  -3.438
   47   1HB   CYS1109           HB2      CYS1109  23.765   2.639  -0.923
   48   2HB   CYS1109           HB1      CYS1109  23.286   2.381  -2.598
   49    H    GLY1110           HN       GLY1110  23.177   4.949  -3.230
   50   1HA   GLY1110           HA1      GLY1110  22.942   7.344  -2.902
   51   2HA   GLY1110           HA2      GLY1110  23.677   7.140  -1.317
   52    HA   PRO1111           HA       PRO1111  19.575   7.300   0.352
   53   1HB   PRO1111           HB2      PRO1111  18.403   9.107  -1.689
   54   2HB   PRO1111           HB1      PRO1111  18.463   9.275   0.069
   55   1HG   PRO1111           HG2      PRO1111  20.040  10.745  -1.516
   56   2HG   PRO1111           HG1      PRO1111  20.614  10.132   0.046
   57   1HD   PRO1111           HD2      PRO1111  21.208   9.150  -2.712
   58   2HD   PRO1111           HD1      PRO1111  22.269   9.237  -1.291
   59    HA   PRO1112           HA       PRO1112  17.925   3.867  -2.082
   60   1HB   PRO1112           HB2      PRO1112  15.934   4.118   0.127
   61   2HB   PRO1112           HB1      PRO1112  16.714   2.674  -0.528
   62   1HG   PRO1112           HG2      PRO1112  17.523   3.730   1.776
   63   2HG   PRO1112           HG1      PRO1112  18.689   3.060   0.620
   64   1HD   PRO1112           HD2      PRO1112  18.088   5.897   1.278
   65   2HD   PRO1112           HD1      PRO1112  19.611   5.156   0.748
   66    HA   PRO1113           HA       PRO1113  14.481   6.179  -3.930
   67   1HB   PRO1113           HB2      PRO1113  15.156   5.725  -6.478
   68   2HB   PRO1113           HB1      PRO1113  16.072   6.868  -5.491
   69   1HG   PRO1113           HG2      PRO1113  16.831   4.179  -6.443
   70   2HG   PRO1113           HG1      PRO1113  17.864   5.526  -5.944
   71   1HD   PRO1113           HD2      PRO1113  17.034   3.225  -4.398
   72   2HD   PRO1113           HD1      PRO1113  18.159   4.518  -3.938
   73    HA   PRO1114           HA       PRO1114  12.666   1.963  -4.616
   74   1HB   PRO1114           HB2      PRO1114  11.483   1.534  -2.324
   75   2HB   PRO1114           HB1      PRO1114  13.251   1.550  -2.382
   76   1HG   PRO1114           HG2      PRO1114  11.364   3.642  -1.385
   77   2HG   PRO1114           HG1      PRO1114  12.953   3.176  -0.756
   78   1HD   PRO1114           HD2      PRO1114  12.360   5.313  -2.542
   79   2HD   PRO1114           HD1      PRO1114  13.962   4.747  -2.029
   80    H    ILE1115           HN       ILE1115  10.248   1.498  -3.229
   81    HA   ILE1115           HA       ILE1115   8.288   2.186  -4.969
   82    HB   ILE1115           HB       ILE1115   6.710   1.986  -2.919
   83   1HG1  ILE1115          2HG1      ILE1115   9.371   1.177  -1.722
   84   2HG1  ILE1115          1HG1      ILE1115   8.336   2.494  -1.183
   85   1HG2  ILE1115          3HG2      ILE1115   7.121   0.246  -4.582
   86   2HG2  ILE1115          2HG2      ILE1115   8.550  -0.272  -3.684
   87   3HG2  ILE1115          1HG2      ILE1115   6.948  -0.433  -2.961
   88   1HD1  ILE1115          3HD1      ILE1115   7.609  -0.424  -1.092
   89   2HD1  ILE1115          2HD1      ILE1115   8.197   0.527   0.274
   90   3HD1  ILE1115          1HD1      ILE1115   6.647   0.918  -0.475
   91    H    ASP1116           HN       ASP1116   7.053   3.861  -5.427
   92    HA   ASP1116           HA       ASP1116   7.649   6.406  -4.193
   93   1HB   ASP1116           HB2      ASP1116   7.337   6.112  -6.675
   94   2HB   ASP1116           HB1      ASP1116   5.630   5.811  -6.366
   95    H    ASN1117           HN       ASN1117   6.335   4.377  -2.630
   96    HA   ASN1117           HA       ASN1117   4.194   5.974  -1.569
   97   1HB   ASN1117           HB2      ASN1117   3.670   3.161  -2.559
   98   2HB   ASN1117           HB1      ASN1117   2.555   4.108  -1.577
   99   1HD2  ASN1117          1HD2      ASN1117   3.965   3.681  -4.709
  100   2HD2  ASN1117          2HD2      ASN1117   2.900   4.742  -5.561
  101    H    GLY1118           HN       GLY1118   6.874   4.266  -1.125
  102   1HA   GLY1118           HA1      GLY1118   6.929   2.393   0.674
  103   2HA   GLY1118           HA2      GLY1118   6.141   3.622   1.648
  104    H    ASP1119           HN       ASP1119   8.649   2.300   2.130
  105    HA   ASP1119           HA       ASP1119  10.955   3.653   1.544
  106   1HB   ASP1119           HB2      ASP1119   9.743   5.674   2.422
  107   2HB   ASP1119           HB1      ASP1119   9.682   4.892   3.998
  108    H    ILE1120           HN       ILE1120  12.595   3.519   3.520
  109    HA   ILE1120           HA       ILE1120  12.668   0.836   4.322
  110    HB   ILE1120           HB       ILE1120  14.182   2.473   6.151
  111   1HG1  ILE1120          2HG1      ILE1120  14.524   3.072   3.203
  112   2HG1  ILE1120          1HG1      ILE1120  14.014   4.215   4.440
  113   1HG2  ILE1120          2HG2      ILE1120  14.958   0.638   3.893
  114   2HG2  ILE1120          1HG2      ILE1120  16.048   1.232   5.145
  115   3HG2  ILE1120          3HG2      ILE1120  14.702   0.177   5.576
  116   1HD1  ILE1120          1HD1      ILE1120  16.191   4.023   5.518
  117   2HD1  ILE1120          3HD1      ILE1120  16.704   2.880   4.277
  118   3HD1  ILE1120          2HD1      ILE1120  16.337   4.549   3.841
  119    H    THR1121           HN       THR1121  12.249  -0.180   6.263
  120    HA   THR1121           HA       THR1121  10.085   0.915   7.778
  121    HB   THR1121           HB       THR1121  10.138  -1.180   9.032
  122    HG1  THR1121           HG1      THR1121  12.323  -1.618   9.183
  123   1HG2  THR1121          1HG2      THR1121  10.521  -1.547   6.056
  124   2HG2  THR1121          3HG2      THR1121   9.793  -2.732   7.142
  125   3HG2  THR1121          2HG2      THR1121   9.006  -1.176   6.878
  126    H    SER1122           HN       SER1122  13.068   1.919   7.899
  127    HA   SER1122           HA       SER1122  13.099   2.152  10.836
  128   1HB   SER1122           HB2      SER1122  15.494   1.989   8.990
  129   2HB   SER1122           HB1      SER1122  15.565   2.260  10.731
  130    HG   SER1122           HG       SER1122  14.168   0.030   9.793
  131    H    PHE1123           HN       PHE1123  15.281   3.735   8.586
  132    HA   PHE1123           HA       PHE1123  13.837   6.208   8.520
  133   1HB   PHE1123           HB2      PHE1123  14.798   6.199  10.827
  134   2HB   PHE1123           HB1      PHE1123  16.405   6.117  10.112
  135    HD1  PHE1123           HD1      PHE1123  17.469   8.045   9.253
  136    HD2  PHE1123           HD2      PHE1123  13.396   8.217  10.474
  137    HE1  PHE1123           HE1      PHE1123  17.531  10.501   9.101
  138    HE2  PHE1123           HE2      PHE1123  13.450  10.671  10.324
  139    HZ   PHE1123           HZ       PHE1123  15.519  11.817   9.637
  140    HA   PRO1124           HA       PRO1124  16.063   6.166   4.644
  141   1HB   PRO1124           HB2      PRO1124  15.566   9.098   4.926
  142   2HB   PRO1124           HB1      PRO1124  15.302   8.042   3.533
  143   1HG   PRO1124           HG2      PRO1124  13.256   8.827   5.039
  144   2HG   PRO1124           HG1      PRO1124  13.330   7.174   4.402
  145   1HD   PRO1124           HD2      PRO1124  13.810   8.163   7.170
  146   2HD   PRO1124           HD1      PRO1124  13.128   6.618   6.623
  147    H    LEU1125           HN       LEU1125  18.145   6.488   4.023
  148    HA   LEU1125           HA       LEU1125  19.822   8.210   5.721
  149   1HB   LEU1125           HB2      LEU1125  20.734   5.619   4.454
  150   2HB   LEU1125           HB1      LEU1125  21.633   6.641   5.559
  151    HG   LEU1125           HG       LEU1125  19.735   6.123   7.247
  152   1HD1  LEU1125          1HD1      LEU1125  19.390   3.839   5.309
  153   2HD1  LEU1125          3HD1      LEU1125  18.675   3.944   6.915
  154   3HD1  LEU1125          2HD1      LEU1125  18.192   5.085   5.658
  155   1HD2  LEU1125          3HD2      LEU1125  22.034   5.350   7.474
  156   2HD2  LEU1125          2HD2      LEU1125  20.894   4.097   7.966
  157   3HD2  LEU1125          1HD2      LEU1125  21.693   3.995   6.397
  158    H    SER1126           HN       SER1126  21.478   9.347   4.704
  159    HA   SER1126           HA       SER1126  21.007   9.884   1.905
  160   1HB   SER1126           HB2      SER1126  22.696  11.663   2.197
  161   2HB   SER1126           HB1      SER1126  21.434  11.750   3.425
  162    HG   SER1126           HG       SER1126  23.089  10.319   4.618
  163    H    VAL1127           HN       VAL1127  23.761   8.796   3.874
  164    HA   VAL1127           HA       VAL1127  25.032   7.812   1.413
  165    HB   VAL1127           HB       VAL1127  26.452   9.333   2.680
  166   1HG1  VAL1127          2HG1      VAL1127  25.496   9.003   4.894
  167   2HG1  VAL1127          1HG1      VAL1127  26.163   7.371   4.952
  168   3HG1  VAL1127          3HG1      VAL1127  27.244   8.764   4.926
  169   1HG2  VAL1127          1HG2      VAL1127  27.515   7.507   1.458
  170   2HG2  VAL1127          3HG2      VAL1127  28.422   7.902   2.917
  171   3HG2  VAL1127          2HG2      VAL1127  27.391   6.472   2.881
  172    H    TYR1128           HN       TYR1128  25.081   5.707   1.042
  173    HA   TYR1128           HA       TYR1128  24.536   3.887   3.292
  174   1HB   TYR1128           HB2      TYR1128  23.221   4.190   0.753
  175   2HB   TYR1128           HB1      TYR1128  23.904   2.573   0.885
  176    HD1  TYR1128           HD1      TYR1128  21.183   4.674   1.752
  177    HD2  TYR1128           HD2      TYR1128  23.360   1.254   3.040
  178    HE1  TYR1128           HE1      TYR1128  19.274   3.991   3.135
  179    HE2  TYR1128           HE2      TYR1128  21.455   0.556   4.429
  180    HH   TYR1128           HH       TYR1128  19.494   1.570   5.507
  181    H    ALA1129           HN       ALA1129  25.374   1.716   3.065
  182    HA   ALA1129           HA       ALA1129  28.094   1.762   2.016
  183   1HB   ALA1129           HB2      ALA1129  27.756   0.947   4.287
  184   2HB   ALA1129           HB3      ALA1129  28.383  -0.337   3.255
  185   3HB   ALA1129           HB1      ALA1129  26.674  -0.312   3.689
  186    HA   PRO1130           HA       PRO1130  27.202  -0.415  -1.714
  187   1HB   PRO1130           HB2      PRO1130  29.731  -1.890  -1.293
  188   2HB   PRO1130           HB1      PRO1130  29.238  -0.860  -2.640
  189   1HG   PRO1130           HG2      PRO1130  31.054  -0.039  -0.852
  190   2HG   PRO1130           HG1      PRO1130  29.880   1.082  -1.566
  191   1HD   PRO1130           HD2      PRO1130  29.892  -0.183   1.144
  192   2HD   PRO1130           HD1      PRO1130  29.416   1.460   0.667
  193    H    ALA1131           HN       ALA1131  26.116  -2.200  -2.250
  194    HA   ALA1131           HA       ALA1131  25.148  -4.250  -2.153
  195   1HB   ALA1131           HB3      ALA1131  27.454  -5.039  -2.381
  196   2HB   ALA1131           HB1      ALA1131  26.483  -6.132  -1.396
  197   3HB   ALA1131           HB2      ALA1131  27.627  -5.032  -0.626
  198    H    SER1132           HN       SER1132  24.722  -2.261   0.041
  199    HA   SER1132           HA       SER1132  24.288  -3.904   2.389
  200   1HB   SER1132           HB2      SER1132  23.701  -1.005   1.787
  201   2HB   SER1132           HB1      SER1132  23.248  -1.782   3.306
  202    HG   SER1132           HG       SER1132  25.674  -2.427   3.149
  203    H    SER1133           HN       SER1133  22.323  -4.491   3.268
  204    HA   SER1133           HA       SER1133  19.982  -4.187   1.503
  205   1HB   SER1133           HB2      SER1133  19.257  -6.430   2.489
  206   2HB   SER1133           HB1      SER1133  20.586  -6.474   1.335
  207    HG   SER1133           HG       SER1133  22.004  -6.809   2.970
  208    H    VAL1134           HN       VAL1134  17.965  -3.907   2.479
  209    HA   VAL1134           HA       VAL1134  17.843  -3.717   5.385
  210    HB   VAL1134           HB       VAL1134  16.735  -1.480   5.262
  211   1HG1  VAL1134          3HG1      VAL1134  19.613  -1.627   4.386
  212   2HG1  VAL1134          2HG1      VAL1134  18.832  -0.206   5.080
  213   3HG1  VAL1134          1HG1      VAL1134  19.009  -1.675   6.042
  214   1HG2  VAL1134          2HG2      VAL1134  16.158  -1.482   2.906
  215   2HG2  VAL1134          1HG2      VAL1134  17.155  -0.081   3.296
  216   3HG2  VAL1134          3HG2      VAL1134  17.867  -1.467   2.468
  217    H    GLU1135           HN       GLU1135  15.609  -3.174   6.120
  218    HA   GLU1135           HA       GLU1135  13.710  -4.807   4.659
  219   1HB   GLU1135           HB2      GLU1135  13.470  -3.426   7.339
  220   2HB   GLU1135           HB1      GLU1135  12.347  -4.602   6.681
  221   1HG   GLU1135           HG2      GLU1135  14.076  -6.312   6.740
  222   2HG   GLU1135           HG1      GLU1135  15.221  -5.133   7.378
  223    H    TYR1136           HN       TYR1136  11.578  -4.062   4.116
  224    HA   TYR1136           HA       TYR1136  11.280  -1.149   4.040
  225   1HB   TYR1136           HB2      TYR1136  11.686  -2.913   1.761
  226   2HB   TYR1136           HB1      TYR1136  10.231  -1.930   1.613
  227    HD1  TYR1136           HD1      TYR1136  13.874  -1.688   2.342
  228    HD2  TYR1136           HD2      TYR1136  10.376   0.278   0.940
  229    HE1  TYR1136           HE1      TYR1136  15.236   0.251   1.685
  230    HE2  TYR1136           HE2      TYR1136  11.720   2.213   0.275
  231    HH   TYR1136           HH       TYR1136  13.876   3.245   0.855
  232    H    GLN1137           HN       GLN1137   9.124  -0.441   3.377
  233    HA   GLN1137           HA       GLN1137   6.907  -2.224   3.456
  234   1HB   GLN1137           HB2      GLN1137   7.521  -2.234   5.855
  235   2HB   GLN1137           HB1      GLN1137   7.344  -0.486   5.893
  236   1HG   GLN1137           HG2      GLN1137   4.965  -0.757   5.271
  237   2HG   GLN1137           HG1      GLN1137   5.175  -2.504   5.381
  238   1HE2  GLN1137          1HE2      GLN1137   5.514  -3.451   7.403
  239   2HE2  GLN1137          2HE2      GLN1137   5.122  -2.629   8.870
  240    H    CYS1138           HN       CYS1138   4.911  -1.157   3.076
  241    HA   CYS1138           HA       CYS1138   5.264   1.439   1.814
  242   1HB   CYS1138           HB2      CYS1138   2.996  -0.550   1.816
  243   2HB   CYS1138           HB1      CYS1138   2.886   1.029   1.046
  244    H    GLN1139           HN       GLN1139   4.329   3.308   2.451
  245    HA   GLN1139           HA       GLN1139   2.968   3.278   5.055
  246   1HB   GLN1139           HB2      GLN1139   3.628   5.645   5.225
  247   2HB   GLN1139           HB1      GLN1139   5.019   4.589   5.013
  248   1HG   GLN1139           HG2      GLN1139   5.109   5.177   2.646
  249   2HG   GLN1139           HG1      GLN1139   3.710   6.229   2.854
  250   1HE2  GLN1139          1HE2      GLN1139   4.836   8.051   2.205
  251   2HE2  GLN1139          2HE2      GLN1139   6.035   8.802   3.195
  252    H    ASN1140           HN       ASN1140   1.746   5.703   5.052
  253    HA   ASN1140           HA       ASN1140  -0.286   6.604   4.572
  254   1HB   ASN1140           HB2      ASN1140   1.271   7.418   2.745
  255   2HB   ASN1140           HB1      ASN1140   0.525   6.215   1.701
  256   1HD2  ASN1140          1HD2      ASN1140  -1.273   7.853   4.157
  257   2HD2  ASN1140          2HD2      ASN1140  -2.235   8.823   3.101
  258    H    LEU1141           HN       LEU1141  -0.657   4.029   5.202
  259    HA   LEU1141           HA       LEU1141  -2.327   2.484   5.183
  260   1HB   LEU1141           HB2      LEU1141  -3.352   3.928   2.741
  261   2HB   LEU1141           HB1      LEU1141  -4.209   2.681   3.627
  262    HG   LEU1141           HG       LEU1141  -3.426   5.377   4.747
  263   1HD1  LEU1141          2HD1      LEU1141  -6.103   4.335   3.831
  264   2HD1  LEU1141          1HD1      LEU1141  -5.818   5.879   4.635
  265   3HD1  LEU1141          3HD1      LEU1141  -5.142   5.581   3.034
  266   1HD2  LEU1141          3HD2      LEU1141  -3.523   3.641   6.452
  267   2HD2  LEU1141          2HD2      LEU1141  -4.874   4.763   6.617
  268   3HD2  LEU1141          1HD2      LEU1141  -5.130   3.173   5.899
  269    H    TYR1142           HN       TYR1142  -0.493   3.112   2.282
  270    HA   TYR1142           HA       TYR1142  -1.111   0.869   0.765
  271   1HB   TYR1142           HB2      TYR1142   1.492   2.370   1.067
  272   2HB   TYR1142           HB1      TYR1142   1.269   1.072  -0.103
  273    HD1  TYR1142           HD1      TYR1142  -0.049   4.401   0.900
  274    HD2  TYR1142           HD2      TYR1142   0.317   1.506  -2.196
  275    HE1  TYR1142           HE1      TYR1142  -0.971   6.015  -0.710
  276    HE2  TYR1142           HE2      TYR1142  -0.605   3.111  -3.814
  277    HH   TYR1142           HH       TYR1142  -0.945   6.417  -3.135
  278    H    GLN1143           HN       GLN1143  -0.518  -1.243   0.774
  279    HA   GLN1143           HA       GLN1143   1.048  -2.159   3.096
  280   1HB   GLN1143           HB2      GLN1143  -1.446  -2.787   2.862
  281   2HB   GLN1143           HB1      GLN1143  -0.914  -3.860   1.575
  282   1HG   GLN1143           HG2      GLN1143   0.214  -3.967   4.355
  283   2HG   GLN1143           HG1      GLN1143  -1.199  -4.894   3.851
  284   1HE2  GLN1143          1HE2      GLN1143   1.405  -5.814   4.775
  285   2HE2  GLN1143          2HE2      GLN1143   2.035  -6.812   3.514
  286    H    LEU1144           HN       LEU1144   3.011  -2.870   2.594
  287    HA   LEU1144           HA       LEU1144   3.749  -3.492  -0.108
  288   1HB   LEU1144           HB2      LEU1144   5.221  -2.369   1.614
  289   2HB   LEU1144           HB1      LEU1144   5.383  -3.933   2.386
  290    HG   LEU1144           HG       LEU1144   6.124  -3.623  -0.502
  291   1HD1  LEU1144          1HD1      LEU1144   7.275  -1.810   0.650
  292   2HD1  LEU1144          3HD1      LEU1144   7.890  -2.950   1.846
  293   3HD1  LEU1144          2HD1      LEU1144   8.406  -3.073   0.165
  294   1HD2  LEU1144          1HD2      LEU1144   7.134  -5.381   1.730
  295   2HD2  LEU1144          3HD2      LEU1144   6.022  -5.865   0.450
  296   3HD2  LEU1144          2HD2      LEU1144   7.681  -5.422   0.054
  297    H    GLU1145           HN       GLU1145   4.392  -5.454  -0.949
  298    HA   GLU1145           HA       GLU1145   3.895  -7.854   0.659
  299   1HB   GLU1145           HB2      GLU1145   1.852  -7.502  -0.593
  300   2HB   GLU1145           HB1      GLU1145   2.758  -7.303  -2.086
  301   1HG   GLU1145           HG2      GLU1145   3.462  -9.621  -1.997
  302   2HG   GLU1145           HG1      GLU1145   2.620  -9.833  -0.463
  303    H    GLY1146           HN       GLY1146   5.264  -9.526   0.276
  304   1HA   GLY1146           HA1      GLY1146   7.072  -9.348  -2.038
  305   2HA   GLY1146           HA2      GLY1146   6.751 -10.800  -1.101
  306    H    ASN1147           HN       ASN1147   9.315 -10.405  -1.515
  307    HA   ASN1147           HA       ASN1147  10.421 -10.109   1.057
  308   1HB   ASN1147           HB2      ASN1147  11.347 -11.309  -1.102
  309   2HB   ASN1147           HB1      ASN1147  12.119  -9.748  -1.379
  310   1HD2  ASN1147          1HD2      ASN1147  13.708  -9.030   0.019
  311   2HD2  ASN1147          2HD2      ASN1147  14.500 -10.086   1.133
  312    H    LYS1148           HN       LYS1148   9.921  -8.140   1.944
  313    HA   LYS1148           HA       LYS1148  10.284  -5.667   0.597
  314   1HB   LYS1148           HB2      LYS1148  10.091  -4.768   3.015
  315   2HB   LYS1148           HB1      LYS1148   8.704  -5.562   2.282
  316   1HG   LYS1148           HG2      LYS1148   8.890  -6.352   4.511
  317   2HG   LYS1148           HG1      LYS1148   9.391  -7.664   3.444
  318   1HD   LYS1148           HD2      LYS1148  11.745  -7.068   3.855
  319   2HD   LYS1148           HD1      LYS1148  11.216  -5.806   4.970
  320   1HE   LYS1148           HE2      LYS1148  10.150  -7.497   6.379
  321   2HE   LYS1148           HE1      LYS1148  10.675  -8.759   5.264
  322   1HZ   LYS1148           HZ1      LYS1148  12.977  -8.151   5.744
  323   2HZ   LYS1148           HZ3      LYS1148  12.449  -6.986   6.851
  324   3HZ   LYS1148           HZ2      LYS1148  12.156  -8.625   7.145
  325    H    ARG1149           HN       ARG1149  12.594  -7.740   1.362
  326    HA   ARG1149           HA       ARG1149  14.464  -5.727   2.401
  327   1HB   ARG1149           HB2      ARG1149  14.354  -7.948   3.538
  328   2HB   ARG1149           HB1      ARG1149  14.906  -8.696   2.045
  329   1HG   ARG1149           HG2      ARG1149  17.003  -7.533   2.170
  330   2HG   ARG1149           HG1      ARG1149  16.456  -6.628   3.582
  331   1HD   ARG1149           HD2      ARG1149  17.920  -8.467   4.231
  332   2HD   ARG1149           HD1      ARG1149  16.288  -8.703   4.856
  333    HE   ARG1149           HE       ARG1149  16.550 -10.014   2.376
  334   1HH1  ARG1149          1HH1      ARG1149  17.595 -10.259   5.691
  335   2HH1  ARG1149          2HH1      ARG1149  17.766 -11.981   5.645
  336   1HH2  ARG1149          1HH2      ARG1149  16.772 -12.282   2.306
  337   2HH2  ARG1149          2HH2      ARG1149  17.298 -13.132   3.720
  338    H    ILE1150           HN       ILE1150  15.487  -4.582   0.882
  339    HA   ILE1150           HA       ILE1150  16.255  -5.999  -1.586
  340    HB   ILE1150           HB       ILE1150  15.774  -4.217  -2.914
  341   1HG1  ILE1150          2HG1      ILE1150  17.275  -2.638  -1.697
  342   2HG1  ILE1150          1HG1      ILE1150  15.807  -1.886  -2.304
  343   1HG2  ILE1150          3HG2      ILE1150  13.697  -4.935  -1.905
  344   2HG2  ILE1150          2HG2      ILE1150  13.908  -3.779  -0.591
  345   3HG2  ILE1150          1HG2      ILE1150  13.647  -3.205  -2.238
  346   1HD1  ILE1150          3HD1      ILE1150  14.837  -2.045  -0.042
  347   2HD1  ILE1150          2HD1      ILE1150  16.378  -2.680   0.535
  348   3HD1  ILE1150          1HD1      ILE1150  16.289  -1.043  -0.122
  349    H    THR1151           HN       THR1151  18.091  -4.610  -2.734
  350    HA   THR1151           HA       THR1151  20.090  -3.705  -0.827
  351    HB   THR1151           HB       THR1151  20.627  -6.030  -2.687
  352    HG1  THR1151           HG1      THR1151  19.806  -7.069  -1.022
  353   1HG2  THR1151          2HG2      THR1151  22.562  -4.547  -2.420
  354   2HG2  THR1151          1HG2      THR1151  22.421  -4.680  -0.666
  355   3HG2  THR1151          3HG2      THR1151  22.829  -6.101  -1.628
  356    H    CYS1152           HN       CYS1152  21.438  -2.208  -1.673
  357    HA   CYS1152           HA       CYS1152  20.869  -1.169  -4.274
  358   1HB   CYS1152           HB2      CYS1152  22.790   0.396  -3.707
  359   2HB   CYS1152           HB1      CYS1152  21.413   0.428  -2.613
  360    H    ARG1153           HN       ARG1153  22.016  -1.315  -6.119
  361    HA   ARG1153           HA       ARG1153  24.465  -2.949  -6.058
  362   1HB   ARG1153           HB2      ARG1153  23.784  -3.667  -8.401
  363   2HB   ARG1153           HB1      ARG1153  22.867  -4.347  -7.066
  364   1HG   ARG1153           HG2      ARG1153  21.921  -1.928  -8.567
  365   2HG   ARG1153           HG1      ARG1153  21.569  -3.570  -9.110
  366   1HD   ARG1153           HD2      ARG1153  20.777  -2.306  -6.487
  367   2HD   ARG1153           HD1      ARG1153  19.711  -2.769  -7.813
  368    HE   ARG1153           HE       ARG1153  20.922  -4.530  -5.849
  369   1HH1  ARG1153          1HH1      ARG1153  19.201  -4.237  -8.865
  370   2HH1  ARG1153          2HH1      ARG1153  18.597  -5.860  -8.827
  371   1HH2  ARG1153          1HH2      ARG1153  20.133  -6.668  -5.791
  372   2HH2  ARG1153          2HH2      ARG1153  19.126  -7.241  -7.078
  373    H    ASN1154           HN       ASN1154  26.140  -1.715  -6.494
  374    HA   ASN1154           HA       ASN1154  27.490  -0.122  -7.391
  375   1HB   ASN1154           HB2      ASN1154  25.665  -0.447  -9.786
  376   2HB   ASN1154           HB1      ASN1154  27.260   0.302  -9.803
  377   1HD2  ASN1154          1HD2      ASN1154  26.245  -2.016 -11.259
  378   2HD2  ASN1154          2HD2      ASN1154  27.295  -3.326 -10.856
  379    H    GLY1155           HN       GLY1155  25.946   1.046  -5.669
  380   1HA   GLY1155           HA1      GLY1155  25.734   3.698  -6.447
  381   2HA   GLY1155           HA2      GLY1155  24.935   3.007  -5.043
  382    H    GLN1156           HN       GLN1156  23.157   1.267  -6.182
  383    HA   GLN1156           HA       GLN1156  21.112   3.046  -7.092
  384   1HB   GLN1156           HB2      GLN1156  22.259   2.730  -9.215
  385   2HB   GLN1156           HB1      GLN1156  22.199   0.984  -9.018
  386   1HG   GLN1156           HG2      GLN1156  19.761   1.054  -9.153
  387   2HG   GLN1156           HG1      GLN1156  19.822   2.805  -9.347
  388   1HE2  GLN1156          1HE2      GLN1156  20.422  -0.271 -10.842
  389   2HE2  GLN1156          2HE2      GLN1156  20.602   0.318 -12.456
  390    H    TRP1157           HN       TRP1157  19.859   2.284  -5.431
  391    HA   TRP1157           HA       TRP1157  19.556  -0.404  -4.691
  392   1HB   TRP1157           HB2      TRP1157  17.789   2.001  -4.286
  393   2HB   TRP1157           HB1      TRP1157  17.427   0.424  -3.597
  394    HD1  TRP1157           HD1      TRP1157  19.875   3.332  -3.268
  395    HE1  TRP1157           HE1      TRP1157  21.071   3.135  -0.995
  396    HE3  TRP1157           HE3      TRP1157  18.161  -1.257  -1.879
  397    HZ2  TRP1157           HZ2      TRP1157  21.268   1.237   1.107
  398    HZ3  TRP1157           HZ3      TRP1157  18.897  -2.206   0.263
  399    HH2  TRP1157           HH2      TRP1157  20.418  -0.990   1.722
  400    H    SER1158           HN       SER1158  17.165  -1.250  -4.553
  401    HA   SER1158           HA       SER1158  15.925  -1.156  -7.216
  402   1HB   SER1158           HB2      SER1158  16.503  -3.626  -5.562
  403   2HB   SER1158           HB1      SER1158  15.489  -3.609  -7.005
  404    HG   SER1158           HG       SER1158  17.280  -3.867  -8.056
  405    H    GLU1159           HN       GLU1159  13.817  -0.720  -7.134
  406    HA   GLU1159           HA       GLU1159  12.441  -0.085  -4.817
  407   1HB   GLU1159           HB2      GLU1159  11.762   0.667  -7.048
  408   2HB   GLU1159           HB1      GLU1159  11.307  -0.977  -7.475
  409   1HG   GLU1159           HG2      GLU1159   9.572  -0.947  -5.760
  410   2HG   GLU1159           HG1      GLU1159  10.029   0.701  -5.327
  411    HA   PRO1160           HA       PRO1160  11.385  -3.850  -2.727
  412   1HB   PRO1160           HB2      PRO1160   8.732  -2.486  -2.475
  413   2HB   PRO1160           HB1      PRO1160   9.692  -3.312  -1.241
  414   1HG   PRO1160           HG2      PRO1160   9.656  -0.660  -1.362
  415   2HG   PRO1160           HG1      PRO1160  11.161  -1.528  -1.006
  416   1HD   PRO1160           HD2      PRO1160  10.304  -0.155  -3.503
  417   2HD   PRO1160           HD1      PRO1160  11.933  -0.354  -2.826
  418    HA   PRO1161           HA       PRO1161   9.249  -6.690  -5.310
  419   1HB   PRO1161           HB2      PRO1161   7.185  -7.530  -3.579
  420   2HB   PRO1161           HB1      PRO1161   8.763  -8.289  -3.792
  421   1HG   PRO1161           HG2      PRO1161   7.840  -6.394  -1.696
  422   2HG   PRO1161           HG1      PRO1161   9.011  -7.721  -1.580
  423   1HD   PRO1161           HD2      PRO1161   9.806  -5.167  -1.634
  424   2HD   PRO1161           HD1      PRO1161  10.737  -6.439  -2.456
  425    H    LYS1162           HN       LYS1162   6.424  -5.722  -3.377
  426    HA   LYS1162           HA       LYS1162   5.418  -4.101  -5.570
  427   1HB   LYS1162           HB2      LYS1162   4.608  -6.846  -5.111
  428   2HB   LYS1162           HB1      LYS1162   3.250  -5.741  -4.992
  429   1HG   LYS1162           HG2      LYS1162   3.755  -4.860  -7.209
  430   2HG   LYS1162           HG1      LYS1162   5.144  -5.943  -7.324
  431   1HD   LYS1162           HD2      LYS1162   3.629  -7.874  -7.129
  432   2HD   LYS1162           HD1      LYS1162   2.253  -6.770  -7.078
  433   1HE   LYS1162           HE2      LYS1162   4.208  -7.065  -9.354
  434   2HE   LYS1162           HE1      LYS1162   2.563  -7.695  -9.315
  435   1HZ   LYS1162           HZ3      LYS1162   1.739  -5.428  -9.154
  436   2HZ   LYS1162           HZ2      LYS1162   3.318  -4.826  -9.197
  437   3HZ   LYS1162           HZ1      LYS1162   2.682  -5.624 -10.545
  438    H    CYS1163           HN       CYS1163   4.099  -2.507  -4.900
  439    HA   CYS1163           HA       CYS1163   3.403  -2.426  -2.056
  440   1HB   CYS1163           HB2      CYS1163   4.719  -0.554  -3.254
  441   2HB   CYS1163           HB1      CYS1163   3.174  -0.128  -3.987
  442    H    LEU1164           HN       LEU1164   1.537  -3.674  -2.044
  443    HA   LEU1164           HA       LEU1164  -0.572  -3.430  -3.900
  444   1HB   LEU1164           HB2      LEU1164  -0.274  -4.640  -1.190
  445   2HB   LEU1164           HB1      LEU1164  -1.885  -4.451  -1.855
  446    HG   LEU1164           HG       LEU1164  -0.947  -6.700  -2.244
  447   1HD1  LEU1164          1HD1      LEU1164  -1.356  -5.065  -4.742
  448   2HD1  LEU1164          3HD1      LEU1164  -1.460  -6.822  -4.632
  449   3HD1  LEU1164          2HD1      LEU1164  -2.621  -5.815  -3.767
  450   1HD2  LEU1164          1HD2      LEU1164   1.407  -6.088  -2.432
  451   2HD2  LEU1164          3HD2      LEU1164   0.870  -7.003  -3.841
  452   3HD2  LEU1164          2HD2      LEU1164   1.075  -5.254  -3.950
  453    H    HIS1165           HN       HIS1165  -1.671  -1.614  -4.233
  454    HA   HIS1165           HA       HIS1165  -1.938   0.569  -2.590
  455   1HB   HIS1165           HB2      HIS1165  -3.987  -0.469  -4.563
  456   2HB   HIS1165           HB1      HIS1165  -3.931   1.169  -3.918
  457    HD1  HIS1165           HD1      HIS1165  -2.374   2.807  -5.036
  458    HD2  HIS1165           HD2      HIS1165  -1.836  -1.095  -6.359
  459    HE1  HIS1165           HE1      HIS1165  -0.830   2.974  -7.014
  460    HE2  HIS1165           HE2      HIS1165  -0.588   0.610  -7.850
  461    HA   PRO1166           HA       PRO1166  -4.397  -0.855   0.802
  462   1HB   PRO1166           HB2      PRO1166  -5.320   1.567   1.673
  463   2HB   PRO1166           HB1      PRO1166  -3.693   0.961   1.997
  464   1HG   PRO1166           HG2      PRO1166  -4.618   2.884  -0.103
  465   2HG   PRO1166           HG1      PRO1166  -3.174   2.959   0.925
  466   1HD   PRO1166           HD2      PRO1166  -3.055   2.141  -1.636
  467   2HD   PRO1166           HD1      PRO1166  -2.013   1.444  -0.380
  468    H    CYS1167           HN       CYS1167  -6.662   0.019   1.795
  469    HA   CYS1167           HA       CYS1167  -8.608  -0.757  -0.157
  470   1HB   CYS1167           HB2      CYS1167  -8.619  -1.335   2.327
  471   2HB   CYS1167           HB1      CYS1167  -9.175   0.313   2.602
  472    H    VAL1168           HN       VAL1168  -7.945   1.209  -1.516
  473    HA   VAL1168           HA       VAL1168  -9.351   3.632  -0.668
  474    HB   VAL1168           HB       VAL1168  -7.555   3.230  -3.065
  475   1HG1  VAL1168          2HG1      VAL1168  -9.211   5.034  -3.312
  476   2HG1  VAL1168          1HG1      VAL1168  -8.616   5.764  -1.821
  477   3HG1  VAL1168          3HG1      VAL1168  -7.559   5.650  -3.228
  478   1HG2  VAL1168          3HG2      VAL1168  -6.968   4.480  -0.383
  479   2HG2  VAL1168          2HG2      VAL1168  -6.311   2.962  -0.994
  480   3HG2  VAL1168          1HG2      VAL1168  -5.884   4.485  -1.774
  481    H    ILE1169           HN       ILE1169 -11.480   2.791  -0.975
  482    HA   ILE1169           HA       ILE1169 -12.266   1.972  -3.647
  483    HB   ILE1169           HB       ILE1169 -13.217   1.202  -1.292
  484   1HG1  ILE1169          2HG1      ILE1169 -14.931   1.621  -3.751
  485   2HG1  ILE1169          1HG1      ILE1169 -13.892   0.235  -3.426
  486   1HG2  ILE1169          2HG2      ILE1169 -14.992   3.523  -2.013
  487   2HG2  ILE1169          1HG2      ILE1169 -15.334   2.315  -0.774
  488   3HG2  ILE1169          3HG2      ILE1169 -13.954   3.396  -0.592
  489   1HD1  ILE1169          3HD1      ILE1169 -15.314  -0.158  -1.364
  490   2HD1  ILE1169          2HD1      ILE1169 -16.441   1.010  -2.051
  491   3HD1  ILE1169          1HD1      ILE1169 -16.070  -0.475  -2.925
  492    H    SER1170           HN       SER1170 -14.591   3.097  -4.238
  493    HA   SER1170           HA       SER1170 -13.859   5.844  -4.770
  494   1HB   SER1170           HB2      SER1170 -14.855   4.432  -6.538
  495   2HB   SER1170           HB1      SER1170 -16.340   4.321  -5.594
  496    HG   SER1170           HG       SER1170 -16.037   6.047  -7.338
  497    H    ARG1171           HN       ARG1171 -14.123   7.198  -3.101
  498    HA   ARG1171           HA       ARG1171 -16.388   7.010  -1.299
  499   1HB   ARG1171           HB2      ARG1171 -15.369   8.989  -0.221
  500   2HB   ARG1171           HB1      ARG1171 -14.223   7.669  -0.405
  501   1HG   ARG1171           HG2      ARG1171 -13.286   8.781  -2.385
  502   2HG   ARG1171           HG1      ARG1171 -14.409  10.121  -2.143
  503   1HD   ARG1171           HD2      ARG1171 -13.422  10.562   0.045
  504   2HD   ARG1171           HD1      ARG1171 -12.312   9.210  -0.177
  505    HE   ARG1171           HE       ARG1171 -12.102  11.094  -2.300
  506   1HH1  ARG1171          1HH1      ARG1171 -11.178  10.510   1.010
  507   2HH1  ARG1171          2HH1      ARG1171  -9.761  11.501   0.925
  508   1HH2  ARG1171          1HH2      ARG1171 -10.237  12.400  -2.421
  509   2HH2  ARG1171          2HH2      ARG1171  -9.226  12.575  -1.026
  510    H    GLU1172           HN       GLU1172 -16.544   7.712  -4.270
  511    HA   GLU1172           HA       GLU1172 -18.338  10.009  -3.917
  512   1HB   GLU1172           HB2      GLU1172 -16.182  10.715  -4.978
  513   2HB   GLU1172           HB1      GLU1172 -16.516   9.603  -6.298
  514   1HG   GLU1172           HG2      GLU1172 -18.547  10.851  -6.835
  515   2HG   GLU1172           HG1      GLU1172 -18.203  11.971  -5.517
  516    H    ILE1173           HN       ILE1173 -18.000   6.848  -4.713
  517    HA   ILE1173           HA       ILE1173 -20.289   6.934  -6.560
  518    HB   ILE1173           HB       ILE1173 -17.843   5.849  -7.127
  519   1HG1  ILE1173          2HG1      ILE1173 -19.209   4.509  -8.877
  520   2HG1  ILE1173          1HG1      ILE1173 -20.609   5.302  -8.157
  521   1HG2  ILE1173          3HG2      ILE1173 -19.619   3.589  -6.244
  522   2HG2  ILE1173          2HG2      ILE1173 -18.126   3.422  -7.167
  523   3HG2  ILE1173          1HG2      ILE1173 -18.079   4.059  -5.523
  524   1HD1  ILE1173          3HD1      ILE1173 -18.233   6.681  -9.361
  525   2HD1  ILE1173          2HD1      ILE1173 -19.818   6.493 -10.112
  526   3HD1  ILE1173          1HD1      ILE1173 -19.642   7.470  -8.654
  527    H    MET1174           HN       MET1174 -18.983   5.608  -3.613
  528    HA   MET1174           HA       MET1174 -21.233   3.773  -3.377
  529   1HB   MET1174           HB2      MET1174 -19.972   2.515  -1.944
  530   2HB   MET1174           HB1      MET1174 -18.681   3.262  -2.865
  531   1HG   MET1174           HG2      MET1174 -17.911   3.545  -0.747
  532   2HG   MET1174           HG1      MET1174 -18.775   5.065  -0.982
  533   1HE   MET1174           HE1      MET1174 -18.020   4.195   1.911
  534   2HE   MET1174           HE3      MET1174 -19.016   5.609   1.564
  535   3HE   MET1174           HE2      MET1174 -19.540   4.437   2.773
  536    H    GLU1175           HN       GLU1175 -19.590   6.298  -1.460
  537    HA   GLU1175           HA       GLU1175 -21.726   6.477   0.425
  538   1HB   GLU1175           HB2      GLU1175 -20.484   8.193   1.461
  539   2HB   GLU1175           HB1      GLU1175 -19.260   7.113   0.800
  540   1HG   GLU1175           HG2      GLU1175 -18.876   8.591  -1.049
  541   2HG   GLU1175           HG1      GLU1175 -20.205   9.632  -0.544
  542    H    ASN1176           HN       ASN1176 -22.164   6.959  -2.587
  543    HA   ASN1176           HA       ASN1176 -23.607   9.494  -2.266
  544   1HB   ASN1176           HB2      ASN1176 -21.618   8.724  -4.232
  545   2HB   ASN1176           HB1      ASN1176 -23.121   9.256  -4.972
  546   1HD2  ASN1176          1HD2      ASN1176 -20.490  10.520  -4.932
  547   2HD2  ASN1176          2HD2      ASN1176 -20.725  12.088  -4.246
  548    H    TYR1177           HN       TYR1177 -23.660   6.243  -3.721
  549    HA   TYR1177           HA       TYR1177 -26.374   6.868  -4.617
  550   1HB   TYR1177           HB2      TYR1177 -26.281   4.935  -6.104
  551   2HB   TYR1177           HB1      TYR1177 -25.020   6.106  -6.443
  552    HD1  TYR1177           HD1      TYR1177 -24.404   3.942  -3.592
  553    HD2  TYR1177           HD2      TYR1177 -24.015   4.317  -7.813
  554    HE1  TYR1177           HE1      TYR1177 -22.739   2.131  -3.601
  555    HE2  TYR1177           HE2      TYR1177 -22.350   2.513  -7.829
  556    HH   TYR1177           HH       TYR1177 -21.807   0.488  -5.163
  557    H    ASN1178           HN       ASN1178 -26.167   6.511  -1.974
  558    HA   ASN1178           HA       ASN1178 -27.567   5.626  -0.425
  559   1HB   ASN1178           HB2      ASN1178 -28.200   3.395  -2.342
  560   2HB   ASN1178           HB1      ASN1178 -29.105   3.857  -0.904
  561   1HD2  ASN1178          1HD2      ASN1178 -29.976   3.666  -3.666
  562   2HD2  ASN1178          2HD2      ASN1178 -30.590   5.225  -4.083
  563    H    ILE1179           HN       ILE1179 -24.635   4.721  -0.767
  564    HA   ILE1179           HA       ILE1179 -25.023   2.586   1.202
  565    HB   ILE1179           HB       ILE1179 -23.463   1.075   0.315
  566   1HG1  ILE1179          2HG1      ILE1179 -22.858   2.952  -1.963
  567   2HG1  ILE1179          1HG1      ILE1179 -21.871   2.857  -0.507
  568   1HG2  ILE1179          1HG2      ILE1179 -25.658   0.956  -0.707
  569   2HG2  ILE1179          3HG2      ILE1179 -25.152   2.088  -1.962
  570   3HG2  ILE1179          2HG2      ILE1179 -24.407   0.493  -1.860
  571   1HD1  ILE1179          3HD1      ILE1179 -22.434   0.565  -2.370
  572   2HD1  ILE1179          2HD1      ILE1179 -20.960   1.534  -2.357
  573   3HD1  ILE1179          1HD1      ILE1179 -21.373   0.537  -0.962
  574    H    ALA1180           HN       ALA1180 -23.596   2.502   2.845
  575    HA   ALA1180           HA       ALA1180 -21.361   4.418   2.816
  576   1HB   ALA1180           HB1      ALA1180 -23.234   5.431   4.020
  577   2HB   ALA1180           HB3      ALA1180 -23.315   4.027   5.084
  578   3HB   ALA1180           HB2      ALA1180 -21.896   5.074   5.111
  579    H    LEU1181           HN       LEU1181 -21.259   3.523   5.837
  580    HA   LEU1181           HA       LEU1181 -20.024   0.897   5.350
  581   1HB   LEU1181           HB2      LEU1181 -18.637   3.229   5.954
  582   2HB   LEU1181           HB1      LEU1181 -18.749   2.392   7.490
  583    HG   LEU1181           HG       LEU1181 -17.929   0.340   5.994
  584   1HD1  LEU1181          2HD1      LEU1181 -17.907   1.613   3.914
  585   2HD1  LEU1181          1HD1      LEU1181 -16.770   2.761   4.621
  586   3HD1  LEU1181          3HD1      LEU1181 -16.281   1.087   4.354
  587   1HD2  LEU1181          2HD2      LEU1181 -16.153   2.506   7.104
  588   2HD2  LEU1181          1HD2      LEU1181 -16.817   1.134   7.992
  589   3HD2  LEU1181          3HD2      LEU1181 -15.638   0.867   6.707
  590    H    ARG1182           HN       ARG1182 -19.556  -0.223   7.541
  591    HA   ARG1182           HA       ARG1182 -22.026  -0.596   8.841
  592   1HB   ARG1182           HB2      ARG1182 -20.724  -2.021  10.426
  593   2HB   ARG1182           HB1      ARG1182 -20.484  -2.422   8.732
  594   1HG   ARG1182           HG2      ARG1182 -18.366  -1.198   8.744
  595   2HG   ARG1182           HG1      ARG1182 -18.606  -0.816  10.450
  596   1HD   ARG1182           HD2      ARG1182 -18.598  -3.201  10.987
  597   2HD   ARG1182           HD1      ARG1182 -18.362  -3.586   9.282
  598    HE   ARG1182           HE       ARG1182 -16.316  -1.857  10.105
  599   1HH1  ARG1182          1HH1      ARG1182 -17.418  -5.121  10.628
  600   2HH1  ARG1182          2HH1      ARG1182 -15.836  -5.737  10.971
  601   1HH2  ARG1182          1HH2      ARG1182 -14.230  -2.659  10.555
  602   2HH2  ARG1182          2HH2      ARG1182 -14.024  -4.338  10.931
  603    H    TRP1183           HN       TRP1183 -20.126   2.004   9.093
  604    HA   TRP1183           HA       TRP1183 -20.698   2.422  11.948
  605   1HB   TRP1183           HB2      TRP1183 -18.756   3.982  10.232
  606   2HB   TRP1183           HB1      TRP1183 -18.913   4.037  11.986
  607    HD1  TRP1183           HD1      TRP1183 -17.932   1.476   9.247
  608    HE1  TRP1183           HE1      TRP1183 -16.163  -0.109  10.235
  609    HE3  TRP1183           HE3      TRP1183 -17.790   3.288  14.028
  610    HZ2  TRP1183           HZ2      TRP1183 -14.872  -0.528  12.694
  611    HZ3  TRP1183           HZ3      TRP1183 -16.253   2.236  15.638
  612    HH2  TRP1183           HH2      TRP1183 -14.824   0.366  14.984
  613    H    THR1184           HN       THR1184 -21.380   3.412   8.747
  614    HA   THR1184           HA       THR1184 -22.667   5.027   7.817
  615    HB   THR1184           HB       THR1184 -24.771   5.571   9.009
  616    HG1  THR1184           HG1      THR1184 -25.053   4.316  11.035
  617   1HG2  THR1184          2HG2      THR1184 -24.579   3.539   7.657
  618   2HG2  THR1184          1HG2      THR1184 -24.009   2.651   9.070
  619   3HG2  THR1184          3HG2      THR1184 -25.652   3.293   9.036
  620    H    ALA1185           HN       ALA1185 -21.111   6.647   7.752
  621    HA   ALA1185           HA       ALA1185 -21.763   8.944   9.417
  622   1HB   ALA1185           HB3      ALA1185 -18.940   7.906   9.199
  623   2HB   ALA1185           HB1      ALA1185 -19.959   7.827  10.637
  624   3HB   ALA1185           HB2      ALA1185 -19.444   9.391  10.006
  625    H    LYS1186           HN       LYS1186 -19.201   7.989   7.125
  626    HA   LYS1186           HA       LYS1186 -20.042   9.250   4.870
  627   1HB   LYS1186           HB2      LYS1186 -19.022  11.429   4.823
  628   2HB   LYS1186           HB1      LYS1186 -20.073  11.345   6.226
  629   1HG   LYS1186           HG2      LYS1186 -17.099  10.920   6.359
  630   2HG   LYS1186           HG1      LYS1186 -17.878  12.485   6.591
  631   1HD   LYS1186           HD2      LYS1186 -19.137  11.589   8.479
  632   2HD   LYS1186           HD1      LYS1186 -18.386  10.009   8.240
  633   1HE   LYS1186           HE2      LYS1186 -16.191  10.981   8.691
  634   2HE   LYS1186           HE1      LYS1186 -16.931  12.564   8.914
  635   1HZ   LYS1186           HZ3      LYS1186 -18.165  11.681  10.795
  636   2HZ   LYS1186           HZ2      LYS1186 -17.452  10.162  10.582
  637   3HZ   LYS1186           HZ1      LYS1186 -16.499  11.487  11.028
  638    H    GLN1187           HN       GLN1187 -18.900   8.032   3.557
  639    HA   GLN1187           HA       GLN1187 -17.120   7.208   2.401
  640   1HB   GLN1187           HB2      GLN1187 -16.096   9.426   2.623
  641   2HB   GLN1187           HB1      GLN1187 -15.479   8.995   4.212
  642   1HG   GLN1187           HG2      GLN1187 -14.120   7.224   3.165
  643   2HG   GLN1187           HG1      GLN1187 -14.687   7.763   1.585
  644   1HE2  GLN1187          1HE2      GLN1187 -11.980   7.670   2.673
  645   2HE2  GLN1187          2HE2      GLN1187 -11.371   9.283   2.573
  646    H    LYS1188           HN       LYS1188 -15.150   7.580   5.270
  647    HA   LYS1188           HA       LYS1188 -14.011   5.995   6.480
  648   1HB   LYS1188           HB2      LYS1188 -16.338   6.201   7.504
  649   2HB   LYS1188           HB1      LYS1188 -16.726   4.695   6.686
  650   1HG   LYS1188           HG2      LYS1188 -16.134   4.243   8.972
  651   2HG   LYS1188           HG1      LYS1188 -14.889   3.591   7.906
  652   1HD   LYS1188           HD2      LYS1188 -13.489   5.551   8.341
  653   2HD   LYS1188           HD1      LYS1188 -14.736   6.206   9.405
  654   1HE   LYS1188           HE2      LYS1188 -13.238   3.620   9.809
  655   2HE   LYS1188           HE1      LYS1188 -12.956   5.126  10.682
  656   1HZ   LYS1188           HZ3      LYS1188 -15.473   3.547  10.729
  657   2HZ   LYS1188           HZ2      LYS1188 -14.317   3.599  11.963
  658   3HZ   LYS1188           HZ1      LYS1188 -15.197   4.989  11.571
  659    H    LEU1189           HN       LEU1189 -14.349   5.461   3.574
  660    HA   LEU1189           HA       LEU1189 -14.294   2.533   3.490
  661   1HB   LEU1189           HB2      LEU1189 -14.326   3.048   0.962
  662   2HB   LEU1189           HB1      LEU1189 -15.795   3.216   1.904
  663    HG   LEU1189           HG       LEU1189 -15.140   5.700   2.115
  664   1HD1  LEU1189          2HD1      LEU1189 -12.828   5.250   1.257
  665   2HD1  LEU1189          1HD1      LEU1189 -13.545   5.040  -0.340
  666   3HD1  LEU1189          3HD1      LEU1189 -13.679   6.592   0.488
  667   1HD2  LEU1189          2HD2      LEU1189 -16.994   4.771   0.734
  668   2HD2  LEU1189          1HD2      LEU1189 -16.281   6.252   0.096
  669   3HD2  LEU1189          3HD2      LEU1189 -15.874   4.695  -0.623
  670    H    TYR1190           HN       TYR1190 -12.092   3.868   4.621
  671    HA   TYR1190           HA       TYR1190 -10.017   3.229   2.633
  672   1HB   TYR1190           HB2      TYR1190 -10.301   5.592   4.414
  673   2HB   TYR1190           HB1      TYR1190  -8.679   4.943   4.192
  674    HD1  TYR1190           HD1      TYR1190 -11.363   4.986   1.623
  675    HD2  TYR1190           HD2      TYR1190  -7.708   6.711   2.975
  676    HE1  TYR1190           HE1      TYR1190 -11.155   6.217  -0.498
  677    HE2  TYR1190           HE2      TYR1190  -7.497   7.941   0.857
  678    HH   TYR1190           HH       TYR1190 -10.042   8.241  -1.356
  679    H    SER1191           HN       SER1191  -8.768   1.596   3.216
  680    HA   SER1191           HA       SER1191  -8.118   1.187   6.041
  681   1HB   SER1191           HB2      SER1191  -9.366  -0.890   4.231
  682   2HB   SER1191           HB1      SER1191  -8.514  -1.301   5.718
  683    HG   SER1191           HG       SER1191 -10.164   0.551   6.440
  684    H    ARG1192           HN       ARG1192  -6.635  -0.939   6.066
  685    HA   ARG1192           HA       ARG1192  -4.503  -0.415   4.118
  686   1HB   ARG1192           HB2      ARG1192  -3.895  -0.179   6.503
  687   2HB   ARG1192           HB1      ARG1192  -4.390  -1.841   6.788
  688   1HG   ARG1192           HG2      ARG1192  -2.631  -2.649   5.333
  689   2HG   ARG1192           HG1      ARG1192  -2.163  -0.991   4.948
  690   1HD   ARG1192           HD2      ARG1192  -2.072  -2.256   7.685
  691   2HD   ARG1192           HD1      ARG1192  -0.685  -1.993   6.629
  692    HE   ARG1192           HE       ARG1192  -2.141   0.412   7.182
  693   1HH1  ARG1192          1HH1      ARG1192   0.301  -1.765   8.380
  694   2HH1  ARG1192          2HH1      ARG1192   1.075  -0.564   9.357
  695   1HH2  ARG1192          1HH2      ARG1192  -1.127   2.001   8.466
  696   2HH2  ARG1192          2HH2      ARG1192   0.264   1.576   9.407
  697    H    THR1193           HN       THR1193  -4.256  -1.844   2.525
  698    HA   THR1193           HA       THR1193  -5.814  -3.932   1.906
  699    HB   THR1193           HB       THR1193  -2.828  -3.821   1.430
  700    HG1  THR1193           HG1      THR1193  -4.231  -3.331  -0.747
  701   1HG2  THR1193          1HG2      THR1193  -4.933  -5.495   0.056
  702   2HG2  THR1193          3HG2      THR1193  -3.245  -5.361  -0.436
  703   3HG2  THR1193          2HG2      THR1193  -3.657  -6.097   1.113
  704    H    GLY1194           HN       GLY1194  -6.451  -5.629   2.988
  705   1HA   GLY1194           HA1      GLY1194  -4.581  -6.924   4.862
  706   2HA   GLY1194           HA2      GLY1194  -5.515  -7.882   3.719
  707    H    GLU1195           HN       GLU1195  -7.032  -5.080   4.958
  708    HA   GLU1195           HA       GLU1195  -8.415  -6.606   7.047
  709   1HB   GLU1195           HB2      GLU1195  -8.420  -3.636   6.473
  710   2HB   GLU1195           HB1      GLU1195  -9.243  -4.415   7.817
  711   1HG   GLU1195           HG2      GLU1195  -6.268  -4.376   7.354
  712   2HG   GLU1195           HG1      GLU1195  -7.152  -3.386   8.515
  713    H    SER1196           HN       SER1196 -10.688  -6.684   7.145
  714    HA   SER1196           HA       SER1196 -11.959  -6.522   4.522
  715   1HB   SER1196           HB2      SER1196 -13.752  -7.865   5.539
  716   2HB   SER1196           HB1      SER1196 -12.177  -8.621   5.776
  717    HG   SER1196           HG       SER1196 -12.180  -7.623   7.889
  718    H    VAL1197           HN       VAL1197 -13.224  -4.880   3.976
  719    HA   VAL1197           HA       VAL1197 -14.238  -3.121   6.098
  720    HB   VAL1197           HB       VAL1197 -13.856  -2.602   3.147
  721   1HG1  VAL1197          2HG1      VAL1197 -15.843  -1.444   3.947
  722   2HG1  VAL1197          1HG1      VAL1197 -14.922  -0.763   5.289
  723   3HG1  VAL1197          3HG1      VAL1197 -14.540  -0.298   3.632
  724   1HG2  VAL1197          2HG2      VAL1197 -11.786  -2.619   4.434
  725   2HG2  VAL1197          1HG2      VAL1197 -12.183  -0.983   3.908
  726   3HG2  VAL1197          3HG2      VAL1197 -12.476  -1.467   5.578
  727    H    GLU1198           HN       GLU1198 -16.343  -2.977   6.507
  728    HA   GLU1198           HA       GLU1198 -18.196  -4.350   4.684
  729   1HB   GLU1198           HB2      GLU1198 -18.353  -5.467   6.718
  730   2HB   GLU1198           HB1      GLU1198 -18.146  -3.995   7.657
  731   1HG   GLU1198           HG2      GLU1198 -20.367  -3.288   7.184
  732   2HG   GLU1198           HG1      GLU1198 -20.593  -4.593   6.018
  733    H    PHE1199           HN       PHE1199 -19.511  -3.119   3.536
  734    HA   PHE1199           HA       PHE1199 -19.973  -0.350   4.363
  735   1HB   PHE1199           HB2      PHE1199 -20.566  -1.757   1.746
  736   2HB   PHE1199           HB1      PHE1199 -20.864  -0.051   2.064
  737    HD1  PHE1199           HD1      PHE1199 -19.176   1.541   1.727
  738    HD2  PHE1199           HD2      PHE1199 -18.181  -2.595   1.881
  739    HE1  PHE1199           HE1      PHE1199 -16.881   2.073   0.982
  740    HE2  PHE1199           HE2      PHE1199 -15.897  -2.077   1.145
  741    HZ   PHE1199           HZ       PHE1199 -15.243   0.255   0.696
  742    H    VAL1200           HN       VAL1200 -22.262   0.475   3.734
  743    HA   VAL1200           HA       VAL1200 -24.324  -1.509   4.395
  744    HB   VAL1200           HB       VAL1200 -25.415   0.023   5.948
  745   1HG1  VAL1200          3HG1      VAL1200 -22.530  -0.492   6.656
  746   2HG1  VAL1200          2HG1      VAL1200 -23.819  -0.130   7.803
  747   3HG1  VAL1200          1HG1      VAL1200 -23.871  -1.618   6.858
  748   1HG2  VAL1200          1HG2      VAL1200 -24.651   2.131   5.010
  749   2HG2  VAL1200          3HG2      VAL1200 -24.275   2.047   6.730
  750   3HG2  VAL1200          2HG2      VAL1200 -23.004   1.786   5.537
  751    H    CYS1201           HN       CYS1201 -26.462   0.282   4.550
  752    HA   CYS1201           HA       CYS1201 -26.453   1.521   1.882
  753   1HB   CYS1201           HB2      CYS1201 -28.817   0.072   3.085
  754   2HB   CYS1201           HB1      CYS1201 -28.689   0.747   1.466
  755    H    LYS1202           HN       LYS1202 -27.223   3.520   1.758
  756    HA   LYS1202           HA       LYS1202 -27.499   5.243   3.821
  757   1HB   LYS1202           HB2      LYS1202 -27.486   5.752   1.340
  758   2HB   LYS1202           HB1      LYS1202 -29.206   5.399   1.335
  759   1HG   LYS1202           HG2      LYS1202 -29.544   7.207   2.983
  760   2HG   LYS1202           HG1      LYS1202 -27.826   7.596   2.857
  761   1HD   LYS1202           HD2      LYS1202 -29.851   7.678   0.618
  762   2HD   LYS1202           HD1      LYS1202 -29.135   9.070   1.433
  763   1HE   LYS1202           HE2      LYS1202 -26.925   8.423   0.629
  764   2HE   LYS1202           HE1      LYS1202 -27.629   7.030  -0.188
  765   1HZ   LYS1202           HZ1      LYS1202 -28.251   9.874  -0.777
  766   2HZ   LYS1202           HZ3      LYS1202 -27.271   8.863  -1.717
  767   3HZ   LYS1202           HZ2      LYS1202 -28.923   8.535  -1.565
  768    H    ARG1203           HN       ARG1203 -28.638   4.766   5.596
  769    HA   ARG1203           HA       ARG1203 -30.571   3.369   6.422
  770   1HB   ARG1203           HB2      ARG1203 -30.696   6.368   6.675
  771   2HB   ARG1203           HB1      ARG1203 -31.585   5.243   7.690
  772   1HG   ARG1203           HG2      ARG1203 -29.489   4.309   8.509
  773   2HG   ARG1203           HG1      ARG1203 -28.588   5.420   7.474
  774   1HD   ARG1203           HD2      ARG1203 -30.457   6.206   9.709
  775   2HD   ARG1203           HD1      ARG1203 -28.695   6.224   9.784
  776    HE   ARG1203           HE       ARG1203 -29.583   7.790   7.611
  777   1HH1  ARG1203          1HH1      ARG1203 -29.424   7.806  11.091
  778   2HH1  ARG1203          2HH1      ARG1203 -29.373   9.532  11.210
  779   1HH2  ARG1203          1HH2      ARG1203 -29.517  10.064   7.757
  780   2HH2  ARG1203          2HH2      ARG1203 -29.426  10.817   9.314
  781    H    GLY1204           HN       GLY1204 -31.880   2.439   4.864
  782   1HA   GLY1204           HA1      GLY1204 -33.852   4.176   3.550
  783   2HA   GLY1204           HA2      GLY1204 -34.423   2.858   4.561
  784    H    TYR1205           HN       TYR1205 -32.126   3.397   1.880
  785    HA   TYR1205           HA       TYR1205 -33.400   1.686   0.085
  786   1HB   TYR1205           HB2      TYR1205 -30.456   2.333   0.125
  787   2HB   TYR1205           HB1      TYR1205 -31.409   1.836  -1.266
  788    HD1  TYR1205           HD1      TYR1205 -30.726   4.595   1.074
  789    HD2  TYR1205           HD2      TYR1205 -32.777   3.413  -2.458
  790    HE1  TYR1205           HE1      TYR1205 -31.192   6.953   0.562
  791    HE2  TYR1205           HE2      TYR1205 -33.250   5.767  -2.981
  792    HH   TYR1205           HH       TYR1205 -33.428   7.915  -1.800
  793    H    ARG1206           HN       ARG1206 -33.167  -0.419  -0.491
  794    HA   ARG1206           HA       ARG1206 -31.708  -2.115   1.423
  795   1HB   ARG1206           HB2      ARG1206 -33.311  -3.870   0.889
  796   2HB   ARG1206           HB1      ARG1206 -34.145  -2.418   1.421
  797   1HG   ARG1206           HG2      ARG1206 -34.633  -1.850  -0.911
  798   2HG   ARG1206           HG1      ARG1206 -33.816  -3.327  -1.430
  799   1HD   ARG1206           HD2      ARG1206 -35.428  -4.665  -0.169
  800   2HD   ARG1206           HD1      ARG1206 -36.249  -3.191   0.346
  801    HE   ARG1206           HE       ARG1206 -36.168  -3.163  -2.431
  802   1HH1  ARG1206          1HH1      ARG1206 -37.575  -5.088   0.109
  803   2HH1  ARG1206          2HH1      ARG1206 -38.940  -5.576  -0.840
  804   1HH2  ARG1206          1HH2      ARG1206 -37.960  -3.799  -3.688
  805   2HH2  ARG1206          2HH2      ARG1206 -39.159  -4.843  -2.999
  806    H    LEU1207           HN       LEU1207 -30.258  -3.573   0.735
  807    HA   LEU1207           HA       LEU1207 -28.746  -3.380  -1.466
  808   1HB   LEU1207           HB2      LEU1207 -29.575  -5.921  -0.074
  809   2HB   LEU1207           HB1      LEU1207 -28.309  -5.862  -1.285
  810    HG   LEU1207           HG       LEU1207 -28.255  -4.316   1.309
  811   1HD1  LEU1207          1HD1      LEU1207 -28.154  -6.722   1.712
  812   2HD1  LEU1207          3HD1      LEU1207 -26.838  -6.867   0.547
  813   3HD1  LEU1207          2HD1      LEU1207 -26.600  -5.955   2.037
  814   1HD2  LEU1207          2HD2      LEU1207 -26.968  -3.305  -0.521
  815   2HD2  LEU1207          1HD2      LEU1207 -25.922  -3.924   0.759
  816   3HD2  LEU1207          3HD2      LEU1207 -26.106  -4.828  -0.744
  817    H    SER1208           HN       SER1208 -28.740  -3.947  -3.585
  818    HA   SER1208           HA       SER1208 -31.302  -4.735  -4.728
  819   1HB   SER1208           HB2      SER1208 -30.123  -2.774  -5.658
  820   2HB   SER1208           HB1      SER1208 -28.764  -3.809  -6.096
  821    HG   SER1208           HG       SER1208 -29.807  -4.250  -7.851
  822    H    SER1209           HN       SER1209 -29.349  -6.586  -3.341
  823    HA   SER1209           HA       SER1209 -28.882  -8.811  -3.500
  824   1HB   SER1209           HB2      SER1209 -30.917  -9.098  -4.830
  825   2HB   SER1209           HB1      SER1209 -30.047  -8.615  -6.286
  826    HG   SER1209           HG       SER1209 -28.751 -10.456  -6.061
  827    H    ARG1210           HN       ARG1210 -28.222  -7.345  -6.691
  828    HA   ARG1210           HA       ARG1210 -25.716  -8.723  -6.922
  829   1HB   ARG1210           HB2      ARG1210 -26.855  -6.461  -8.577
  830   2HB   ARG1210           HB1      ARG1210 -25.458  -7.440  -9.004
  831   1HG   ARG1210           HG2      ARG1210 -26.867  -9.420  -9.137
  832   2HG   ARG1210           HG1      ARG1210 -28.272  -8.460  -8.672
  833   1HD   ARG1210           HD2      ARG1210 -27.994  -7.087 -10.682
  834   2HD   ARG1210           HD1      ARG1210 -26.598  -8.059 -11.149
  835    HE   ARG1210           HE       ARG1210 -28.742  -9.795 -10.800
  836   1HH1  ARG1210          1HH1      ARG1210 -27.837  -7.157 -12.888
  837   2HH1  ARG1210          2HH1      ARG1210 -28.750  -7.743 -14.237
  838   1HH2  ARG1210          1HH2      ARG1210 -29.947 -10.574 -12.572
  839   2HH2  ARG1210          2HH2      ARG1210 -29.951  -9.684 -14.058
  840    H    SER1211           HN       SER1211 -26.139  -6.894  -4.635
  841    HA   SER1211           HA       SER1211 -24.616  -4.536  -4.990
  842   1HB   SER1211           HB2      SER1211 -24.658  -4.389  -2.548
  843   2HB   SER1211           HB1      SER1211 -26.249  -4.837  -3.164
  844    HG   SER1211           HG       SER1211 -25.308  -7.103  -2.776
  845    H    HIS1212           HN       HIS1212 -23.641  -7.697  -5.058
  846    HA   HIS1212           HA       HIS1212 -21.616  -8.730  -5.008
  847   1HB   HIS1212           HB2      HIS1212 -20.578  -5.888  -4.991
  848   2HB   HIS1212           HB1      HIS1212 -19.588  -7.319  -5.262
  849    HD1  HIS1212           HD1      HIS1212 -21.803  -4.941  -6.973
  850    HD2  HIS1212           HD2      HIS1212 -20.159  -8.680  -7.736
  851    HE1  HIS1212           HE1      HIS1212 -22.082  -5.306  -9.446
  852    HE2  HIS1212           HE2      HIS1212 -21.002  -7.537  -9.898
  853    H    THR1213           HN       THR1213 -23.010  -8.188  -2.556
  854    HA   THR1213           HA       THR1213 -22.747  -8.512  -0.337
  855    HB   THR1213           HB       THR1213 -20.863  -9.611   0.537
  856    HG1  THR1213           HG1      THR1213 -19.123  -9.348  -1.559
  857   1HG2  THR1213          1HG2      THR1213 -21.047 -10.346  -2.386
  858   2HG2  THR1213          3HG2      THR1213 -20.352 -11.354  -1.117
  859   3HG2  THR1213          2HG2      THR1213 -22.071 -10.963  -1.090
  860    H    LEU1214           HN       LEU1214 -22.582  -7.208   1.361
  861    HA   LEU1214           HA       LEU1214 -21.651  -4.563   1.056
  862   1HB   LEU1214           HB2      LEU1214 -22.504  -6.161   3.463
  863   2HB   LEU1214           HB1      LEU1214 -22.037  -4.476   3.571
  864    HG   LEU1214           HG       LEU1214 -24.220  -5.341   1.701
  865   1HD1  LEU1214          3HD1      LEU1214 -24.808  -6.224   3.900
  866   2HD1  LEU1214          2HD1      LEU1214 -24.532  -4.636   4.616
  867   3HD1  LEU1214          1HD1      LEU1214 -25.844  -4.867   3.459
  868   1HD2  LEU1214          1HD2      LEU1214 -23.186  -3.071   1.561
  869   2HD2  LEU1214          3HD2      LEU1214 -24.920  -3.068   1.884
  870   3HD2  LEU1214          2HD2      LEU1214 -23.779  -2.764   3.194
  871    H    ARG1215           HN       ARG1215 -20.457  -7.208   3.115
  872    HA   ARG1215           HA       ARG1215 -18.011  -5.756   3.669
  873   1HB   ARG1215           HB2      ARG1215 -19.153  -7.118   5.411
  874   2HB   ARG1215           HB1      ARG1215 -18.796  -8.562   4.475
  875   1HG   ARG1215           HG2      ARG1215 -16.406  -8.152   4.736
  876   2HG   ARG1215           HG1      ARG1215 -16.758  -6.691   5.662
  877   1HD   ARG1215           HD2      ARG1215 -16.218  -8.574   7.126
  878   2HD   ARG1215           HD1      ARG1215 -17.873  -8.016   7.368
  879    HE   ARG1215           HE       ARG1215 -17.808 -10.127   5.486
  880   1HH1  ARG1215          1HH1      ARG1215 -17.511  -9.489   8.899
  881   2HH1  ARG1215          2HH1      ARG1215 -18.069 -11.058   9.371
  882   1HH2  ARG1215          1HH2      ARG1215 -18.544 -12.196   6.101
  883   2HH2  ARG1215          2HH2      ARG1215 -18.656 -12.597   7.781
  884    H    THR1216           HN       THR1216 -15.991  -6.241   2.914
  885    HA   THR1216           HA       THR1216 -15.565  -8.565   1.234
  886    HB   THR1216           HB       THR1216 -16.426  -7.118  -0.452
  887    HG1  THR1216           HG1      THR1216 -14.787  -7.407  -1.775
  888   1HG2  THR1216          2HG2      THR1216 -14.528  -5.019   0.590
  889   2HG2  THR1216          1HG2      THR1216 -15.534  -4.861  -0.850
  890   3HG2  THR1216          3HG2      THR1216 -16.285  -5.002   0.740
  891    H    THR1217           HN       THR1217 -13.268  -8.376   0.235
  892    HA   THR1217           HA       THR1217 -11.467  -7.524   2.400
  893    HB   THR1217           HB       THR1217 -11.178  -9.646   0.276
  894    HG1  THR1217           HG1      THR1217 -11.792 -10.790   1.940
  895   1HG2  THR1217          1HG2      THR1217  -9.080  -8.283   0.468
  896   2HG2  THR1217          3HG2      THR1217  -9.006  -8.744   2.170
  897   3HG2  THR1217          2HG2      THR1217  -8.889  -9.980   0.918
  898    H    CYS1218           HN       CYS1218 -10.196  -5.827   2.064
  899    HA   CYS1218           HA       CYS1218 -10.056  -4.631  -0.553
  900   1HB   CYS1218           HB2      CYS1218  -8.555  -3.762   1.917
  901   2HB   CYS1218           HB1      CYS1218  -8.972  -2.791   0.508
  902    H    TRP1219           HN       TRP1219  -8.391  -4.711  -1.953
  903    HA   TRP1219           HA       TRP1219  -5.752  -5.483  -1.177
  904   1HB   TRP1219           HB2      TRP1219  -7.414  -7.610  -1.475
  905   2HB   TRP1219           HB1      TRP1219  -6.819  -7.435  -3.123
  906    HD1  TRP1219           HD1      TRP1219  -4.143  -7.742  -3.491
  907    HE1  TRP1219           HE1      TRP1219  -2.422  -9.089  -2.135
  908    HE3  TRP1219           HE3      TRP1219  -6.798  -8.363   0.836
  909    HZ2  TRP1219           HZ2      TRP1219  -2.205 -10.254   0.408
  910    HZ3  TRP1219           HZ3      TRP1219  -5.757  -9.610   2.685
  911    HH2  TRP1219           HH2      TRP1219  -3.507 -10.538   2.475
  912    H    ASP1220           HN       ASP1220  -4.341  -4.632  -2.566
  913    HA   ASP1220           HA       ASP1220  -3.452  -3.621  -4.395
  914   1HB   ASP1220           HB2      ASP1220  -4.088  -5.745  -5.513
  915   2HB   ASP1220           HB1      ASP1220  -5.646  -5.035  -5.926
  916    H    GLY1221           HN       GLY1221  -6.356  -2.873  -3.134
  917   1HA   GLY1221           HA1      GLY1221  -6.449  -0.356  -4.614
  918   2HA   GLY1221           HA2      GLY1221  -7.221  -0.681  -3.071
  919    H    LYS1222           HN       LYS1222  -8.516  -3.131  -3.897
  920    HA   LYS1222           HA       LYS1222 -10.759  -1.919  -5.287
  921   1HB   LYS1222           HB2      LYS1222  -8.928  -3.443  -6.730
  922   2HB   LYS1222           HB1      LYS1222 -10.257  -4.545  -6.398
  923   1HG   LYS1222           HG2      LYS1222 -10.546  -1.836  -7.678
  924   2HG   LYS1222           HG1      LYS1222 -10.499  -3.373  -8.544
  925   1HD   LYS1222           HD2      LYS1222 -12.501  -4.109  -7.330
  926   2HD   LYS1222           HD1      LYS1222 -12.552  -2.558  -6.488
  927   1HE   LYS1222           HE2      LYS1222 -14.122  -2.590  -8.351
  928   2HE   LYS1222           HE1      LYS1222 -12.846  -1.403  -8.619
  929   1HZ   LYS1222           HZ3      LYS1222 -12.956  -4.122  -9.811
  930   2HZ   LYS1222           HZ2      LYS1222 -13.300  -2.676 -10.617
  931   3HZ   LYS1222           HZ1      LYS1222 -11.731  -2.984 -10.068
  932    H    LEU1223           HN       LEU1223 -12.657  -2.663  -4.580
  933    HA   LEU1223           HA       LEU1223 -12.875  -5.291  -3.368
  934   1HB   LEU1223           HB2      LEU1223 -14.194  -3.956  -1.457
  935   2HB   LEU1223           HB1      LEU1223 -12.511  -4.426  -1.323
  936    HG   LEU1223           HG       LEU1223 -13.026  -1.791  -2.561
  937   1HD1  LEU1223          1HD1      LEU1223 -13.491  -2.322   0.368
  938   2HD1  LEU1223          3HD1      LEU1223 -13.289  -0.725  -0.353
  939   3HD1  LEU1223          2HD1      LEU1223 -14.670  -1.726  -0.804
  940   1HD2  LEU1223          3HD2      LEU1223 -10.775  -2.663  -2.206
  941   2HD2  LEU1223          2HD2      LEU1223 -11.056  -1.202  -1.258
  942   3HD2  LEU1223          1HD2      LEU1223 -11.093  -2.783  -0.475
  943    H    GLU1224           HN       GLU1224 -15.229  -5.556  -2.523
  944    HA   GLU1224           HA       GLU1224 -16.972  -4.795  -4.728
  945   1HB   GLU1224           HB2      GLU1224 -17.467  -6.676  -2.410
  946   2HB   GLU1224           HB1      GLU1224 -18.522  -6.461  -3.799
  947   1HG   GLU1224           HG2      GLU1224 -16.742  -7.295  -5.265
  948   2HG   GLU1224           HG1      GLU1224 -15.712  -7.540  -3.856
  949    H    TYR1225           HN       TYR1225 -18.310  -3.114  -4.597
  950    HA   TYR1225           HA       TYR1225 -19.213  -2.279  -1.928
  951   1HB   TYR1225           HB2      TYR1225 -19.574   0.005  -3.190
  952   2HB   TYR1225           HB1      TYR1225 -18.008  -0.427  -2.520
  953    HD1  TYR1225           HD1      TYR1225 -19.569   0.932  -5.282
  954    HD2  TYR1225           HD2      TYR1225 -16.494  -1.828  -4.279
  955    HE1  TYR1225           HE1      TYR1225 -18.523   1.314  -7.471
  956    HE2  TYR1225           HE2      TYR1225 -15.441  -1.463  -6.464
  957    HH   TYR1225           HH       TYR1225 -16.080  -0.690  -8.714
  958    HA   PRO1226           HA       PRO1226 -23.270  -3.378  -3.311
  959   1HB   PRO1226           HB2      PRO1226 -24.660  -2.079  -1.358
  960   2HB   PRO1226           HB1      PRO1226 -23.819  -3.613  -1.101
  961   1HG   PRO1226           HG2      PRO1226 -22.907  -0.827  -0.471
  962   2HG   PRO1226           HG1      PRO1226 -22.809  -2.286   0.531
  963   1HD   PRO1226           HD2      PRO1226 -20.690  -1.381  -0.834
  964   2HD   PRO1226           HD1      PRO1226 -20.994  -3.121  -0.645
  965    H    THR1227           HN       THR1227 -25.524  -1.934  -3.042
  966    HA   THR1227           HA       THR1227 -25.129   0.696  -4.228
  967    HB   THR1227           HB       THR1227 -26.846  -1.388  -5.589
  968    HG1  THR1227           HG1      THR1227 -24.472  -0.208  -6.612
  969   1HG2  THR1227          2HG2      THR1227 -26.121   1.439  -6.375
  970   2HG2  THR1227          1HG2      THR1227 -27.054   0.309  -7.357
  971   3HG2  THR1227          3HG2      THR1227 -27.703   0.887  -5.822
  972    H    CYS1228           HN       CYS1228 -27.538  -1.761  -3.448
  973    HA   CYS1228           HA       CYS1228 -29.466  -1.718  -2.250
  974   1HB   CYS1228           HB2      CYS1228 -28.552   0.853  -0.991
  975   2HB   CYS1228           HB1      CYS1228 -29.464  -0.468  -0.261
  976    H    ALA1229           HN       ALA1229 -31.537  -0.622  -2.006
  977    HA   ALA1229           HA       ALA1229 -32.088   1.881  -3.186
  978   1HB   ALA1229           HB2      ALA1229 -32.680  -0.533  -4.880
  979   2HB   ALA1229           HB1      ALA1229 -33.261   1.103  -5.199
  980   3HB   ALA1229           HB3      ALA1229 -31.533   0.754  -5.248
  981    H    LYS1230           HN       LYS1230 -33.643   2.435  -1.821
  982    HA   LYS1230           HA       LYS1230 -36.197   1.295  -1.911
  983   1HB   LYS1230           HB2      LYS1230 -34.559  -0.118  -0.257
  984   2HB   LYS1230           HB1      LYS1230 -35.301   1.018   0.853
  985   1HG   LYS1230           HG2      LYS1230 -36.848  -0.754  -1.016
  986   2HG   LYS1230           HG1      LYS1230 -36.481  -1.149   0.661
  987   1HD   LYS1230           HD2      LYS1230 -37.996   1.299  -0.231
  988   2HD   LYS1230           HD1      LYS1230 -38.746  -0.188   0.353
  989   1HE   LYS1230           HE2      LYS1230 -36.855   1.572   1.911
  990   2HE   LYS1230           HE1      LYS1230 -38.605   1.499   2.118
  991   1HZ   LYS1230           HZ3      LYS1230 -38.394  -0.820   2.767
  992   2HZ   LYS1230           HZ2      LYS1230 -36.716  -0.748   2.571
  993   3HZ   LYS1230           HZ1      LYS1230 -37.464   0.170   3.777
  994    H    ARG1231           HN       ARG1231 -35.149   2.331   1.140
  995    HA   ARG1231           HA       ARG1231 -36.043   4.027   2.430
  996   1HB   ARG1231           HB2      ARG1231 -33.784   4.719   1.770
  997   2HB   ARG1231           HB1      ARG1231 -34.440   5.525   0.352
  998   1HG   ARG1231           HG2      ARG1231 -35.668   7.071   1.768
  999   2HG   ARG1231           HG1      ARG1231 -35.079   6.239   3.209
 1000   1HD   ARG1231           HD2      ARG1231 -32.782   6.827   2.604
 1001   2HD   ARG1231           HD1      ARG1231 -33.375   7.664   1.170
 1002    HE   ARG1231           HE       ARG1231 -34.647   8.716   3.443
 1003   1HH1  ARG1231          1HH1      ARG1231 -31.515   8.628   1.919
 1004   2HH1  ARG1231          2HH1      ARG1231 -31.015  10.156   2.564
 1005   1HH2  ARG1231          1HH2      ARG1231 -33.998  10.729   4.296
 1006   2HH2  ARG1231          2HH2      ARG1231 -32.426  11.350   3.915

  No H/Q in entry =        1006
  Start of MODEL   16
    1    H1   GLU1103           HT3      GLU1103  38.740  -3.560   0.961
    2    H2   GLU1103           HT2      GLU1103  38.349  -2.166   1.835
    3    H3   GLU1103           HT1      GLU1103  37.374  -2.653   0.542
    4    HA   GLU1103           HA       GLU1103  38.743  -0.798  -0.104
    5   1HB   GLU1103           HB2      GLU1103  41.034  -2.652   0.574
    6   2HB   GLU1103           HB1      GLU1103  41.194  -1.084  -0.206
    7   1HG   GLU1103           HG2      GLU1103  40.278   0.000   1.781
    8   2HG   GLU1103           HG1      GLU1103  40.121  -1.573   2.564
    9    H    ALA1104           HN       ALA1104  37.973  -3.863  -0.836
   10    HA   ALA1104           HA       ALA1104  39.266  -3.891  -3.465
   11   1HB   ALA1104           HB2      ALA1104  38.484  -6.190  -3.637
   12   2HB   ALA1104           HB3      ALA1104  37.619  -6.024  -2.109
   13   3HB   ALA1104           HB1      ALA1104  39.381  -5.946  -2.139
   14    H    GLU1105           HN       GLU1105  38.219  -2.859  -5.023
   15    HA   GLU1105           HA       GLU1105  36.580  -2.104  -6.402
   16   1HB   GLU1105           HB2      GLU1105  36.131  -4.500  -6.697
   17   2HB   GLU1105           HB1      GLU1105  35.054  -4.474  -5.308
   18   1HG   GLU1105           HG2      GLU1105  33.572  -2.930  -6.485
   19   2HG   GLU1105           HG1      GLU1105  34.653  -2.960  -7.879
   20    H    PHE1106           HN       PHE1106  35.987  -0.153  -5.635
   21    HA   PHE1106           HA       PHE1106  34.194   0.039  -3.349
   22   1HB   PHE1106           HB2      PHE1106  35.511   2.196  -5.014
   23   2HB   PHE1106           HB1      PHE1106  34.557   2.475  -3.562
   24    HD1  PHE1106           HD1      PHE1106  35.427   1.923  -1.371
   25    HD2  PHE1106           HD2      PHE1106  37.742   1.290  -4.885
   26    HE1  PHE1106           HE1      PHE1106  37.446   1.670   0.011
   27    HE2  PHE1106           HE2      PHE1106  39.766   1.034  -3.510
   28    HZ   PHE1106           HZ       PHE1106  39.620   1.224  -1.059
   29    H    GLY1107           HN       GLY1107  32.105   0.779  -3.423
   30   1HA   GLY1107           HA1      GLY1107  30.502   0.228  -5.577
   31   2HA   GLY1107           HA2      GLY1107  30.942   1.918  -5.756
   32    H    LYS1108           HN       LYS1108  30.912   2.878  -3.227
   33    HA   LYS1108           HA       LYS1108  28.848   2.116  -1.538
   34   1HB   LYS1108           HB2      LYS1108  29.933   4.881  -2.105
   35   2HB   LYS1108           HB1      LYS1108  28.846   4.503  -0.775
   36   1HG   LYS1108           HG2      LYS1108  30.547   2.909   0.083
   37   2HG   LYS1108           HG1      LYS1108  31.642   3.469  -1.184
   38   1HD   LYS1108           HD2      LYS1108  31.560   5.725  -0.298
   39   2HD   LYS1108           HD1      LYS1108  30.386   5.226   0.921
   40   1HE   LYS1108           HE2      LYS1108  32.032   3.730   1.913
   41   2HE   LYS1108           HE1      LYS1108  33.204   4.180   0.676
   42   1HZ   LYS1108           HZ3      LYS1108  32.022   6.018   2.687
   43   2HZ   LYS1108           HZ2      LYS1108  33.588   5.381   2.733
   44   3HZ   LYS1108           HZ1      LYS1108  33.147   6.452   1.500
   45    H    CYS1109           HN       CYS1109  26.711   2.228  -1.611
   46    HA   CYS1109           HA       CYS1109  25.448   3.171  -4.012
   47   1HB   CYS1109           HB2      CYS1109  23.395   2.566  -2.283
   48   2HB   CYS1109           HB1      CYS1109  24.142   1.448  -3.419
   49    H    GLY1110           HN       GLY1110  23.460   4.516  -3.875
   50   1HA   GLY1110           HA1      GLY1110  23.228   6.920  -3.700
   51   2HA   GLY1110           HA2      GLY1110  23.990   6.825  -2.116
   52    HA   PRO1111           HA       PRO1111  19.807   7.386  -0.601
   53   1HB   PRO1111           HB2      PRO1111  18.585   8.211  -3.200
   54   2HB   PRO1111           HB1      PRO1111  18.421   8.939  -1.597
   55   1HG   PRO1111           HG2      PRO1111  19.985  10.053  -3.449
   56   2HG   PRO1111           HG1      PRO1111  20.461  10.033  -1.742
   57   1HD   PRO1111           HD2      PRO1111  21.484   8.404  -4.014
   58   2HD   PRO1111           HD1      PRO1111  22.333   8.987  -2.568
   59    HA   PRO1112           HA       PRO1112  18.239   3.399  -1.873
   60   1HB   PRO1112           HB2      PRO1112  16.572   2.973   0.186
   61   2HB   PRO1112           HB1      PRO1112  18.328   2.913   0.381
   62   1HG   PRO1112           HG2      PRO1112  16.425   5.141   1.021
   63   2HG   PRO1112           HG1      PRO1112  17.768   4.508   1.991
   64   1HD   PRO1112           HD2      PRO1112  17.965   6.754   0.462
   65   2HD   PRO1112           HD1      PRO1112  19.344   5.690   0.808
   66    HA   PRO1113           HA       PRO1113  14.310   4.901  -3.608
   67   1HB   PRO1113           HB2      PRO1113  14.643   3.940  -6.078
   68   2HB   PRO1113           HB1      PRO1113  15.525   5.374  -5.538
   69   1HG   PRO1113           HG2      PRO1113  16.487   2.590  -5.924
   70   2HG   PRO1113           HG1      PRO1113  17.363   4.118  -6.104
   71   1HD   PRO1113           HD2      PRO1113  17.403   2.369  -3.867
   72   2HD   PRO1113           HD1      PRO1113  18.133   3.981  -3.980
   73    HA   PRO1114           HA       PRO1114  12.880   0.613  -2.935
   74   1HB   PRO1114           HB2      PRO1114  11.158   1.068  -0.977
   75   2HB   PRO1114           HB1      PRO1114  12.897   1.164  -0.678
   76   1HG   PRO1114           HG2      PRO1114  10.905   3.353  -1.005
   77   2HG   PRO1114           HG1      PRO1114  12.331   3.281   0.041
   78   1HD   PRO1114           HD2      PRO1114  12.147   4.522  -2.496
   79   2HD   PRO1114           HD1      PRO1114  13.623   4.236  -1.556
   80    H    ILE1115           HN       ILE1115  10.317   0.180  -2.165
   81    HA   ILE1115           HA       ILE1115   8.862   0.129  -4.520
   82    HB   ILE1115           HB       ILE1115   6.893  -0.316  -2.957
   83   1HG1  ILE1115          2HG1      ILE1115   9.073   0.362  -1.027
   84   2HG1  ILE1115          1HG1      ILE1115   7.353   0.717  -0.940
   85   1HG2  ILE1115          2HG2      ILE1115   8.217  -2.080  -3.979
   86   2HG2  ILE1115          1HG2      ILE1115   9.411  -1.955  -2.684
   87   3HG2  ILE1115          3HG2      ILE1115   7.777  -2.518  -2.327
   88   1HD1  ILE1115          1HD1      ILE1115   8.617  -1.965  -0.436
   89   2HD1  ILE1115          3HD1      ILE1115   8.035  -0.841   0.792
   90   3HD1  ILE1115          2HD1      ILE1115   6.896  -1.593  -0.327
   91    H    ASP1116           HN       ASP1116   6.632   1.056  -4.790
   92    HA   ASP1116           HA       ASP1116   6.776   3.888  -4.847
   93   1HB   ASP1116           HB2      ASP1116   5.517   2.599  -6.523
   94   2HB   ASP1116           HB1      ASP1116   4.391   2.072  -5.275
   95    H    ASN1117           HN       ASN1117   6.127   5.369  -3.411
   96    HA   ASN1117           HA       ASN1117   5.292   6.316  -1.519
   97   1HB   ASN1117           HB2      ASN1117   3.314   4.032  -1.703
   98   2HB   ASN1117           HB1      ASN1117   3.162   5.403  -0.606
   99   1HD2  ASN1117          1HD2      ASN1117   1.390   4.528  -2.737
  100   2HD2  ASN1117          2HD2      ASN1117   1.245   5.864  -3.822
  101    H    GLY1118           HN       GLY1118   7.080   3.727  -1.565
  102   1HA   GLY1118           HA1      GLY1118   7.697   2.092   0.056
  103   2HA   GLY1118           HA2      GLY1118   6.762   2.973   1.255
  104    H    ASP1119           HN       ASP1119   9.176   2.206   2.024
  105    HA   ASP1119           HA       ASP1119  11.402   3.773   1.478
  106   1HB   ASP1119           HB2      ASP1119   9.892   5.657   2.198
  107   2HB   ASP1119           HB1      ASP1119   9.838   4.928   3.801
  108    H    ILE1120           HN       ILE1120  12.906   3.901   3.564
  109    HA   ILE1120           HA       ILE1120  13.112   1.242   4.508
  110    HB   ILE1120           HB       ILE1120  14.594   3.166   6.114
  111   1HG1  ILE1120          2HG1      ILE1120  14.991   3.167   3.111
  112   2HG1  ILE1120          1HG1      ILE1120  14.419   4.527   4.067
  113   1HG2  ILE1120          3HG2      ILE1120  15.341   0.920   4.255
  114   2HG2  ILE1120          2HG2      ILE1120  16.461   1.749   5.339
  115   3HG2  ILE1120          1HG2      ILE1120  15.119   0.813   6.002
  116   1HD1  ILE1120          1HD1      ILE1120  16.562   4.610   5.230
  117   2HD1  ILE1120          3HD1      ILE1120  17.134   3.251   4.263
  118   3HD1  ILE1120          2HD1      ILE1120  16.755   4.787   3.485
  119    H    THR1121           HN       THR1121  12.812   0.385   6.530
  120    HA   THR1121           HA       THR1121  10.618   1.463   8.003
  121    HB   THR1121           HB       THR1121  10.796  -0.510   9.399
  122    HG1  THR1121           HG1      THR1121  12.590  -1.710   9.488
  123   1HG2  THR1121          1HG2      THR1121   9.768  -0.790   7.191
  124   2HG2  THR1121          3HG2      THR1121  11.344  -1.168   6.497
  125   3HG2  THR1121          2HG2      THR1121  10.617  -2.256   7.679
  126    H    SER1122           HN       SER1122  13.597   2.580   7.951
  127    HA   SER1122           HA       SER1122  13.633   3.167  10.841
  128   1HB   SER1122           HB2      SER1122  15.528   1.717  10.207
  129   2HB   SER1122           HB1      SER1122  16.033   2.908   9.010
  130    HG   SER1122           HG       SER1122  17.222   3.314  10.817
  131    H    PHE1123           HN       PHE1123  15.752   4.530   8.404
  132    HA   PHE1123           HA       PHE1123  14.227   6.946   8.085
  133   1HB   PHE1123           HB2      PHE1123  15.284   7.241  10.326
  134   2HB   PHE1123           HB1      PHE1123  16.862   7.088   9.561
  135    HD1  PHE1123           HD1      PHE1123  13.818   9.173   9.724
  136    HD2  PHE1123           HD2      PHE1123  17.881   8.916   8.488
  137    HE1  PHE1123           HE1      PHE1123  13.828  11.590   9.269
  138    HE2  PHE1123           HE2      PHE1123  17.900  11.334   8.030
  139    HZ   PHE1123           HZ       PHE1123  15.872  12.674   8.421
  140    HA   PRO1124           HA       PRO1124  16.332   6.523   4.171
  141   1HB   PRO1124           HB2      PRO1124  15.716   9.437   4.040
  142   2HB   PRO1124           HB1      PRO1124  15.404   8.165   2.854
  143   1HG   PRO1124           HG2      PRO1124  13.427   9.134   4.346
  144   2HG   PRO1124           HG1      PRO1124  13.518   7.402   3.975
  145   1HD   PRO1124           HD2      PRO1124  14.179   8.839   6.506
  146   2HD   PRO1124           HD1      PRO1124  13.447   7.239   6.274
  147    H    LEU1125           HN       LEU1125  18.369   6.862   3.425
  148    HA   LEU1125           HA       LEU1125  20.007   8.887   4.798
  149   1HB   LEU1125           HB2      LEU1125  21.036   6.205   3.859
  150   2HB   LEU1125           HB1      LEU1125  21.894   7.409   4.802
  151    HG   LEU1125           HG       LEU1125  20.053   6.995   6.587
  152   1HD1  LEU1125          1HD1      LEU1125  19.840   4.487   4.929
  153   2HD1  LEU1125          3HD1      LEU1125  19.172   4.701   6.546
  154   3HD1  LEU1125          2HD1      LEU1125  18.559   5.670   5.203
  155   1HD2  LEU1125          2HD2      LEU1125  22.404   6.415   6.862
  156   2HD2  LEU1125          1HD2      LEU1125  21.362   5.161   7.533
  157   3HD2  LEU1125          3HD2      LEU1125  22.147   4.914   5.973
  158    H    SER1126           HN       SER1126  21.602   9.916   3.559
  159    HA   SER1126           HA       SER1126  20.996  10.048   0.739
  160   1HB   SER1126           HB2      SER1126  23.107  11.512   2.343
  161   2HB   SER1126           HB1      SER1126  22.624  11.883   0.688
  162    HG   SER1126           HG       SER1126  21.509  12.698   2.976
  163    H    VAL1127           HN       VAL1127  23.856   9.286   2.706
  164    HA   VAL1127           HA       VAL1127  25.051   7.986   0.358
  165    HB   VAL1127           HB       VAL1127  26.472   9.680   1.417
  166   1HG1  VAL1127          1HG1      VAL1127  25.615   9.535   3.693
  167   2HG1  VAL1127          3HG1      VAL1127  26.320   7.928   3.868
  168   3HG1  VAL1127          2HG1      VAL1127  27.368   9.333   3.669
  169   1HG2  VAL1127          2HG2      VAL1127  27.535   7.785   0.324
  170   2HG2  VAL1127          1HG2      VAL1127  28.480   8.305   1.719
  171   3HG2  VAL1127          3HG2      VAL1127  27.471   6.863   1.826
  172    H    TYR1128           HN       TYR1128  25.300   5.837   0.295
  173    HA   TYR1128           HA       TYR1128  24.719   4.330   2.758
  174   1HB   TYR1128           HB2      TYR1128  23.483   4.214   0.148
  175   2HB   TYR1128           HB1      TYR1128  24.160   2.650   0.592
  176    HD1  TYR1128           HD1      TYR1128  23.561   1.798   2.991
  177    HD2  TYR1128           HD2      TYR1128  21.370   4.782   0.897
  178    HE1  TYR1128           HE1      TYR1128  21.600   1.337   4.400
  179    HE2  TYR1128           HE2      TYR1128  19.404   4.334   2.300
  180    HH   TYR1128           HH       TYR1128  18.500   2.493   3.667
  181    H    ALA1129           HN       ALA1129  25.635   2.187   2.871
  182    HA   ALA1129           HA       ALA1129  28.352   2.147   1.787
  183   1HB   ALA1129           HB1      ALA1129  28.071   1.838   4.201
  184   2HB   ALA1129           HB3      ALA1129  27.085   0.407   3.904
  185   3HB   ALA1129           HB2      ALA1129  28.789   0.414   3.449
  186    HA   PRO1130           HA       PRO1130  27.335  -0.856  -1.299
  187   1HB   PRO1130           HB2      PRO1130  29.780  -2.052  -1.571
  188   2HB   PRO1130           HB1      PRO1130  29.365  -0.491  -2.283
  189   1HG   PRO1130           HG2      PRO1130  30.873  -1.094   0.231
  190   2HG   PRO1130           HG1      PRO1130  31.199   0.138  -1.003
  191   1HD   PRO1130           HD2      PRO1130  30.017   0.734   1.349
  192   2HD   PRO1130           HD1      PRO1130  29.612   1.587  -0.155
  193    H    ALA1131           HN       ALA1131  26.943  -3.057  -1.566
  194    HA   ALA1131           HA       ALA1131  26.445  -5.184  -0.944
  195   1HB   ALA1131           HB3      ALA1131  28.875  -5.407  -0.753
  196   2HB   ALA1131           HB1      ALA1131  28.034  -6.395   0.442
  197   3HB   ALA1131           HB2      ALA1131  28.790  -4.877   0.927
  198    H    SER1132           HN       SER1132  25.651  -2.667   0.756
  199    HA   SER1132           HA       SER1132  24.942  -3.983   3.258
  200   1HB   SER1132           HB2      SER1132  24.530  -1.147   2.296
  201   2HB   SER1132           HB1      SER1132  24.004  -1.746   3.869
  202    HG   SER1132           HG       SER1132  26.679  -2.044   3.041
  203    H    SER1133           HN       SER1133  22.794  -4.135   4.026
  204    HA   SER1133           HA       SER1133  20.722  -4.018   1.937
  205   1HB   SER1133           HB2      SER1133  20.725  -6.134   4.076
  206   2HB   SER1133           HB1      SER1133  19.864  -6.116   2.539
  207    HG   SER1133           HG       SER1133  22.230  -6.035   1.725
  208    H    VAL1134           HN       VAL1134  18.563  -3.650   2.691
  209    HA   VAL1134           HA       VAL1134  18.283  -2.876   5.495
  210    HB   VAL1134           HB       VAL1134  17.128  -0.760   4.874
  211   1HG1  VAL1134          1HG1      VAL1134  20.032  -0.979   4.105
  212   2HG1  VAL1134          3HG1      VAL1134  19.187   0.520   4.492
  213   3HG1  VAL1134          2HG1      VAL1134  19.388  -0.723   5.727
  214   1HG2  VAL1134          3HG2      VAL1134  16.636  -1.299   2.544
  215   2HG2  VAL1134          2HG2      VAL1134  17.519   0.221   2.684
  216   3HG2  VAL1134          1HG2      VAL1134  18.358  -1.243   2.166
  217    H    GLU1135           HN       GLU1135  15.997  -2.204   5.970
  218    HA   GLU1135           HA       GLU1135  14.151  -4.017   4.565
  219   1HB   GLU1135           HB2      GLU1135  14.547  -4.641   6.893
  220   2HB   GLU1135           HB1      GLU1135  14.112  -3.022   7.422
  221   1HG   GLU1135           HG2      GLU1135  11.834  -3.371   6.600
  222   2HG   GLU1135           HG1      GLU1135  12.275  -5.003   6.099
  223    H    TYR1136           HN       TYR1136  12.150  -3.271   3.917
  224    HA   TYR1136           HA       TYR1136  11.723  -0.369   4.204
  225   1HB   TYR1136           HB2      TYR1136  11.145  -2.160   1.846
  226   2HB   TYR1136           HB1      TYR1136  10.523  -0.522   1.993
  227    HD1  TYR1136           HD1      TYR1136  12.934   0.840   3.125
  228    HD2  TYR1136           HD2      TYR1136  12.543  -2.011   0.008
  229    HE1  TYR1136           HE1      TYR1136  14.975   1.723   2.075
  230    HE2  TYR1136           HE2      TYR1136  14.575  -1.146  -1.056
  231    HH   TYR1136           HH       TYR1136  16.720   0.960   0.520
  232    H    GLN1137           HN       GLN1137   9.400   0.212   3.637
  233    HA   GLN1137           HA       GLN1137   7.369  -1.717   4.273
  234   1HB   GLN1137           HB2      GLN1137   6.680  -0.983   6.348
  235   2HB   GLN1137           HB1      GLN1137   8.419  -0.781   6.501
  236   1HG   GLN1137           HG2      GLN1137   6.466   1.398   5.797
  237   2HG   GLN1137           HG1      GLN1137   7.174   1.127   7.388
  238   1HE2  GLN1137          1HE2      GLN1137   7.334   3.454   5.632
  239   2HE2  GLN1137          2HE2      GLN1137   9.018   3.727   5.357
  240    H    CYS1138           HN       CYS1138   5.174  -0.628   4.283
  241    HA   CYS1138           HA       CYS1138   5.208   1.492   2.254
  242   1HB   CYS1138           HB2      CYS1138   2.813  -0.159   3.038
  243   2HB   CYS1138           HB1      CYS1138   3.076   0.745   1.551
  244    H    GLN1139           HN       GLN1139   4.201   3.412   2.553
  245    HA   GLN1139           HA       GLN1139   3.960   4.571   5.015
  246   1HB   GLN1139           HB2      GLN1139   3.918   5.741   2.801
  247   2HB   GLN1139           HB1      GLN1139   2.233   5.271   2.634
  248   1HG   GLN1139           HG2      GLN1139   1.682   6.539   4.651
  249   2HG   GLN1139           HG1      GLN1139   3.371   7.023   4.800
  250   1HE2  GLN1139          1HE2      GLN1139   4.229   8.509   3.351
  251   2HE2  GLN1139          2HE2      GLN1139   3.229   9.505   2.355
  252    H    ASN1140           HN       ASN1140   1.992   5.401   6.132
  253    HA   ASN1140           HA       ASN1140   0.451   3.437   7.224
  254   1HB   ASN1140           HB2      ASN1140  -1.142   5.245   7.891
  255   2HB   ASN1140           HB1      ASN1140   0.545   5.628   8.220
  256   1HD2  ASN1140          1HD2      ASN1140  -2.224   6.331   6.246
  257   2HD2  ASN1140          2HD2      ASN1140  -1.624   7.805   5.575
  258    H    LEU1141           HN       LEU1141  -1.549   2.538   6.903
  259    HA   LEU1141           HA       LEU1141  -3.444   1.862   5.848
  260   1HB   LEU1141           HB2      LEU1141  -2.974   4.438   4.408
  261   2HB   LEU1141           HB1      LEU1141  -4.162   3.311   3.784
  262    HG   LEU1141           HG       LEU1141  -5.221   5.008   5.170
  263   1HD1  LEU1141          2HD1      LEU1141  -5.204   2.294   6.482
  264   2HD1  LEU1141          1HD1      LEU1141  -6.434   3.540   6.704
  265   3HD1  LEU1141          3HD1      LEU1141  -6.213   2.789   5.123
  266   1HD2  LEU1141          2HD2      LEU1141  -3.464   3.964   7.384
  267   2HD2  LEU1141          1HD2      LEU1141  -3.354   5.551   6.623
  268   3HD2  LEU1141          3HD2      LEU1141  -4.777   5.126   7.574
  269    H    TYR1142           HN       TYR1142  -0.569   2.519   4.005
  270    HA   TYR1142           HA       TYR1142  -1.359   0.852   1.785
  271   1HB   TYR1142           HB2      TYR1142   1.254   2.186   2.507
  272   2HB   TYR1142           HB1      TYR1142   1.045   1.190   1.071
  273    HD1  TYR1142           HD1      TYR1142  -0.071   2.030  -0.863
  274    HD2  TYR1142           HD2      TYR1142   0.031   4.333   2.712
  275    HE1  TYR1142           HE1      TYR1142  -0.888   3.987  -2.108
  276    HE2  TYR1142           HE2      TYR1142  -0.788   6.296   1.478
  277    HH   TYR1142           HH       TYR1142  -2.067   6.094  -1.659
  278    H    GLN1143           HN       GLN1143  -1.029  -1.262   1.559
  279    HA   GLN1143           HA       GLN1143   0.375  -2.693   3.690
  280   1HB   GLN1143           HB2      GLN1143  -1.947  -3.359   3.020
  281   2HB   GLN1143           HB1      GLN1143  -1.317  -3.803   1.440
  282   1HG   GLN1143           HG2      GLN1143  -1.540  -5.784   2.731
  283   2HG   GLN1143           HG1      GLN1143   0.180  -5.436   2.564
  284   1HE2  GLN1143          1HE2      GLN1143   1.350  -4.752   4.357
  285   2HE2  GLN1143          2HE2      GLN1143   0.753  -4.939   5.967
  286    H    LEU1144           HN       LEU1144   1.729  -4.610   2.987
  287    HA   LEU1144           HA       LEU1144   3.232  -3.896   0.557
  288   1HB   LEU1144           HB2      LEU1144   4.437  -3.561   2.728
  289   2HB   LEU1144           HB1      LEU1144   4.335  -5.291   2.989
  290    HG   LEU1144           HG       LEU1144   5.487  -4.694   0.389
  291   1HD1  LEU1144          1HD1      LEU1144   6.883  -3.579   2.820
  292   2HD1  LEU1144          3HD1      LEU1144   7.592  -3.751   1.215
  293   3HD1  LEU1144          2HD1      LEU1144   6.239  -2.648   1.467
  294   1HD2  LEU1144          2HD2      LEU1144   6.473  -6.144   2.844
  295   2HD2  LEU1144          1HD2      LEU1144   5.667  -6.856   1.447
  296   3HD2  LEU1144          3HD2      LEU1144   7.276  -6.152   1.273
  297    H    GLU1145           HN       GLU1145   4.249  -5.595  -0.593
  298    HA   GLU1145           HA       GLU1145   3.302  -8.307  -0.116
  299   1HB   GLU1145           HB2      GLU1145   1.616  -7.297  -1.605
  300   2HB   GLU1145           HB1      GLU1145   2.885  -6.852  -2.738
  301   1HG   GLU1145           HG2      GLU1145   1.724  -8.827  -3.499
  302   2HG   GLU1145           HG1      GLU1145   3.397  -9.214  -3.094
  303    H    GLY1146           HN       GLY1146   5.055  -9.541  -0.175
  304   1HA   GLY1146           HA1      GLY1146   7.128  -8.951  -2.186
  305   2HA   GLY1146           HA2      GLY1146   6.830 -10.532  -1.478
  306    H    ASN1147           HN       ASN1147   9.369  -9.236  -1.606
  307    HA   ASN1147           HA       ASN1147   9.962  -9.150   1.259
  308   1HB   ASN1147           HB2      ASN1147  11.201 -10.676  -0.403
  309   2HB   ASN1147           HB1      ASN1147  12.000  -9.205  -0.954
  310   1HD2  ASN1147          1HD2      ASN1147  14.018  -9.792  -0.284
  311   2HD2  ASN1147          2HD2      ASN1147  14.463  -9.908   1.381
  312    H    LYS1148           HN       LYS1148   9.891  -7.185   2.120
  313    HA   LYS1148           HA       LYS1148  10.400  -4.806   0.598
  314   1HB   LYS1148           HB2      LYS1148  10.252  -3.793   3.006
  315   2HB   LYS1148           HB1      LYS1148   8.813  -4.406   2.202
  316   1HG   LYS1148           HG2      LYS1148   8.873  -5.107   4.521
  317   2HG   LYS1148           HG1      LYS1148   9.004  -6.499   3.445
  318   1HD   LYS1148           HD2      LYS1148  11.429  -6.531   3.784
  319   2HD   LYS1148           HD1      LYS1148  11.295  -5.142   4.865
  320   1HE   LYS1148           HE2      LYS1148  10.043  -7.853   5.294
  321   2HE   LYS1148           HE1      LYS1148  11.470  -7.229   6.121
  322   1HZ   LYS1148           HZ1      LYS1148   8.738  -6.073   6.276
  323   2HZ   LYS1148           HZ3      LYS1148   9.490  -6.995   7.479
  324   3HZ   LYS1148           HZ2      LYS1148  10.105  -5.474   7.071
  325    H    ARG1149           HN       ARG1149  12.473  -7.041   1.661
  326    HA   ARG1149           HA       ARG1149  14.524  -5.113   2.523
  327   1HB   ARG1149           HB2      ARG1149  14.080  -7.027   4.034
  328   2HB   ARG1149           HB1      ARG1149  14.528  -8.130   2.742
  329   1HG   ARG1149           HG2      ARG1149  16.788  -7.283   2.743
  330   2HG   ARG1149           HG1      ARG1149  16.362  -6.074   3.956
  331   1HD   ARG1149           HD2      ARG1149  17.506  -7.976   4.969
  332   2HD   ARG1149           HD1      ARG1149  15.848  -7.842   5.554
  333    HE   ARG1149           HE       ARG1149  15.958  -9.595   3.343
  334   1HH1  ARG1149          1HH1      ARG1149  16.814  -9.403   6.715
  335   2HH1  ARG1149          2HH1      ARG1149  16.686 -11.110   6.977
  336   1HH2  ARG1149          1HH2      ARG1149  15.786 -11.844   3.679
  337   2HH2  ARG1149          2HH2      ARG1149  16.102 -12.497   5.252
  338    H    ILE1150           HN       ILE1150  16.258  -4.698   1.261
  339    HA   ILE1150           HA       ILE1150  16.863  -6.530  -0.943
  340    HB   ILE1150           HB       ILE1150  16.753  -4.973  -2.651
  341   1HG1  ILE1150          2HG1      ILE1150  18.007  -3.151  -1.740
  342   2HG1  ILE1150          1HG1      ILE1150  16.452  -2.503  -2.247
  343   1HG2  ILE1150          1HG2      ILE1150  14.508  -4.233  -0.783
  344   2HG2  ILE1150          3HG2      ILE1150  14.546  -3.897  -2.514
  345   3HG2  ILE1150          2HG2      ILE1150  14.522  -5.565  -1.940
  346   1HD1  ILE1150          1HD1      ILE1150  15.694  -2.628   0.105
  347   2HD1  ILE1150          3HD1      ILE1150  17.324  -3.124   0.560
  348   3HD1  ILE1150          2HD1      ILE1150  17.052  -1.533  -0.155
  349    H    THR1151           HN       THR1151  18.783  -5.100  -2.240
  350    HA   THR1151           HA       THR1151  20.742  -4.132  -0.337
  351    HB   THR1151           HB       THR1151  21.296  -6.606  -1.990
  352    HG1  THR1151           HG1      THR1151  20.866  -7.701  -0.226
  353   1HG2  THR1151          3HG2      THR1151  23.238  -5.112  -1.773
  354   2HG2  THR1151          2HG2      THR1151  23.055  -5.144  -0.020
  355   3HG2  THR1151          1HG2      THR1151  23.468  -6.621  -0.890
  356    H    CYS1152           HN       CYS1152  22.052  -2.640  -1.278
  357    HA   CYS1152           HA       CYS1152  21.562  -1.867  -3.970
  358   1HB   CYS1152           HB2      CYS1152  23.036  -0.058  -3.576
  359   2HB   CYS1152           HB1      CYS1152  22.201  -0.337  -2.053
  360    H    ARG1153           HN       ARG1153  22.904  -1.926  -5.744
  361    HA   ARG1153           HA       ARG1153  25.329  -3.566  -5.547
  362   1HB   ARG1153           HB2      ARG1153  24.672  -4.661  -7.717
  363   2HB   ARG1153           HB1      ARG1153  23.713  -5.133  -6.321
  364   1HG   ARG1153           HG2      ARG1153  22.807  -2.974  -8.196
  365   2HG   ARG1153           HG1      ARG1153  22.486  -4.682  -8.508
  366   1HD   ARG1153           HD2      ARG1153  21.623  -3.101  -6.085
  367   2HD   ARG1153           HD1      ARG1153  20.587  -3.668  -7.396
  368    HE   ARG1153           HE       ARG1153  21.605  -5.219  -5.191
  369   1HH1  ARG1153          1HH1      ARG1153  20.299  -5.314  -8.419
  370   2HH1  ARG1153          2HH1      ARG1153  19.723  -6.942  -8.276
  371   1HH2  ARG1153          1HH2      ARG1153  20.851  -7.362  -4.993
  372   2HH2  ARG1153          2HH2      ARG1153  20.037  -8.105  -6.329
  373    H    ASN1154           HN       ASN1154  26.972  -2.425  -6.291
  374    HA   ASN1154           HA       ASN1154  28.221  -0.931  -7.468
  375   1HB   ASN1154           HB2      ASN1154  26.168  -1.633  -9.573
  376   2HB   ASN1154           HB1      ASN1154  27.570  -0.617  -9.895
  377   1HD2  ASN1154          1HD2      ASN1154  27.612  -3.347  -7.708
  378   2HD2  ASN1154          2HD2      ASN1154  28.635  -4.347  -8.674
  379    H    GLY1155           HN       GLY1155  26.511   0.230  -5.695
  380   1HA   GLY1155           HA1      GLY1155  26.368   2.876  -6.600
  381   2HA   GLY1155           HA2      GLY1155  25.619   2.262  -5.137
  382    H    GLN1156           HN       GLN1156  23.951   0.328  -6.567
  383    HA   GLN1156           HA       GLN1156  21.838   2.171  -7.341
  384   1HB   GLN1156           HB2      GLN1156  22.854   0.001  -9.184
  385   2HB   GLN1156           HB1      GLN1156  21.334   0.857  -9.409
  386   1HG   GLN1156           HG2      GLN1156  22.547   2.960  -9.640
  387   2HG   GLN1156           HG1      GLN1156  24.072   2.108  -9.405
  388   1HE2  GLN1156          1HE2      GLN1156  23.139   3.688 -11.673
  389   2HE2  GLN1156          2HE2      GLN1156  23.209   2.641 -13.046
  390    H    TRP1157           HN       TRP1157  20.660   1.511  -5.567
  391    HA   TRP1157           HA       TRP1157  20.274  -1.070  -4.639
  392   1HB   TRP1157           HB2      TRP1157  18.442   1.323  -4.562
  393   2HB   TRP1157           HB1      TRP1157  18.099  -0.179  -3.714
  394    HD1  TRP1157           HD1      TRP1157  20.376   2.865  -3.593
  395    HE1  TRP1157           HE1      TRP1157  21.531   2.934  -1.292
  396    HE3  TRP1157           HE3      TRP1157  18.909  -1.690  -1.847
  397    HZ2  TRP1157           HZ2      TRP1157  21.791   1.241   0.965
  398    HZ3  TRP1157           HZ3      TRP1157  19.652  -2.405   0.384
  399    HH2  TRP1157           HH2      TRP1157  21.062  -0.974   1.759
  400    H    SER1158           HN       SER1158  17.971  -2.042  -4.538
  401    HA   SER1158           HA       SER1158  16.847  -2.213  -7.254
  402   1HB   SER1158           HB2      SER1158  17.383  -4.458  -5.300
  403   2HB   SER1158           HB1      SER1158  16.383  -4.633  -6.740
  404    HG   SER1158           HG       SER1158  18.202  -5.033  -7.704
  405    H    GLU1159           HN       GLU1159  14.769  -1.694  -7.325
  406    HA   GLU1159           HA       GLU1159  13.263  -1.026  -5.057
  407   1HB   GLU1159           HB2      GLU1159  12.867  -0.047  -7.277
  408   2HB   GLU1159           HB1      GLU1159  12.310  -1.607  -7.867
  409   1HG   GLU1159           HG2      GLU1159  10.444  -1.541  -6.295
  410   2HG   GLU1159           HG1      GLU1159  11.005   0.019  -5.695
  411    HA   PRO1160           HA       PRO1160  11.929  -5.078  -3.795
  412   1HB   PRO1160           HB2      PRO1160   9.867  -3.655  -2.261
  413   2HB   PRO1160           HB1      PRO1160  11.184  -4.678  -1.685
  414   1HG   PRO1160           HG2      PRO1160  11.186  -2.011  -1.331
  415   2HG   PRO1160           HG1      PRO1160  12.677  -2.933  -1.588
  416   1HD   PRO1160           HD2      PRO1160  11.141  -1.238  -3.513
  417   2HD   PRO1160           HD1      PRO1160  12.895  -1.405  -3.306
  418    HA   PRO1161           HA       PRO1161   8.385  -6.544  -5.963
  419   1HB   PRO1161           HB2      PRO1161   6.993  -6.772  -3.322
  420   2HB   PRO1161           HB1      PRO1161   7.052  -7.924  -4.662
  421   1HG   PRO1161           HG2      PRO1161   8.605  -8.267  -2.535
  422   2HG   PRO1161           HG1      PRO1161   9.228  -8.584  -4.165
  423   1HD   PRO1161           HD2      PRO1161   9.799  -6.320  -2.326
  424   2HD   PRO1161           HD1      PRO1161  10.831  -7.058  -3.566
  425    H    LYS1162           HN       LYS1162   6.326  -5.289  -3.341
  426    HA   LYS1162           HA       LYS1162   5.827  -2.754  -4.450
  427   1HB   LYS1162           HB2      LYS1162   5.018  -4.308  -6.311
  428   2HB   LYS1162           HB1      LYS1162   3.684  -4.711  -5.242
  429   1HG   LYS1162           HG2      LYS1162   3.027  -2.358  -5.178
  430   2HG   LYS1162           HG1      LYS1162   4.356  -1.963  -6.268
  431   1HD   LYS1162           HD2      LYS1162   2.106  -3.864  -6.920
  432   2HD   LYS1162           HD1      LYS1162   2.169  -2.173  -7.420
  433   1HE   LYS1162           HE2      LYS1162   4.165  -4.311  -8.156
  434   2HE   LYS1162           HE1      LYS1162   2.911  -3.662  -9.211
  435   1HZ   LYS1162           HZ1      LYS1162   3.959  -1.490  -9.059
  436   2HZ   LYS1162           HZ3      LYS1162   5.164  -2.115  -8.048
  437   3HZ   LYS1162           HZ2      LYS1162   5.051  -2.639  -9.652
  438    H    CYS1163           HN       CYS1163   3.695  -1.818  -3.751
  439    HA   CYS1163           HA       CYS1163   2.874  -2.943  -1.151
  440   1HB   CYS1163           HB2      CYS1163   3.118  -0.066  -2.050
  441   2HB   CYS1163           HB1      CYS1163   2.297  -0.549  -0.571
  442    H    LEU1164           HN       LEU1164   0.768  -3.454  -0.937
  443    HA   LEU1164           HA       LEU1164  -1.029  -2.988  -3.138
  444   1HB   LEU1164           HB2      LEU1164  -1.702  -4.151  -0.437
  445   2HB   LEU1164           HB1      LEU1164  -2.617  -4.321  -1.921
  446    HG   LEU1164           HG       LEU1164   0.068  -5.547  -1.310
  447   1HD1  LEU1164          1HD1      LEU1164  -2.644  -6.769  -1.782
  448   2HD1  LEU1164          3HD1      LEU1164  -1.142  -7.659  -1.530
  449   3HD1  LEU1164          2HD1      LEU1164  -1.805  -6.662  -0.234
  450   1HD2  LEU1164          1HD2      LEU1164  -0.032  -4.856  -3.651
  451   2HD2  LEU1164          3HD2      LEU1164  -0.095  -6.611  -3.501
  452   3HD2  LEU1164          2HD2      LEU1164  -1.567  -5.703  -3.839
  453    H    HIS1165           HN       HIS1165  -1.771  -0.967  -3.373
  454    HA   HIS1165           HA       HIS1165  -2.036   1.009  -1.485
  455   1HB   HIS1165           HB2      HIS1165  -3.844   0.577  -3.874
  456   2HB   HIS1165           HB1      HIS1165  -3.610   2.096  -3.015
  457    HD1  HIS1165           HD1      HIS1165  -2.126  -0.058  -5.626
  458    HD2  HIS1165           HD2      HIS1165  -1.071   3.324  -3.455
  459    HE1  HIS1165           HE1      HIS1165  -0.146   0.921  -6.827
  460    HE2  HIS1165           HE2      HIS1165   0.419   3.016  -5.546
  461    HA   PRO1166           HA       PRO1166  -5.341  -0.220   1.179
  462   1HB   PRO1166           HB2      PRO1166  -6.264   2.236   1.937
  463   2HB   PRO1166           HB1      PRO1166  -4.783   1.516   2.578
  464   1HG   PRO1166           HG2      PRO1166  -5.117   3.546   0.401
  465   2HG   PRO1166           HG1      PRO1166  -3.933   3.506   1.722
  466   1HD   PRO1166           HD2      PRO1166  -3.300   2.741  -0.781
  467   2HD   PRO1166           HD1      PRO1166  -2.604   1.950   0.645
  468    H    CYS1167           HN       CYS1167  -7.707   0.021   1.444
  469    HA   CYS1167           HA       CYS1167  -8.975   0.024  -1.108
  470   1HB   CYS1167           HB2      CYS1167 -11.069  -0.103   0.472
  471   2HB   CYS1167           HB1      CYS1167  -9.993  -1.483   0.291
  472    H    VAL1168           HN       VAL1168  -8.293   2.287  -1.611
  473    HA   VAL1168           HA       VAL1168  -9.589   4.455  -0.290
  474    HB   VAL1168           HB       VAL1168  -8.342   4.363  -3.043
  475   1HG1  VAL1168          1HG1      VAL1168  -9.891   6.228  -2.812
  476   2HG1  VAL1168          3HG1      VAL1168  -9.098   6.718  -1.314
  477   3HG1  VAL1168          2HG1      VAL1168  -8.223   6.804  -2.844
  478   1HG2  VAL1168          2HG2      VAL1168  -7.205   5.246  -0.392
  479   2HG2  VAL1168          1HG2      VAL1168  -6.750   3.799  -1.292
  480   3HG2  VAL1168          3HG2      VAL1168  -6.401   5.396  -1.954
  481    H    ILE1169           HN       ILE1169 -11.789   3.825  -0.231
  482    HA   ILE1169           HA       ILE1169 -13.264   3.310  -2.630
  483    HB   ILE1169           HB       ILE1169 -14.167   3.934   0.184
  484   1HG1  ILE1169          2HG1      ILE1169 -12.949   1.743  -0.423
  485   2HG1  ILE1169          1HG1      ILE1169 -14.473   1.625   0.453
  486   1HG2  ILE1169          2HG2      ILE1169 -15.861   4.618  -1.490
  487   2HG2  ILE1169          1HG2      ILE1169 -15.857   2.966  -2.109
  488   3HG2  ILE1169          3HG2      ILE1169 -16.391   3.288  -0.460
  489   1HD1  ILE1169          3HD1      ILE1169 -14.119   1.258  -2.513
  490   2HD1  ILE1169          2HD1      ILE1169 -14.341  -0.022  -1.323
  491   3HD1  ILE1169          1HD1      ILE1169 -15.641   1.127  -1.629
  492    H    SER1170           HN       SER1170 -15.032   4.646  -3.419
  493    HA   SER1170           HA       SER1170 -14.290   7.481  -3.366
  494   1HB   SER1170           HB2      SER1170 -16.099   5.964  -5.261
  495   2HB   SER1170           HB1      SER1170 -15.682   7.672  -5.399
  496    HG   SER1170           HG       SER1170 -13.732   5.621  -5.341
  497    H    ARG1171           HN       ARG1171 -15.454   8.922  -2.293
  498    HA   ARG1171           HA       ARG1171 -17.703   8.222  -0.742
  499   1HB   ARG1171           HB2      ARG1171 -17.882  10.648  -0.292
  500   2HB   ARG1171           HB1      ARG1171 -16.246  10.041  -0.079
  501   1HG   ARG1171           HG2      ARG1171 -15.624  10.931  -2.265
  502   2HG   ARG1171           HG1      ARG1171 -17.268  11.538  -2.484
  503   1HD   ARG1171           HD2      ARG1171 -15.349  12.363  -0.309
  504   2HD   ARG1171           HD1      ARG1171 -15.758  13.308  -1.740
  505    HE   ARG1171           HE       ARG1171 -18.130  12.711  -0.402
  506   1HH1  ARG1171          1HH1      ARG1171 -15.219  14.559   0.105
  507   2HH1  ARG1171          2HH1      ARG1171 -15.987  15.729   1.126
  508   1HH2  ARG1171          1HH2      ARG1171 -19.148  14.247   0.941
  509   2HH2  ARG1171          2HH2      ARG1171 -18.219  15.552   1.601
  510    H    GLU1172           HN       GLU1172 -17.375   9.793  -3.881
  511    HA   GLU1172           HA       GLU1172 -20.179  10.383  -4.109
  512   1HB   GLU1172           HB2      GLU1172 -18.299  11.667  -5.225
  513   2HB   GLU1172           HB1      GLU1172 -18.138  10.312  -6.334
  514   1HG   GLU1172           HG2      GLU1172 -20.441  10.642  -7.075
  515   2HG   GLU1172           HG1      GLU1172 -20.602  12.000  -5.963
  516    H    ILE1173           HN       ILE1173 -19.028   7.539  -3.780
  517    HA   ILE1173           HA       ILE1173 -20.635   6.342  -5.933
  518    HB   ILE1173           HB       ILE1173 -18.002   5.348  -4.857
  519   1HG1  ILE1173          2HG1      ILE1173 -18.076   7.147  -6.631
  520   2HG1  ILE1173          1HG1      ILE1173 -17.176   5.695  -7.060
  521   1HG2  ILE1173          2HG2      ILE1173 -19.548   3.474  -5.095
  522   2HG2  ILE1173          1HG2      ILE1173 -19.899   3.965  -6.752
  523   3HG2  ILE1173          3HG2      ILE1173 -18.281   3.410  -6.321
  524   1HD1  ILE1173          3HD1      ILE1173 -19.973   6.376  -7.940
  525   2HD1  ILE1173          2HD1      ILE1173 -18.512   6.487  -8.922
  526   3HD1  ILE1173          1HD1      ILE1173 -19.086   4.913  -8.371
  527    H    MET1174           HN       MET1174 -19.163   5.639  -2.746
  528    HA   MET1174           HA       MET1174 -21.141   3.626  -2.230
  529   1HB   MET1174           HB2      MET1174 -20.061   3.514   0.026
  530   2HB   MET1174           HB1      MET1174 -18.970   3.232  -1.322
  531   1HG   MET1174           HG2      MET1174 -17.659   4.643  -0.175
  532   2HG   MET1174           HG1      MET1174 -18.610   5.862  -1.020
  533   1HE   MET1174           HE2      MET1174 -18.160   3.855   2.322
  534   2HE   MET1174           HE1      MET1174 -19.467   4.512   3.306
  535   3HE   MET1174           HE3      MET1174 -19.839   3.526   1.892
  536    H    GLU1175           HN       GLU1175 -20.307   6.652  -0.510
  537    HA   GLU1175           HA       GLU1175 -22.737   6.672   0.946
  538   1HB   GLU1175           HB2      GLU1175 -21.856   8.470   2.039
  539   2HB   GLU1175           HB1      GLU1175 -20.377   7.921   1.270
  540   1HG   GLU1175           HG2      GLU1175 -20.248  10.090   0.691
  541   2HG   GLU1175           HG1      GLU1175 -21.238   9.536  -0.658
  542    H    ASN1176           HN       ASN1176 -22.286   7.038  -2.259
  543    HA   ASN1176           HA       ASN1176 -24.410   9.039  -2.577
  544   1HB   ASN1176           HB2      ASN1176 -22.166   9.377  -3.706
  545   2HB   ASN1176           HB1      ASN1176 -22.601   8.022  -4.736
  546   1HD2  ASN1176          1HD2      ASN1176 -22.121  10.818  -5.413
  547   2HD2  ASN1176          2HD2      ASN1176 -23.556  11.367  -6.203
  548    H    TYR1177           HN       TYR1177 -23.384   5.809  -3.673
  549    HA   TYR1177           HA       TYR1177 -25.776   5.383  -5.199
  550   1HB   TYR1177           HB2      TYR1177 -23.568   3.520  -4.329
  551   2HB   TYR1177           HB1      TYR1177 -24.949   2.987  -5.280
  552    HD1  TYR1177           HD1      TYR1177 -24.646   6.080  -6.547
  553    HD2  TYR1177           HD2      TYR1177 -22.379   2.483  -6.380
  554    HE1  TYR1177           HE1      TYR1177 -23.470   6.732  -8.603
  555    HE2  TYR1177           HE2      TYR1177 -21.196   3.126  -8.436
  556    HH   TYR1177           HH       TYR1177 -21.342   6.253  -9.741
  557    H    ASN1178           HN       ASN1178 -26.131   6.072  -2.378
  558    HA   ASN1178           HA       ASN1178 -27.603   5.605  -0.737
  559   1HB   ASN1178           HB2      ASN1178 -28.462   3.257  -2.440
  560   2HB   ASN1178           HB1      ASN1178 -29.361   3.966  -1.102
  561   1HD2  ASN1178          1HD2      ASN1178 -30.111   3.630  -3.898
  562   2HD2  ASN1178          2HD2      ASN1178 -30.496   5.210  -4.481
  563    H    ILE1179           HN       ILE1179 -24.876   4.272  -0.922
  564    HA   ILE1179           HA       ILE1179 -25.453   2.232   1.126
  565    HB   ILE1179           HB       ILE1179 -23.489   0.954   0.430
  566   1HG1  ILE1179          2HG1      ILE1179 -23.338   2.694  -2.026
  567   2HG1  ILE1179          1HG1      ILE1179 -22.348   3.000  -0.603
  568   1HG2  ILE1179          3HG2      ILE1179 -25.438   1.468  -1.813
  569   2HG2  ILE1179          2HG2      ILE1179 -24.392   0.055  -1.666
  570   3HG2  ILE1179          1HG2      ILE1179 -25.657   0.344  -0.471
  571   1HD1  ILE1179          1HD1      ILE1179 -21.443   0.696  -0.822
  572   2HD1  ILE1179          3HD1      ILE1179 -22.318   0.554  -2.347
  573   3HD1  ILE1179          2HD1      ILE1179 -21.047   1.767  -2.168
  574    H    ALA1180           HN       ALA1180 -23.404   1.783   2.479
  575    HA   ALA1180           HA       ALA1180 -21.451   3.807   2.782
  576   1HB   ALA1180           HB1      ALA1180 -22.213   4.852   4.840
  577   2HB   ALA1180           HB3      ALA1180 -23.390   5.112   3.552
  578   3HB   ALA1180           HB2      ALA1180 -23.696   3.898   4.796
  579    H    LEU1181           HN       LEU1181 -19.966   3.340   4.499
  580    HA   LEU1181           HA       LEU1181 -19.402   0.717   4.983
  581   1HB   LEU1181           HB2      LEU1181 -18.656   3.262   6.244
  582   2HB   LEU1181           HB1      LEU1181 -18.481   1.866   7.289
  583    HG   LEU1181           HG       LEU1181 -16.382   2.349   6.179
  584   1HD1  LEU1181          1HD1      LEU1181 -16.901   0.020   6.645
  585   2HD1  LEU1181          3HD1      LEU1181 -17.686  -0.131   5.072
  586   3HD1  LEU1181          2HD1      LEU1181 -15.951   0.169   5.166
  587   1HD2  LEU1181          3HD2      LEU1181 -17.948   2.041   3.625
  588   2HD2  LEU1181          2HD2      LEU1181 -17.137   3.493   4.209
  589   3HD2  LEU1181          1HD2      LEU1181 -16.188   2.091   3.718
  590    H    ARG1182           HN       ARG1182 -19.527  -0.599   6.942
  591    HA   ARG1182           HA       ARG1182 -22.196  -0.809   7.880
  592   1HB   ARG1182           HB2      ARG1182 -21.318  -2.637   9.298
  593   2HB   ARG1182           HB1      ARG1182 -20.833  -2.789   7.614
  594   1HG   ARG1182           HG2      ARG1182 -18.635  -1.856   8.176
  595   2HG   ARG1182           HG1      ARG1182 -19.126  -1.754   9.869
  596   1HD   ARG1182           HD2      ARG1182 -19.438  -4.176   9.928
  597   2HD   ARG1182           HD1      ARG1182 -18.964  -4.283   8.233
  598    HE   ARG1182           HE       ARG1182 -16.952  -3.009   9.779
  599   1HH1  ARG1182          1HH1      ARG1182 -18.318  -6.129   9.041
  600   2HH1  ARG1182          2HH1      ARG1182 -16.854  -6.992   9.376
  601   1HH2  ARG1182          1HH2      ARG1182 -15.021  -4.138  10.222
  602   2HH2  ARG1182          2HH2      ARG1182 -14.981  -5.861  10.048
  603    H    TRP1183           HN       TRP1183 -20.302   1.569   8.617
  604    HA   TRP1183           HA       TRP1183 -20.874   1.552  11.502
  605   1HB   TRP1183           HB2      TRP1183 -18.877   3.310  10.067
  606   2HB   TRP1183           HB1      TRP1183 -19.034   3.059  11.805
  607    HD1  TRP1183           HD1      TRP1183 -18.069   1.034   8.643
  608    HE1  TRP1183           HE1      TRP1183 -16.365  -0.765   9.339
  609    HE3  TRP1183           HE3      TRP1183 -18.016   1.864  13.690
  610    HZ2  TRP1183           HZ2      TRP1183 -15.156  -1.699  11.694
  611    HZ3  TRP1183           HZ3      TRP1183 -16.552   0.470  15.095
  612    HH2  TRP1183           HH2      TRP1183 -15.152  -1.276  14.117
  613    H    THR1184           HN       THR1184 -21.636   2.950   8.509
  614    HA   THR1184           HA       THR1184 -22.837   4.765   7.840
  615    HB   THR1184           HB       THR1184 -24.901   5.188   9.102
  616    HG1  THR1184           HG1      THR1184 -24.861   3.394  10.992
  617   1HG2  THR1184          1HG2      THR1184 -24.811   3.260   7.603
  618   2HG2  THR1184          3HG2      THR1184 -24.193   2.258   8.916
  619   3HG2  THR1184          2HG2      THR1184 -25.826   2.917   9.005
  620    H    ALA1185           HN       ALA1185 -20.994   6.187   8.113
  621    HA   ALA1185           HA       ALA1185 -21.654   8.438   9.782
  622   1HB   ALA1185           HB2      ALA1185 -19.550   8.500  11.008
  623   2HB   ALA1185           HB3      ALA1185 -19.078   6.962  10.286
  624   3HB   ALA1185           HB1      ALA1185 -20.458   7.035  11.381
  625    H    LYS1186           HN       LYS1186 -21.553   8.241   7.051
  626    HA   LYS1186           HA       LYS1186 -20.797   9.352   5.228
  627   1HB   LYS1186           HB2      LYS1186 -19.300  10.837   7.369
  628   2HB   LYS1186           HB1      LYS1186 -19.106  11.231   5.666
  629   1HG   LYS1186           HG2      LYS1186 -20.699  12.733   6.598
  630   2HG   LYS1186           HG1      LYS1186 -21.568  11.611   5.550
  631   1HD   LYS1186           HD2      LYS1186 -22.218  10.294   7.520
  632   2HD   LYS1186           HD1      LYS1186 -21.375  11.447   8.556
  633   1HE   LYS1186           HE2      LYS1186 -23.772  11.893   8.518
  634   2HE   LYS1186           HE1      LYS1186 -22.865  13.227   7.806
  635   1HZ   LYS1186           HZ1      LYS1186 -23.404  12.373   5.610
  636   2HZ   LYS1186           HZ3      LYS1186 -24.278  11.096   6.295
  637   3HZ   LYS1186           HZ2      LYS1186 -24.813  12.688   6.492
  638    H    GLN1187           HN       GLN1187 -19.827   7.865   4.041
  639    HA   GLN1187           HA       GLN1187 -18.171   6.660   3.061
  640   1HB   GLN1187           HB2      GLN1187 -16.436   8.702   4.453
  641   2HB   GLN1187           HB1      GLN1187 -15.805   7.485   3.354
  642   1HG   GLN1187           HG2      GLN1187 -16.027   9.357   2.017
  643   2HG   GLN1187           HG1      GLN1187 -17.482   8.424   1.666
  644   1HE2  GLN1187          1HE2      GLN1187 -18.649  10.205   0.997
  645   2HE2  GLN1187          2HE2      GLN1187 -19.203  11.423   2.090
  646    H    LYS1188           HN       LYS1188 -15.892   7.278   5.582
  647    HA   LYS1188           HA       LYS1188 -15.156   6.076   7.378
  648   1HB   LYS1188           HB2      LYS1188 -17.537   5.714   7.969
  649   2HB   LYS1188           HB1      LYS1188 -17.568   4.307   6.920
  650   1HG   LYS1188           HG2      LYS1188 -17.340   3.611   9.212
  651   2HG   LYS1188           HG1      LYS1188 -15.851   3.247   8.337
  652   1HD   LYS1188           HD2      LYS1188 -14.814   5.263   9.255
  653   2HD   LYS1188           HD1      LYS1188 -16.305   5.637  10.123
  654   1HE   LYS1188           HE2      LYS1188 -16.095   3.553  11.386
  655   2HE   LYS1188           HE1      LYS1188 -14.608   3.174  10.516
  656   1HZ   LYS1188           HZ1      LYS1188 -15.021   5.523  12.287
  657   2HZ   LYS1188           HZ3      LYS1188 -14.146   4.129  12.684
  658   3HZ   LYS1188           HZ2      LYS1188 -13.594   5.153  11.457
  659    H    LEU1189           HN       LEU1189 -15.052   5.444   4.353
  660    HA   LEU1189           HA       LEU1189 -14.335   2.710   4.096
  661   1HB   LEU1189           HB2      LEU1189 -12.997   4.026   2.086
  662   2HB   LEU1189           HB1      LEU1189 -14.620   3.372   1.990
  663    HG   LEU1189           HG       LEU1189 -14.525   6.068   3.126
  664   1HD1  LEU1189          3HD1      LEU1189 -13.629   5.613   0.286
  665   2HD1  LEU1189          2HD1      LEU1189 -14.118   7.167   0.962
  666   3HD1  LEU1189          1HD1      LEU1189 -12.687   6.346   1.585
  667   1HD2  LEU1189          3HD2      LEU1189 -16.579   4.915   2.492
  668   2HD2  LEU1189          2HD2      LEU1189 -16.359   6.395   1.557
  669   3HD2  LEU1189          1HD2      LEU1189 -16.018   4.829   0.822
  670    H    TYR1190           HN       TYR1190 -11.899   3.271   2.592
  671    HA   TYR1190           HA       TYR1190  -9.657   3.142   2.837
  672   1HB   TYR1190           HB2      TYR1190 -10.336   5.179   4.938
  673   2HB   TYR1190           HB1      TYR1190  -8.674   4.692   4.627
  674    HD1  TYR1190           HD1      TYR1190 -11.095   4.840   1.875
  675    HD2  TYR1190           HD2      TYR1190  -8.048   6.953   3.979
  676    HE1  TYR1190           HE1      TYR1190 -10.953   6.473   0.038
  677    HE2  TYR1190           HE2      TYR1190  -7.904   8.584   2.149
  678    HH   TYR1190           HH       TYR1190 -10.226   8.785  -0.323
  679    H    SER1191           HN       SER1191  -8.366   1.640   3.586
  680    HA   SER1191           HA       SER1191  -8.053   0.945   6.307
  681   1HB   SER1191           HB2      SER1191  -9.821  -0.786   4.637
  682   2HB   SER1191           HB1      SER1191  -8.829  -1.504   5.897
  683    HG   SER1191           HG       SER1191 -10.932  -0.919   6.637
  684    H    ARG1192           HN       ARG1192  -6.504  -0.808   6.601
  685    HA   ARG1192           HA       ARG1192  -4.459  -0.722   4.623
  686   1HB   ARG1192           HB2      ARG1192  -4.752  -2.381   7.135
  687   2HB   ARG1192           HB1      ARG1192  -3.295  -2.282   6.164
  688   1HG   ARG1192           HG2      ARG1192  -3.123   0.104   6.639
  689   2HG   ARG1192           HG1      ARG1192  -4.596   0.012   7.608
  690   1HD   ARG1192           HD2      ARG1192  -3.497  -1.575   9.117
  691   2HD   ARG1192           HD1      ARG1192  -2.023  -1.460   8.156
  692    HE   ARG1192           HE       ARG1192  -2.718   1.120   8.931
  693   1HH1  ARG1192          1HH1      ARG1192  -1.722  -1.872  10.413
  694   2HH1  ARG1192          2HH1      ARG1192  -0.954  -1.099  11.759
  695   1HH2  ARG1192          1HH2      ARG1192  -1.708   2.146  10.699
  696   2HH2  ARG1192          2HH2      ARG1192  -0.946   1.184  11.922
  697    H    THR1193           HN       THR1193  -4.435  -1.923   2.843
  698    HA   THR1193           HA       THR1193  -6.196  -3.727   1.964
  699    HB   THR1193           HB       THR1193  -3.230  -3.604   1.506
  700    HG1  THR1193           HG1      THR1193  -4.559  -3.364  -0.716
  701   1HG2  THR1193          2HG2      THR1193  -3.932  -5.998   1.337
  702   2HG2  THR1193          1HG2      THR1193  -5.064  -5.522   0.070
  703   3HG2  THR1193          3HG2      THR1193  -3.327  -5.315  -0.173
  704    H    GLY1194           HN       GLY1194  -7.046  -5.469   2.809
  705   1HA   GLY1194           HA1      GLY1194  -5.361  -7.204   4.501
  706   2HA   GLY1194           HA2      GLY1194  -6.466  -7.872   3.306
  707    H    GLU1195           HN       GLU1195  -7.470  -5.038   4.949
  708    HA   GLU1195           HA       GLU1195  -8.842  -6.437   7.076
  709   1HB   GLU1195           HB2      GLU1195  -8.723  -3.531   6.260
  710   2HB   GLU1195           HB1      GLU1195  -9.728  -4.111   7.582
  711   1HG   GLU1195           HG2      GLU1195  -6.734  -4.363   7.401
  712   2HG   GLU1195           HG1      GLU1195  -7.619  -3.195   8.381
  713    H    SER1196           HN       SER1196 -11.099  -6.511   7.353
  714    HA   SER1196           HA       SER1196 -12.549  -6.928   4.918
  715   1HB   SER1196           HB2      SER1196 -14.422  -7.545   6.409
  716   2HB   SER1196           HB1      SER1196 -12.929  -8.370   6.857
  717    HG   SER1196           HG       SER1196 -14.435  -6.963   8.427
  718    H    VAL1197           HN       VAL1197 -14.082  -5.707   3.977
  719    HA   VAL1197           HA       VAL1197 -14.868  -3.191   5.275
  720    HB   VAL1197           HB       VAL1197 -14.887  -2.704   2.521
  721   1HG1  VAL1197          2HG1      VAL1197 -14.456  -1.062   4.264
  722   2HG1  VAL1197          1HG1      VAL1197 -12.910  -1.831   4.624
  723   3HG1  VAL1197          3HG1      VAL1197 -13.163  -1.047   3.064
  724   1HG2  VAL1197          1HG2      VAL1197 -12.303  -4.011   3.358
  725   2HG2  VAL1197          3HG2      VAL1197 -13.435  -4.602   2.140
  726   3HG2  VAL1197          2HG2      VAL1197 -12.547  -3.102   1.866
  727    H    GLU1198           HN       GLU1198 -17.008  -2.958   5.376
  728    HA   GLU1198           HA       GLU1198 -18.676  -4.256   3.334
  729   1HB   GLU1198           HB2      GLU1198 -19.169  -5.768   4.951
  730   2HB   GLU1198           HB1      GLU1198 -18.662  -4.701   6.251
  731   1HG   GLU1198           HG2      GLU1198 -20.753  -3.516   6.160
  732   2HG   GLU1198           HG1      GLU1198 -21.264  -4.462   4.761
  733    H    PHE1199           HN       PHE1199 -20.032  -2.871   2.397
  734    HA   PHE1199           HA       PHE1199 -20.699  -0.389   3.838
  735   1HB   PHE1199           HB2      PHE1199 -21.036  -0.773   0.873
  736   2HB   PHE1199           HB1      PHE1199 -20.880   0.728   1.777
  737    HD1  PHE1199           HD1      PHE1199 -18.874   1.838   1.721
  738    HD2  PHE1199           HD2      PHE1199 -18.944  -2.355   1.008
  739    HE1  PHE1199           HE1      PHE1199 -16.464   1.891   1.210
  740    HE2  PHE1199           HE2      PHE1199 -16.546  -2.316   0.504
  741    HZ   PHE1199           HZ       PHE1199 -15.301  -0.193   0.605
  742    H    VAL1200           HN       VAL1200 -22.593  -0.797   4.874
  743    HA   VAL1200           HA       VAL1200 -24.659  -2.460   4.056
  744    HB   VAL1200           HB       VAL1200 -26.120  -1.208   5.559
  745   1HG1  VAL1200          2HG1      VAL1200 -24.530  -2.759   6.553
  746   2HG1  VAL1200          1HG1      VAL1200 -23.320  -1.478   6.648
  747   3HG1  VAL1200          3HG1      VAL1200 -24.792  -1.374   7.614
  748   1HG2  VAL1200          3HG2      VAL1200 -25.472   1.054   4.919
  749   2HG2  VAL1200          2HG2      VAL1200 -25.353   0.839   6.665
  750   3HG2  VAL1200          1HG2      VAL1200 -23.894   0.828   5.674
  751    H    CYS1201           HN       CYS1201 -26.988  -1.411   3.644
  752    HA   CYS1201           HA       CYS1201 -26.678   0.039   1.128
  753   1HB   CYS1201           HB2      CYS1201 -29.165  -1.218   2.296
  754   2HB   CYS1201           HB1      CYS1201 -28.969  -0.597   0.661
  755    H    LYS1202           HN       LYS1202 -26.396   1.322   3.780
  756    HA   LYS1202           HA       LYS1202 -26.979   3.254   4.833
  757   1HB   LYS1202           HB2      LYS1202 -26.634   4.268   2.667
  758   2HB   LYS1202           HB1      LYS1202 -28.242   3.791   2.142
  759   1HG   LYS1202           HG2      LYS1202 -29.131   5.248   4.017
  760   2HG   LYS1202           HG1      LYS1202 -27.490   5.886   4.154
  761   1HD   LYS1202           HD2      LYS1202 -27.565   6.556   1.794
  762   2HD   LYS1202           HD1      LYS1202 -29.215   5.939   1.677
  763   1HE   LYS1202           HE2      LYS1202 -29.935   7.547   3.372
  764   2HE   LYS1202           HE1      LYS1202 -28.287   8.160   3.495
  765   1HZ   LYS1202           HZ1      LYS1202 -28.409   8.844   1.180
  766   2HZ   LYS1202           HZ3      LYS1202 -29.993   8.261   1.066
  767   3HZ   LYS1202           HZ2      LYS1202 -29.643   9.567   2.083
  768    H    ARG1203           HN       ARG1203 -28.306   2.611   6.455
  769    HA   ARG1203           HA       ARG1203 -30.254   1.714   7.398
  770   1HB   ARG1203           HB2      ARG1203 -31.714   3.767   7.734
  771   2HB   ARG1203           HB1      ARG1203 -30.045   3.871   8.254
  772   1HG   ARG1203           HG2      ARG1203 -29.443   5.192   6.399
  773   2HG   ARG1203           HG1      ARG1203 -30.974   4.871   5.586
  774   1HD   ARG1203           HD2      ARG1203 -32.160   6.106   7.334
  775   2HD   ARG1203           HD1      ARG1203 -30.632   6.414   8.155
  776    HE   ARG1203           HE       ARG1203 -30.477   7.354   5.508
  777   1HH1  ARG1203          1HH1      ARG1203 -32.028   8.083   8.542
  778   2HH1  ARG1203          2HH1      ARG1203 -32.145   9.781   8.221
  779   1HH2  ARG1203          1HH2      ARG1203 -30.626   9.588   5.078
  780   2HH2  ARG1203          2HH2      ARG1203 -31.349  10.636   6.253
  781    H    GLY1204           HN       GLY1204 -30.640   0.403   5.259
  782   1HA   GLY1204           HA1      GLY1204 -33.252   1.248   4.170
  783   2HA   GLY1204           HA2      GLY1204 -32.917  -0.412   4.637
  784    H    TYR1205           HN       TYR1205 -33.718   0.741   2.046
  785    HA   TYR1205           HA       TYR1205 -33.312   0.452  -0.161
  786   1HB   TYR1205           HB2      TYR1205 -30.434   0.803   0.665
  787   2HB   TYR1205           HB1      TYR1205 -31.001   0.800  -0.995
  788    HD1  TYR1205           HD1      TYR1205 -32.168   2.724  -1.907
  789    HD2  TYR1205           HD2      TYR1205 -30.875   2.686   2.140
  790    HE1  TYR1205           HE1      TYR1205 -32.514   5.154  -1.783
  791    HE2  TYR1205           HE2      TYR1205 -31.217   5.117   2.279
  792    HH   TYR1205           HH       TYR1205 -32.922   6.871  -0.070
  793    H    ARG1206           HN       ARG1206 -33.743  -1.448  -0.985
  794    HA   ARG1206           HA       ARG1206 -32.523  -3.861  -0.012
  795   1HB   ARG1206           HB2      ARG1206 -34.060  -5.012  -1.470
  796   2HB   ARG1206           HB1      ARG1206 -34.923  -3.711  -0.661
  797   1HG   ARG1206           HG2      ARG1206 -34.744  -2.332  -2.663
  798   2HG   ARG1206           HG1      ARG1206 -33.868  -3.630  -3.478
  799   1HD   ARG1206           HD2      ARG1206 -35.811  -5.095  -3.231
  800   2HD   ARG1206           HD1      ARG1206 -36.687  -3.796  -2.420
  801    HE   ARG1206           HE       ARG1206 -35.818  -2.864  -4.913
  802   1HH1  ARG1206          1HH1      ARG1206 -38.059  -5.169  -3.570
  803   2HH1  ARG1206          2HH1      ARG1206 -39.161  -5.069  -4.903
  804   1HH2  ARG1206          1HH2      ARG1206 -37.262  -2.726  -6.671
  805   2HH2  ARG1206          2HH2      ARG1206 -38.707  -3.680  -6.667
  806    H    LEU1207           HN       LEU1207 -30.969  -5.074  -0.958
  807    HA   LEU1207           HA       LEU1207 -29.116  -4.010  -2.689
  808   1HB   LEU1207           HB2      LEU1207 -28.879  -6.086  -1.283
  809   2HB   LEU1207           HB1      LEU1207 -29.782  -6.948  -2.511
  810    HG   LEU1207           HG       LEU1207 -27.987  -6.297  -4.159
  811   1HD1  LEU1207          3HD1      LEU1207 -27.067  -4.400  -2.918
  812   2HD1  LEU1207          2HD1      LEU1207 -26.522  -5.495  -1.644
  813   3HD1  LEU1207          1HD1      LEU1207 -25.824  -5.607  -3.259
  814   1HD2  LEU1207          2HD2      LEU1207 -28.091  -8.521  -3.171
  815   2HD2  LEU1207          1HD2      LEU1207 -26.418  -8.004  -3.385
  816   3HD2  LEU1207          3HD2      LEU1207 -27.156  -7.960  -1.784
  817    H    SER1208           HN       SER1208 -29.174  -3.473  -4.761
  818    HA   SER1208           HA       SER1208 -31.393  -3.888  -6.418
  819   1HB   SER1208           HB2      SER1208 -29.861  -2.025  -6.759
  820   2HB   SER1208           HB1      SER1208 -28.558  -3.141  -7.167
  821    HG   SER1208           HG       SER1208 -30.829  -3.502  -8.659
  822    H    SER1209           HN       SER1209 -29.071  -6.094  -5.516
  823    HA   SER1209           HA       SER1209 -28.743  -8.269  -6.103
  824   1HB   SER1209           HB2      SER1209 -31.098  -8.407  -6.753
  825   2HB   SER1209           HB1      SER1209 -30.717  -7.719  -8.331
  826    HG   SER1209           HG       SER1209 -30.478 -10.279  -7.457
  827    H    ARG1210           HN       ARG1210 -28.946  -6.174  -8.985
  828    HA   ARG1210           HA       ARG1210 -27.064  -7.530 -10.536
  829   1HB   ARG1210           HB2      ARG1210 -26.850  -5.439 -11.805
  830   2HB   ARG1210           HB1      ARG1210 -28.534  -5.808 -11.459
  831   1HG   ARG1210           HG2      ARG1210 -28.521  -4.190  -9.633
  832   2HG   ARG1210           HG1      ARG1210 -26.826  -3.825  -9.966
  833   1HD   ARG1210           HD2      ARG1210 -27.443  -3.066 -12.215
  834   2HD   ARG1210           HD1      ARG1210 -29.136  -3.413 -11.863
  835    HE   ARG1210           HE       ARG1210 -28.219  -1.686  -9.888
  836   1HH1  ARG1210          1HH1      ARG1210 -28.724  -1.661 -13.335
  837   2HH1  ARG1210          2HH1      ARG1210 -29.035   0.040 -13.408
  838   1HH2  ARG1210          1HH2      ARG1210 -28.629   0.555  -9.974
  839   2HH2  ARG1210          2HH2      ARG1210 -28.981   1.301 -11.497
  840    H    SER1211           HN       SER1211 -26.685  -5.533  -7.777
  841    HA   SER1211           HA       SER1211 -24.042  -4.629  -8.178
  842   1HB   SER1211           HB2      SER1211 -25.471  -3.621  -6.485
  843   2HB   SER1211           HB1      SER1211 -25.571  -5.152  -5.617
  844    HG   SER1211           HG       SER1211 -23.983  -4.129  -4.579
  845    H    HIS1212           HN       HIS1212 -22.225  -5.341  -6.636
  846    HA   HIS1212           HA       HIS1212 -21.762  -8.143  -7.126
  847   1HB   HIS1212           HB2      HIS1212 -20.031  -6.063  -5.772
  848   2HB   HIS1212           HB1      HIS1212 -19.517  -7.697  -6.180
  849    HD1  HIS1212           HD1      HIS1212 -18.711  -8.104  -8.529
  850    HD2  HIS1212           HD2      HIS1212 -20.495  -4.381  -8.062
  851    HE1  HIS1212           HE1      HIS1212 -18.257  -6.868 -10.671
  852    HE2  HIS1212           HE2      HIS1212 -19.420  -4.651 -10.400
  853    H    THR1213           HN       THR1213 -20.597  -6.683  -4.174
  854    HA   THR1213           HA       THR1213 -22.459  -8.243  -2.551
  855    HB   THR1213           HB       THR1213 -20.755  -9.347  -1.284
  856    HG1  THR1213           HG1      THR1213 -18.680  -8.405  -2.926
  857   1HG2  THR1213          1HG2      THR1213 -20.218  -9.585  -4.244
  858   2HG2  THR1213          3HG2      THR1213 -19.629 -10.721  -3.030
  859   3HG2  THR1213          2HG2      THR1213 -21.363 -10.534  -3.293
  860    H    LEU1214           HN       LEU1214 -22.422  -7.662  -0.281
  861    HA   LEU1214           HA       LEU1214 -21.997  -4.841   0.096
  862   1HB   LEU1214           HB2      LEU1214 -23.071  -7.051   1.825
  863   2HB   LEU1214           HB1      LEU1214 -22.746  -5.463   2.492
  864    HG   LEU1214           HG       LEU1214 -25.083  -5.619   1.957
  865   1HD1  LEU1214          3HD1      LEU1214 -23.556  -3.918  -0.004
  866   2HD1  LEU1214          2HD1      LEU1214 -25.287  -3.769   0.307
  867   3HD1  LEU1214          1HD1      LEU1214 -24.128  -3.454   1.599
  868   1HD2  LEU1214          1HD2      LEU1214 -24.214  -6.317  -0.844
  869   2HD2  LEU1214          3HD2      LEU1214 -24.975  -7.410   0.314
  870   3HD2  LEU1214          2HD2      LEU1214 -25.873  -6.029  -0.318
  871    H    ARG1215           HN       ARG1215 -20.649  -7.825   1.420
  872    HA   ARG1215           HA       ARG1215 -18.585  -6.300   2.828
  873   1HB   ARG1215           HB2      ARG1215 -19.840  -8.169   3.960
  874   2HB   ARG1215           HB1      ARG1215 -19.039  -9.286   2.862
  875   1HG   ARG1215           HG2      ARG1215 -16.861  -8.561   3.739
  876   2HG   ARG1215           HG1      ARG1215 -17.693  -7.489   4.869
  877   1HD   ARG1215           HD2      ARG1215 -17.049  -9.570   5.958
  878   2HD   ARG1215           HD1      ARG1215 -18.803  -9.413   5.884
  879    HE   ARG1215           HE       ARG1215 -18.086 -10.853   3.651
  880   1HH1  ARG1215          1HH1      ARG1215 -17.770 -11.213   7.103
  881   2HH1  ARG1215          2HH1      ARG1215 -17.808 -12.944   7.054
  882   1HH2  ARG1215          1HH2      ARG1215 -18.138 -13.131   3.578
  883   2HH2  ARG1215          2HH2      ARG1215 -18.017 -14.034   5.052
  884    H    THR1216           HN       THR1216 -16.340  -6.793   2.569
  885    HA   THR1216           HA       THR1216 -15.418  -8.493   0.467
  886    HB   THR1216           HB       THR1216 -16.289  -6.580  -0.860
  887    HG1  THR1216           HG1      THR1216 -13.557  -6.339  -1.223
  888   1HG2  THR1216          1HG2      THR1216 -14.136  -5.021   0.569
  889   2HG2  THR1216          3HG2      THR1216 -15.086  -4.443  -0.799
  890   3HG2  THR1216          2HG2      THR1216 -15.876  -4.785   0.740
  891    H    THR1217           HN       THR1217 -13.010  -7.309  -0.114
  892    HA   THR1217           HA       THR1217 -11.720  -6.823   2.478
  893    HB   THR1217           HB       THR1217 -11.023  -8.957   0.483
  894    HG1  THR1217           HG1      THR1217 -10.678  -9.315   3.207
  895   1HG2  THR1217          2HG2      THR1217  -8.992  -7.574   0.810
  896   2HG2  THR1217          1HG2      THR1217  -9.122  -7.838   2.550
  897   3HG2  THR1217          3HG2      THR1217  -8.821  -9.202   1.470
  898    H    CYS1218           HN       CYS1218 -10.153  -5.301   2.447
  899    HA   CYS1218           HA       CYS1218  -9.827  -3.648   0.177
  900   1HB   CYS1218           HB2      CYS1218  -8.086  -3.830   2.648
  901   2HB   CYS1218           HB1      CYS1218  -8.108  -2.498   1.497
  902    H    TRP1219           HN       TRP1219  -8.650  -4.060  -1.597
  903    HA   TRP1219           HA       TRP1219  -6.041  -5.273  -1.330
  904   1HB   TRP1219           HB2      TRP1219  -8.044  -7.048  -1.605
  905   2HB   TRP1219           HB1      TRP1219  -7.736  -6.694  -3.302
  906    HD1  TRP1219           HD1      TRP1219  -5.452  -7.550  -4.344
  907    HE1  TRP1219           HE1      TRP1219  -3.692  -9.234  -3.515
  908    HE3  TRP1219           HE3      TRP1219  -6.896  -7.918   0.549
  909    HZ2  TRP1219           HZ2      TRP1219  -3.002 -10.540  -1.130
  910    HZ3  TRP1219           HZ3      TRP1219  -5.628  -9.412   2.039
  911    HH2  TRP1219           HH2      TRP1219  -3.721 -10.697   1.216
  912    H    ASP1220           HN       ASP1220  -4.709  -4.343  -2.694
  913    HA   ASP1220           HA       ASP1220  -3.839  -3.345  -4.543
  914   1HB   ASP1220           HB2      ASP1220  -5.062  -4.999  -5.880
  915   2HB   ASP1220           HB1      ASP1220  -6.495  -3.977  -5.842
  916    H    GLY1221           HN       GLY1221  -6.992  -2.380  -3.401
  917   1HA   GLY1221           HA1      GLY1221  -6.349   0.389  -4.201
  918   2HA   GLY1221           HA2      GLY1221  -7.038  -0.017  -2.639
  919    H    LYS1222           HN       LYS1222  -8.823  -2.053  -3.927
  920    HA   LYS1222           HA       LYS1222 -10.940  -0.185  -4.600
  921   1HB   LYS1222           HB2      LYS1222  -9.894  -0.682  -6.769
  922   2HB   LYS1222           HB1      LYS1222 -10.149  -2.398  -6.490
  923   1HG   LYS1222           HG2      LYS1222 -12.659  -1.476  -6.159
  924   2HG   LYS1222           HG1      LYS1222 -12.041  -0.319  -7.340
  925   1HD   LYS1222           HD2      LYS1222 -11.289  -2.254  -8.730
  926   2HD   LYS1222           HD1      LYS1222 -12.116  -3.321  -7.591
  927   1HE   LYS1222           HE2      LYS1222 -13.509  -2.869  -9.541
  928   2HE   LYS1222           HE1      LYS1222 -14.233  -2.212  -8.073
  929   1HZ   LYS1222           HZ3      LYS1222 -12.701  -0.661 -10.090
  930   2HZ   LYS1222           HZ2      LYS1222 -14.383  -0.650  -9.905
  931   3HZ   LYS1222           HZ1      LYS1222 -13.395  -0.029  -8.681
  932    H    LEU1223           HN       LEU1223 -12.986  -0.973  -4.276
  933    HA   LEU1223           HA       LEU1223 -13.243  -3.741  -3.316
  934   1HB   LEU1223           HB2      LEU1223 -14.743  -1.509  -1.990
  935   2HB   LEU1223           HB1      LEU1223 -14.453  -3.134  -1.405
  936    HG   LEU1223           HG       LEU1223 -12.394  -0.936  -1.588
  937   1HD1  LEU1223          1HD1      LEU1223 -13.769  -2.184   0.784
  938   2HD1  LEU1223          3HD1      LEU1223 -12.458  -1.008   0.858
  939   3HD1  LEU1223          2HD1      LEU1223 -14.017  -0.547   0.176
  940   1HD2  LEU1223          2HD2      LEU1223 -11.419  -3.130  -1.949
  941   2HD2  LEU1223          1HD2      LEU1223 -10.946  -2.469  -0.386
  942   3HD2  LEU1223          3HD2      LEU1223 -12.184  -3.720  -0.475
  943    H    GLU1224           HN       GLU1224 -15.290  -4.677  -3.619
  944    HA   GLU1224           HA       GLU1224 -16.711  -3.790  -5.898
  945   1HB   GLU1224           HB2      GLU1224 -17.554  -5.803  -3.801
  946   2HB   GLU1224           HB1      GLU1224 -18.278  -5.614  -5.392
  947   1HG   GLU1224           HG2      GLU1224 -16.179  -6.265  -6.439
  948   2HG   GLU1224           HG1      GLU1224 -15.432  -6.431  -4.850
  949    H    TYR1225           HN       TYR1225 -17.280  -1.626  -5.374
  950    HA   TYR1225           HA       TYR1225 -18.636  -0.670  -3.187
  951   1HB   TYR1225           HB2      TYR1225 -19.210   0.150  -6.046
  952   2HB   TYR1225           HB1      TYR1225 -19.466   1.117  -4.599
  953    HD1  TYR1225           HD1      TYR1225 -17.094   0.054  -7.103
  954    HD2  TYR1225           HD2      TYR1225 -17.514   1.983  -3.335
  955    HE1  TYR1225           HE1      TYR1225 -14.846   1.018  -7.360
  956    HE2  TYR1225           HE2      TYR1225 -15.262   2.956  -3.582
  957    HH   TYR1225           HH       TYR1225 -13.557   2.931  -6.516
  958    HA   PRO1226           HA       PRO1226 -22.380  -3.242  -3.440
  959   1HB   PRO1226           HB2      PRO1226 -23.068  -1.384  -1.213
  960   2HB   PRO1226           HB1      PRO1226 -23.210  -3.144  -1.294
  961   1HG   PRO1226           HG2      PRO1226 -21.255  -2.017   0.110
  962   2HG   PRO1226           HG1      PRO1226 -20.952  -3.476  -0.851
  963   1HD   PRO1226           HD2      PRO1226 -20.226  -0.635  -1.433
  964   2HD   PRO1226           HD1      PRO1226 -19.314  -2.123  -1.760
  965    H    THR1227           HN       THR1227 -24.797  -2.551  -3.357
  966    HA   THR1227           HA       THR1227 -25.476   0.117  -4.051
  967    HB   THR1227           HB       THR1227 -26.226  -1.306  -6.428
  968    HG1  THR1227           HG1      THR1227 -23.658  -1.060  -6.926
  969   1HG2  THR1227          3HG2      THR1227 -26.140   1.126  -6.196
  970   2HG2  THR1227          2HG2      THR1227 -24.391   1.051  -5.982
  971   3HG2  THR1227          1HG2      THR1227 -25.111   0.584  -7.523
  972    H    CYS1228           HN       CYS1228 -27.391   0.243  -3.119
  973    HA   CYS1228           HA       CYS1228 -29.370  -1.866  -3.641
  974   1HB   CYS1228           HB2      CYS1228 -29.084  -0.532  -0.950
  975   2HB   CYS1228           HB1      CYS1228 -30.033  -1.959  -1.363
  976    H    ALA1229           HN       ALA1229 -31.612  -0.956  -2.685
  977    HA   ALA1229           HA       ALA1229 -31.962   1.864  -3.012
  978   1HB   ALA1229           HB1      ALA1229 -32.994   0.033  -5.170
  979   2HB   ALA1229           HB3      ALA1229 -33.359   1.753  -5.018
  980   3HB   ALA1229           HB2      ALA1229 -31.707   1.226  -5.342
  981    H    LYS1230           HN       LYS1230 -33.899   2.573  -2.274
  982    HA   LYS1230           HA       LYS1230 -36.060   2.547  -1.533
  983   1HB   LYS1230           HB2      LYS1230 -35.877  -0.452  -1.672
  984   2HB   LYS1230           HB1      LYS1230 -37.322   0.451  -1.239
  985   1HG   LYS1230           HG2      LYS1230 -37.347   1.470  -3.457
  986   2HG   LYS1230           HG1      LYS1230 -35.888   0.571  -3.880
  987   1HD   LYS1230           HD2      LYS1230 -37.822  -0.556  -4.791
  988   2HD   LYS1230           HD1      LYS1230 -37.116  -1.539  -3.506
  989   1HE   LYS1230           HE2      LYS1230 -38.807  -0.715  -1.944
  990   2HE   LYS1230           HE1      LYS1230 -39.509   0.276  -3.223
  991   1HZ   LYS1230           HZ2      LYS1230 -40.016  -1.741  -4.457
  992   2HZ   LYS1230           HZ1      LYS1230 -39.344  -2.691  -3.229
  993   3HZ   LYS1230           HZ3      LYS1230 -40.737  -1.779  -2.927
  994    H    ARG1231           HN       ARG1231 -34.740   3.431   0.198
  995    HA   ARG1231           HA       ARG1231 -33.743   2.152   2.375
  996   1HB   ARG1231           HB2      ARG1231 -33.701   4.215   3.368
  997   2HB   ARG1231           HB1      ARG1231 -33.918   4.677   1.696
  998   1HG   ARG1231           HG2      ARG1231 -36.313   4.942   2.065
  999   2HG   ARG1231           HG1      ARG1231 -36.100   4.496   3.759
 1000   1HD   ARG1231           HD2      ARG1231 -34.637   6.425   4.086
 1001   2HD   ARG1231           HD1      ARG1231 -34.837   6.869   2.392
 1002    HE   ARG1231           HE       ARG1231 -37.363   6.686   3.616
 1003   1HH1  ARG1231          1HH1      ARG1231 -34.515   8.693   3.593
 1004   2HH1  ARG1231          2HH1      ARG1231 -35.371  10.135   4.023
 1005   1HH2  ARG1231          1HH2      ARG1231 -38.499   8.581   4.180
 1006   2HH2  ARG1231          2HH2      ARG1231 -37.635  10.072   4.357

  No H/Q in entry =        1006
  Start of MODEL   17
    1    H1   GLU1103           HT3      GLU1103  37.487 -11.194   2.535
    2    H2   GLU1103           HT2      GLU1103  38.197 -12.728   2.609
    3    H3   GLU1103           HT1      GLU1103  39.172 -11.350   2.499
    4    HA   GLU1103           HA       GLU1103  39.073 -12.468   0.384
    5   1HB   GLU1103           HB2      GLU1103  36.100 -11.942   0.592
    6   2HB   GLU1103           HB1      GLU1103  36.924 -12.583  -0.823
    7   1HG   GLU1103           HG2      GLU1103  37.586 -14.556   0.452
    8   2HG   GLU1103           HG1      GLU1103  36.763 -13.914   1.871
    9    H    ALA1104           HN       ALA1104  38.307  -9.627   1.882
   10    HA   ALA1104           HA       ALA1104  38.443  -7.431   1.315
   11   1HB   ALA1104           HB3      ALA1104  40.610  -8.115   0.406
   12   2HB   ALA1104           HB2      ALA1104  39.845  -8.477  -1.141
   13   3HB   ALA1104           HB1      ALA1104  39.887  -6.818  -0.545
   14    H    GLU1105           HN       GLU1105  36.359  -6.809   1.037
   15    HA   GLU1105           HA       GLU1105  35.423  -6.604  -1.726
   16   1HB   GLU1105           HB2      GLU1105  34.364  -8.624  -0.808
   17   2HB   GLU1105           HB1      GLU1105  33.733  -7.685   0.536
   18   1HG   GLU1105           HG2      GLU1105  32.012  -8.074  -1.115
   19   2HG   GLU1105           HG1      GLU1105  32.395  -6.356  -1.015
   20    H    PHE1106           HN       PHE1106  35.187  -4.496  -2.041
   21    HA   PHE1106           HA       PHE1106  33.817  -2.915   0.028
   22   1HB   PHE1106           HB2      PHE1106  36.187  -2.021  -1.627
   23   2HB   PHE1106           HB1      PHE1106  35.278  -1.001  -0.516
   24    HD1  PHE1106           HD1      PHE1106  37.743  -3.666  -0.821
   25    HD2  PHE1106           HD2      PHE1106  35.476  -1.292   1.888
   26    HE1  PHE1106           HE1      PHE1106  39.222  -4.360   1.020
   27    HE2  PHE1106           HE2      PHE1106  36.951  -1.981   3.733
   28    HZ   PHE1106           HZ       PHE1106  38.827  -3.517   3.299
   29    H    GLY1107           HN       GLY1107  32.214  -1.613  -0.686
   30   1HA   GLY1107           HA1      GLY1107  31.039  -1.986  -3.162
   31   2HA   GLY1107           HA2      GLY1107  32.055  -0.564  -3.307
   32    H    LYS1108           HN       LYS1108  31.753   0.903  -1.172
   33    HA   LYS1108           HA       LYS1108  29.346   1.056   0.156
   34   1HB   LYS1108           HB2      LYS1108  31.036   3.359  -0.845
   35   2HB   LYS1108           HB1      LYS1108  29.788   3.474   0.389
   36   1HG   LYS1108           HG2      LYS1108  32.096   1.601   0.717
   37   2HG   LYS1108           HG1      LYS1108  32.248   3.312   1.118
   38   1HD   LYS1108           HD2      LYS1108  30.363   3.117   2.668
   39   2HD   LYS1108           HD1      LYS1108  30.206   1.407   2.262
   40   1HE   LYS1108           HE2      LYS1108  32.607   2.710   3.538
   41   2HE   LYS1108           HE1      LYS1108  31.409   1.717   4.366
   42   1HZ   LYS1108           HZ2      LYS1108  33.203   0.800   2.184
   43   2HZ   LYS1108           HZ1      LYS1108  33.389   0.448   3.828
   44   3HZ   LYS1108           HZ3      LYS1108  32.054  -0.153   2.978
   45    H    CYS1109           HN       CYS1109  27.348   1.285  -0.480
   46    HA   CYS1109           HA       CYS1109  26.788   2.058  -3.215
   47   1HB   CYS1109           HB2      CYS1109  24.348   1.583  -2.203
   48   2HB   CYS1109           HB1      CYS1109  25.408   0.308  -2.792
   49    H    GLY1110           HN       GLY1110  24.576   3.311  -3.376
   50   1HA   GLY1110           HA1      GLY1110  24.414   5.755  -3.473
   51   2HA   GLY1110           HA2      GLY1110  24.924   5.781  -1.791
   52    HA   PRO1111           HA       PRO1111  20.588   6.312  -0.897
   53   1HB   PRO1111           HB2      PRO1111  19.744   7.407  -3.529
   54   2HB   PRO1111           HB1      PRO1111  19.497   8.058  -1.905
   55   1HG   PRO1111           HG2      PRO1111  21.305   9.130  -3.556
   56   2HG   PRO1111           HG1      PRO1111  21.616   8.994  -1.816
   57   1HD   PRO1111           HD2      PRO1111  22.680   7.346  -4.068
   58   2HD   PRO1111           HD1      PRO1111  23.481   7.864  -2.570
   59    HA   PRO1112           HA       PRO1112  19.415   2.349  -2.729
   60   1HB   PRO1112           HB2      PRO1112  17.463   1.850  -0.852
   61   2HB   PRO1112           HB1      PRO1112  19.173   1.462  -0.647
   62   1HG   PRO1112           HG2      PRO1112  17.631   3.819   0.357
   63   2HG   PRO1112           HG1      PRO1112  18.864   2.851   1.187
   64   1HD   PRO1112           HD2      PRO1112  19.441   5.248   0.137
   65   2HD   PRO1112           HD1      PRO1112  20.611   3.913   0.091
   66    HA   PRO1113           HA       PRO1113  16.143   4.401  -5.220
   67   1HB   PRO1113           HB2      PRO1113  16.216   1.593  -6.254
   68   2HB   PRO1113           HB1      PRO1113  16.100   3.115  -7.147
   69   1HG   PRO1113           HG2      PRO1113  18.413   1.807  -6.997
   70   2HG   PRO1113           HG1      PRO1113  18.363   3.577  -6.910
   71   1HD   PRO1113           HD2      PRO1113  18.843   1.590  -4.756
   72   2HD   PRO1113           HD1      PRO1113  19.450   3.248  -4.918
   73    HA   PRO1114           HA       PRO1114  13.159   2.458  -2.368
   74   1HB   PRO1114           HB2      PRO1114  11.706   4.979  -2.720
   75   2HB   PRO1114           HB1      PRO1114  12.347   4.253  -1.244
   76   1HG   PRO1114           HG2      PRO1114  13.441   6.460  -2.309
   77   2HG   PRO1114           HG1      PRO1114  14.428   5.215  -1.515
   78   1HD   PRO1114           HD2      PRO1114  13.941   5.644  -4.450
   79   2HD   PRO1114           HD1      PRO1114  15.475   5.350  -3.600
   80    H    ILE1115           HN       ILE1115  10.577   2.865  -2.472
   81    HA   ILE1115           HA       ILE1115   9.802   1.914  -5.139
   82    HB   ILE1115           HB       ILE1115   7.653   1.301  -3.754
   83   1HG1  ILE1115          2HG1      ILE1115   9.797   1.584  -1.635
   84   2HG1  ILE1115          1HG1      ILE1115   8.256   2.430  -1.702
   85   1HG2  ILE1115          2HG2      ILE1115  10.253  -0.203  -3.513
   86   2HG2  ILE1115          1HG2      ILE1115   8.649  -0.885  -3.243
   87   3HG2  ILE1115          3HG2      ILE1115   9.104  -0.308  -4.847
   88   1HD1  ILE1115          2HD1      ILE1115   8.579  -0.534  -1.309
   89   2HD1  ILE1115          1HD1      ILE1115   8.290   0.643  -0.026
   90   3HD1  ILE1115          3HD1      ILE1115   7.068   0.375  -1.271
   91    H    ASP1116           HN       ASP1116   7.725   2.596  -6.005
   92    HA   ASP1116           HA       ASP1116   7.371   5.352  -6.079
   93   1HB   ASP1116           HB2      ASP1116   6.494   3.841  -7.809
   94   2HB   ASP1116           HB1      ASP1116   5.324   3.197  -6.662
   95    H    ASN1117           HN       ASN1117   6.800   6.644  -4.458
   96    HA   ASN1117           HA       ASN1117   5.692   7.509  -2.665
   97   1HB   ASN1117           HB2      ASN1117   3.662   5.342  -3.272
   98   2HB   ASN1117           HB1      ASN1117   3.407   6.702  -2.181
   99   1HD2  ASN1117          1HD2      ASN1117   1.969   5.936  -4.600
  100   2HD2  ASN1117          2HD2      ASN1117   2.053   7.302  -5.656
  101    H    GLY1118           HN       GLY1118   7.749   5.646  -2.266
  102   1HA   GLY1118           HA1      GLY1118   7.808   3.520  -0.820
  103   2HA   GLY1118           HA2      GLY1118   6.906   4.509   0.316
  104    H    ASP1119           HN       ASP1119   9.216   3.364   1.111
  105    HA   ASP1119           HA       ASP1119  11.640   4.591   0.837
  106   1HB   ASP1119           HB2      ASP1119  10.379   6.706   1.439
  107   2HB   ASP1119           HB1      ASP1119  10.113   6.007   3.033
  108    H    ILE1120           HN       ILE1120  13.032   4.356   2.909
  109    HA   ILE1120           HA       ILE1120  12.654   1.750   3.870
  110    HB   ILE1120           HB       ILE1120  14.284   3.456   5.611
  111   1HG1  ILE1120          2HG1      ILE1120  14.865   3.240   2.650
  112   2HG1  ILE1120          1HG1      ILE1120  14.671   4.718   3.583
  113   1HG2  ILE1120          3HG2      ILE1120  14.798   0.992   3.964
  114   2HG2  ILE1120          2HG2      ILE1120  15.912   1.670   5.153
  115   3HG2  ILE1120          1HG2      ILE1120  14.347   1.036   5.667
  116   1HD1  ILE1120          3HD1      ILE1120  16.721   4.146   4.833
  117   2HD1  ILE1120          2HD1      ILE1120  16.929   2.744   3.784
  118   3HD1  ILE1120          1HD1      ILE1120  16.991   4.371   3.105
  119    H    THR1121           HN       THR1121  12.037   0.967   5.871
  120    HA   THR1121           HA       THR1121   9.800   2.170   7.040
  121    HB   THR1121           HB       THR1121   9.923   0.423   8.740
  122    HG1  THR1121           HG1      THR1121  11.730  -0.734   9.070
  123   1HG2  THR1121          1HG2      THR1121  10.653  -0.535   5.966
  124   2HG2  THR1121          3HG2      THR1121   9.954  -1.543   7.234
  125   3HG2  THR1121          2HG2      THR1121   9.030  -0.197   6.568
  126    H    SER1122           HN       SER1122  12.971   3.079   7.359
  127    HA   SER1122           HA       SER1122  12.460   4.272  10.006
  128   1HB   SER1122           HB2      SER1122  14.304   2.594  10.007
  129   2HB   SER1122           HB1      SER1122  15.157   3.576   8.819
  130    HG   SER1122           HG       SER1122  14.709   5.289  10.598
  131    H    PHE1123           HN       PHE1123  14.954   4.864   7.581
  132    HA   PHE1123           HA       PHE1123  13.832   7.353   6.699
  133   1HB   PHE1123           HB2      PHE1123  14.784   7.894   8.966
  134   2HB   PHE1123           HB1      PHE1123  16.368   7.455   8.344
  135    HD1  PHE1123           HD1      PHE1123  13.603   9.868   8.047
  136    HD2  PHE1123           HD2      PHE1123  17.620   8.940   6.996
  137    HE1  PHE1123           HE1      PHE1123  13.914  12.167   7.225
  138    HE2  PHE1123           HE2      PHE1123  17.940  11.237   6.172
  139    HZ   PHE1123           HZ       PHE1123  16.085  12.853   6.287
  140    HA   PRO1124           HA       PRO1124  16.507   6.162   3.338
  141   1HB   PRO1124           HB2      PRO1124  16.391   8.391   1.826
  142   2HB   PRO1124           HB1      PRO1124  15.013   7.296   1.992
  143   1HG   PRO1124           HG2      PRO1124  15.553   9.891   3.389
  144   2HG   PRO1124           HG1      PRO1124  14.039   9.296   2.685
  145   1HD   PRO1124           HD2      PRO1124  14.590   9.178   5.349
  146   2HD   PRO1124           HD1      PRO1124  13.547   8.006   4.522
  147    H    LEU1125           HN       LEU1125  18.684   6.141   3.108
  148    HA   LEU1125           HA       LEU1125  20.181   8.417   4.219
  149   1HB   LEU1125           HB2      LEU1125  21.576   5.838   3.737
  150   2HB   LEU1125           HB1      LEU1125  21.797   7.017   5.016
  151    HG   LEU1125           HG       LEU1125  19.776   4.805   4.847
  152   1HD1  LEU1125          2HD1      LEU1125  21.797   5.604   6.932
  153   2HD1  LEU1125          1HD1      LEU1125  20.695   4.232   7.039
  154   3HD1  LEU1125          3HD1      LEU1125  21.943   4.264   5.794
  155   1HD2  LEU1125          3HD2      LEU1125  19.564   7.364   6.321
  156   2HD2  LEU1125          2HD2      LEU1125  18.299   6.321   5.654
  157   3HD2  LEU1125          1HD2      LEU1125  19.102   5.885   7.167
  158    H    SER1126           HN       SER1126  22.067   9.124   3.135
  159    HA   SER1126           HA       SER1126  21.814   8.935   0.254
  160   1HB   SER1126           HB2      SER1126  23.706  10.584   1.951
  161   2HB   SER1126           HB1      SER1126  23.510  10.725   0.204
  162    HG   SER1126           HG       SER1126  21.439  11.465   0.506
  163    H    VAL1127           HN       VAL1127  24.318   8.346   2.703
  164    HA   VAL1127           HA       VAL1127  25.790   6.756   0.713
  165    HB   VAL1127           HB       VAL1127  27.133   8.544   1.676
  166   1HG1  VAL1127          1HG1      VAL1127  25.960   8.815   3.793
  167   2HG1  VAL1127          3HG1      VAL1127  26.566   7.252   4.342
  168   3HG1  VAL1127          2HG1      VAL1127  27.688   8.583   4.059
  169   1HG2  VAL1127          3HG2      VAL1127  28.254   6.464   1.088
  170   2HG2  VAL1127          2HG2      VAL1127  29.019   7.206   2.493
  171   3HG2  VAL1127          1HG2      VAL1127  27.944   5.825   2.702
  172    H    TYR1128           HN       TYR1128  25.726   4.629   0.888
  173    HA   TYR1128           HA       TYR1128  24.998   3.460   3.491
  174   1HB   TYR1128           HB2      TYR1128  23.884   3.077   0.832
  175   2HB   TYR1128           HB1      TYR1128  24.377   1.557   1.570
  176    HD1  TYR1128           HD1      TYR1128  23.504   1.078   3.948
  177    HD2  TYR1128           HD2      TYR1128  21.841   4.035   1.385
  178    HE1  TYR1128           HE1      TYR1128  21.418   1.022   5.249
  179    HE2  TYR1128           HE2      TYR1128  19.752   3.993   2.677
  180    HH   TYR1128           HH       TYR1128  18.543   2.413   4.168
  181    H    ALA1129           HN       ALA1129  25.635   1.122   3.649
  182    HA   ALA1129           HA       ALA1129  28.443   0.873   2.842
  183   1HB   ALA1129           HB3      ALA1129  27.943   0.657   5.227
  184   2HB   ALA1129           HB2      ALA1129  26.871  -0.699   4.883
  185   3HB   ALA1129           HB1      ALA1129  28.601  -0.843   4.573
  186    HA   PRO1130           HA       PRO1130  27.602  -2.201  -0.211
  187   1HB   PRO1130           HB2      PRO1130  29.818  -3.794   0.062
  188   2HB   PRO1130           HB1      PRO1130  29.807  -2.251  -0.797
  189   1HG   PRO1130           HG2      PRO1130  30.709  -2.872   1.987
  190   2HG   PRO1130           HG1      PRO1130  31.449  -1.802   0.782
  191   1HD   PRO1130           HD2      PRO1130  29.977  -0.851   2.830
  192   2HD   PRO1130           HD1      PRO1130  29.985  -0.073   1.234
  193    H    ALA1131           HN       ALA1131  26.748  -4.228  -0.438
  194    HA   ALA1131           HA       ALA1131  25.745  -6.180   0.144
  195   1HB   ALA1131           HB1      ALA1131  28.047  -6.894   0.581
  196   2HB   ALA1131           HB2      ALA1131  26.903  -7.660   1.683
  197   3HB   ALA1131           HB3      ALA1131  27.905  -6.321   2.242
  198    H    SER1132           HN       SER1132  25.302  -3.515   1.736
  199    HA   SER1132           HA       SER1132  24.233  -4.497   4.234
  200   1HB   SER1132           HB2      SER1132  24.115  -1.782   2.911
  201   2HB   SER1132           HB1      SER1132  23.392  -2.139   4.479
  202    HG   SER1132           HG       SER1132  25.294  -1.787   5.275
  203    H    SER1133           HN       SER1133  22.062  -4.556   4.840
  204    HA   SER1133           HA       SER1133  20.119  -4.448   2.630
  205   1HB   SER1133           HB2      SER1133  20.009  -6.485   4.856
  206   2HB   SER1133           HB1      SER1133  19.067  -6.450   3.367
  207    HG   SER1133           HG       SER1133  21.662  -6.447   2.749
  208    H    VAL1134           HN       VAL1134  18.008  -3.814   3.176
  209    HA   VAL1134           HA       VAL1134  17.530  -2.977   5.936
  210    HB   VAL1134           HB       VAL1134  16.603  -0.787   5.124
  211   1HG1  VAL1134          2HG1      VAL1134  19.561  -1.253   4.778
  212   2HG1  VAL1134          1HG1      VAL1134  18.792   0.315   5.024
  213   3HG1  VAL1134          3HG1      VAL1134  18.723  -0.908   6.291
  214   1HG2  VAL1134          2HG2      VAL1134  16.398  -1.343   2.764
  215   2HG2  VAL1134          1HG2      VAL1134  17.415   0.080   2.988
  216   3HG2  VAL1134          3HG2      VAL1134  18.151  -1.483   2.633
  217    H    GLU1135           HN       GLU1135  15.255  -2.053   6.128
  218    HA   GLU1135           HA       GLU1135  13.411  -3.729   4.554
  219   1HB   GLU1135           HB2      GLU1135  13.509  -4.404   6.898
  220   2HB   GLU1135           HB1      GLU1135  13.177  -2.755   7.409
  221   1HG   GLU1135           HG2      GLU1135  10.973  -2.888   6.332
  222   2HG   GLU1135           HG1      GLU1135  11.309  -4.563   5.896
  223    H    TYR1136           HN       TYR1136  11.969  -2.712   3.345
  224    HA   TYR1136           HA       TYR1136  11.612   0.172   3.756
  225   1HB   TYR1136           HB2      TYR1136  11.669  -1.581   1.370
  226   2HB   TYR1136           HB1      TYR1136  10.529  -0.242   1.328
  227    HD1  TYR1136           HD1      TYR1136  14.108  -0.861   2.234
  228    HD2  TYR1136           HD2      TYR1136  11.262   1.739   0.438
  229    HE1  TYR1136           HE1      TYR1136  15.922   0.666   1.578
  230    HE2  TYR1136           HE2      TYR1136  13.064   3.269  -0.225
  231    HH   TYR1136           HH       TYR1136  15.356   3.821   0.469
  232    H    GLN1137           HN       GLN1137   9.445   0.972   2.907
  233    HA   GLN1137           HA       GLN1137   7.167  -0.729   3.201
  234   1HB   GLN1137           HB2      GLN1137   7.846  -0.346   5.582
  235   2HB   GLN1137           HB1      GLN1137   7.604   1.377   5.328
  236   1HG   GLN1137           HG2      GLN1137   5.244   0.974   4.839
  237   2HG   GLN1137           HG1      GLN1137   5.488  -0.753   5.099
  238   1HE2  GLN1137          1HE2      GLN1137   3.731   1.119   6.482
  239   2HE2  GLN1137          2HE2      GLN1137   4.166   1.040   8.152
  240    H    CYS1138           HN       CYS1138   5.119   0.567   3.020
  241    HA   CYS1138           HA       CYS1138   5.595   2.805   1.196
  242   1HB   CYS1138           HB2      CYS1138   3.069   1.218   1.692
  243   2HB   CYS1138           HB1      CYS1138   3.293   2.443   0.446
  244    H    GLN1139           HN       GLN1139   4.348   4.726   1.331
  245    HA   GLN1139           HA       GLN1139   4.254   5.945   3.802
  246   1HB   GLN1139           HB2      GLN1139   2.505   6.630   1.433
  247   2HB   GLN1139           HB1      GLN1139   2.935   7.704   2.757
  248   1HG   GLN1139           HG2      GLN1139   4.814   6.553   0.708
  249   2HG   GLN1139           HG1      GLN1139   4.235   8.216   0.789
  250   1HE2  GLN1139          1HE2      GLN1139   6.361   5.848   2.158
  251   2HE2  GLN1139          2HE2      GLN1139   7.288   6.937   3.126
  252    H    ASN1140           HN       ASN1140   2.237   6.934   4.807
  253    HA   ASN1140           HA       ASN1140   0.713   5.028   6.053
  254   1HB   ASN1140           HB2      ASN1140  -0.900   6.919   6.546
  255   2HB   ASN1140           HB1      ASN1140   0.782   7.222   6.970
  256   1HD2  ASN1140          1HD2      ASN1140  -1.809   7.993   4.786
  257   2HD2  ASN1140          2HD2      ASN1140  -1.087   9.409   4.111
  258    H    LEU1141           HN       LEU1141  -1.352   4.207   5.832
  259    HA   LEU1141           HA       LEU1141  -3.268   3.510   4.831
  260   1HB   LEU1141           HB2      LEU1141  -2.677   5.881   3.105
  261   2HB   LEU1141           HB1      LEU1141  -3.941   4.758   2.644
  262    HG   LEU1141           HG       LEU1141  -5.064   5.180   4.818
  263   1HD1  LEU1141          2HD1      LEU1141  -3.102   5.836   6.113
  264   2HD1  LEU1141          1HD1      LEU1141  -2.949   7.302   5.146
  265   3HD1  LEU1141          3HD1      LEU1141  -4.358   7.071   6.182
  266   1HD2  LEU1141          2HD2      LEU1141  -5.731   6.405   2.822
  267   2HD2  LEU1141          1HD2      LEU1141  -5.871   7.417   4.259
  268   3HD2  LEU1141          3HD2      LEU1141  -4.511   7.633   3.157
  269    H    TYR1142           HN       TYR1142  -0.448   3.992   2.784
  270    HA   TYR1142           HA       TYR1142  -1.295   2.008   0.868
  271   1HB   TYR1142           HB2      TYR1142   1.351   3.429   1.235
  272   2HB   TYR1142           HB1      TYR1142   0.973   2.347  -0.103
  273    HD1  TYR1142           HD1      TYR1142   0.516   5.675   1.287
  274    HD2  TYR1142           HD2      TYR1142  -0.689   3.010  -1.802
  275    HE1  TYR1142           HE1      TYR1142  -0.424   7.567   0.030
  276    HE2  TYR1142           HE2      TYR1142  -1.631   4.894  -3.069
  277    HH   TYR1142           HH       TYR1142  -2.478   7.163  -2.638
  278    H    GLN1143           HN       GLN1143  -0.844  -0.110   0.867
  279    HA   GLN1143           HA       GLN1143   0.886  -1.121   3.024
  280   1HB   GLN1143           HB2      GLN1143  -1.544  -2.251   1.676
  281   2HB   GLN1143           HB1      GLN1143  -0.387  -3.327   2.448
  282   1HG   GLN1143           HG2      GLN1143  -1.489  -0.999   3.953
  283   2HG   GLN1143           HG1      GLN1143  -2.449  -2.465   3.763
  284   1HE2  GLN1143          1HE2      GLN1143   1.029  -2.524   3.976
  285   2HE2  GLN1143          2HE2      GLN1143   1.118  -3.251   5.539
  286    H    LEU1144           HN       LEU1144   2.738  -2.053   2.514
  287    HA   LEU1144           HA       LEU1144   3.549  -2.321  -0.212
  288   1HB   LEU1144           HB2      LEU1144   5.068  -1.663   1.638
  289   2HB   LEU1144           HB1      LEU1144   4.928  -3.282   2.295
  290    HG   LEU1144           HG       LEU1144   5.958  -4.179   0.220
  291   1HD1  LEU1144          3HD1      LEU1144   5.285  -2.325  -1.263
  292   2HD1  LEU1144          2HD1      LEU1144   6.451  -1.283  -0.449
  293   3HD1  LEU1144          1HD1      LEU1144   7.008  -2.688  -1.357
  294   1HD2  LEU1144          3HD2      LEU1144   7.295  -3.682   2.224
  295   2HD2  LEU1144          2HD2      LEU1144   8.214  -3.472   0.734
  296   3HD2  LEU1144          1HD2      LEU1144   7.601  -2.062   1.599
  297    H    GLU1145           HN       GLU1145   4.385  -4.280  -1.175
  298    HA   GLU1145           HA       GLU1145   3.459  -6.809  -0.083
  299   1HB   GLU1145           HB2      GLU1145   1.567  -5.827  -1.440
  300   2HB   GLU1145           HB1      GLU1145   2.607  -5.951  -2.852
  301   1HG   GLU1145           HG2      GLU1145   1.889  -8.309  -1.136
  302   2HG   GLU1145           HG1      GLU1145   0.939  -7.805  -2.532
  303    H    GLY1146           HN       GLY1146   5.134  -8.131  -0.248
  304   1HA   GLY1146           HA1      GLY1146   6.966  -7.803  -2.543
  305   2HA   GLY1146           HA2      GLY1146   6.434  -9.390  -2.007
  306    H    ASN1147           HN       ASN1147   9.137  -8.704  -2.195
  307    HA   ASN1147           HA       ASN1147   9.950  -9.183   0.542
  308   1HB   ASN1147           HB2      ASN1147  10.896 -10.292  -1.628
  309   2HB   ASN1147           HB1      ASN1147  11.870  -8.827  -1.729
  310   1HD2  ASN1147          1HD2      ASN1147  13.494  -8.465  -0.275
  311   2HD2  ASN1147          2HD2      ASN1147  14.061  -9.678   0.818
  312    H    LYS1148           HN       LYS1148   9.594  -7.230   1.586
  313    HA   LYS1148           HA       LYS1148  10.500  -4.723   0.641
  314   1HB   LYS1148           HB2      LYS1148  10.232  -4.101   3.129
  315   2HB   LYS1148           HB1      LYS1148   8.807  -4.604   2.229
  316   1HG   LYS1148           HG2      LYS1148   8.755  -5.636   4.383
  317   2HG   LYS1148           HG1      LYS1148   9.073  -6.881   3.174
  318   1HD   LYS1148           HD2      LYS1148  11.466  -6.775   3.710
  319   2HD   LYS1148           HD1      LYS1148  11.130  -5.553   4.938
  320   1HE   LYS1148           HE2      LYS1148  10.111  -8.391   4.911
  321   2HE   LYS1148           HE1      LYS1148  11.370  -7.743   5.961
  322   1HZ   LYS1148           HZ1      LYS1148   9.728  -6.247   6.929
  323   2HZ   LYS1148           HZ3      LYS1148   8.522  -6.904   5.940
  324   3HZ   LYS1148           HZ2      LYS1148   9.266  -7.864   7.117
  325    H    ARG1149           HN       ARG1149  12.324  -7.284   1.375
  326    HA   ARG1149           HA       ARG1149  14.417  -5.794   2.785
  327   1HB   ARG1149           HB2      ARG1149  13.806  -8.076   3.572
  328   2HB   ARG1149           HB1      ARG1149  14.343  -8.720   2.028
  329   1HG   ARG1149           HG2      ARG1149  16.100  -9.067   3.572
  330   2HG   ARG1149           HG1      ARG1149  16.601  -7.748   2.513
  331   1HD   ARG1149           HD2      ARG1149  17.147  -7.234   4.822
  332   2HD   ARG1149           HD1      ARG1149  15.916  -6.126   4.216
  333    HE   ARG1149           HE       ARG1149  14.612  -8.249   5.464
  334   1HH1  ARG1149          1HH1      ARG1149  16.730  -5.612   6.302
  335   2HH1  ARG1149          2HH1      ARG1149  16.111  -5.457   7.913
  336   1HH2  ARG1149          1HH2      ARG1149  13.791  -8.051   7.582
  337   2HH2  ARG1149          2HH2      ARG1149  14.442  -6.844   8.641
  338    H    ILE1150           HN       ILE1150  15.806  -4.700   1.558
  339    HA   ILE1150           HA       ILE1150  16.570  -5.886  -1.030
  340    HB   ILE1150           HB       ILE1150  16.859  -3.687  -1.959
  341   1HG1  ILE1150          2HG1      ILE1150  15.876  -2.588   0.684
  342   2HG1  ILE1150          1HG1      ILE1150  17.560  -2.578   0.171
  343   1HG2  ILE1150          3HG2      ILE1150  14.198  -3.973  -0.571
  344   2HG2  ILE1150          2HG2      ILE1150  14.523  -2.916  -1.945
  345   3HG2  ILE1150          1HG2      ILE1150  14.651  -4.665  -2.128
  346   1HD1  ILE1150          1HD1      ILE1150  16.976  -1.161  -1.726
  347   2HD1  ILE1150          3HD1      ILE1150  15.289  -1.169  -1.209
  348   3HD1  ILE1150          2HD1      ILE1150  16.519  -0.420  -0.192
  349    H    THR1151           HN       THR1151  18.707  -5.106  -1.836
  350    HA   THR1151           HA       THR1151  20.640  -4.375   0.208
  351    HB   THR1151           HB       THR1151  20.908  -6.959  -1.346
  352    HG1  THR1151           HG1      THR1151  20.740  -7.898   0.761
  353   1HG2  THR1151          2HG2      THR1151  23.052  -5.822  -0.987
  354   2HG2  THR1151          1HG2      THR1151  22.712  -5.729   0.741
  355   3HG2  THR1151          3HG2      THR1151  22.939  -7.299  -0.030
  356    H    CYS1152           HN       CYS1152  22.488  -3.418  -0.646
  357    HA   CYS1152           HA       CYS1152  22.278  -2.685  -3.447
  358   1HB   CYS1152           HB2      CYS1152  23.959  -1.018  -2.989
  359   2HB   CYS1152           HB1      CYS1152  22.720  -0.951  -1.747
  360    H    ARG1153           HN       ARG1153  23.392  -3.538  -5.010
  361    HA   ARG1153           HA       ARG1153  25.693  -5.242  -4.343
  362   1HB   ARG1153           HB2      ARG1153  25.244  -6.051  -6.795
  363   2HB   ARG1153           HB1      ARG1153  24.249  -6.645  -5.475
  364   1HG   ARG1153           HG2      ARG1153  23.424  -4.272  -7.111
  365   2HG   ARG1153           HG1      ARG1153  23.082  -5.926  -7.627
  366   1HD   ARG1153           HD2      ARG1153  22.156  -4.553  -5.106
  367   2HD   ARG1153           HD1      ARG1153  21.164  -5.099  -6.459
  368    HE   ARG1153           HE       ARG1153  22.664  -7.191  -5.152
  369   1HH1  ARG1153          1HH1      ARG1153  19.678  -5.398  -5.242
  370   2HH1  ARG1153          2HH1      ARG1153  18.765  -6.631  -4.439
  371   1HH2  ARG1153          1HH2      ARG1153  21.469  -8.817  -4.095
  372   2HH2  ARG1153          2HH2      ARG1153  19.782  -8.574  -3.786
  373    H    ASN1154           HN       ASN1154  27.631  -4.474  -4.789
  374    HA   ASN1154           HA       ASN1154  29.270  -3.084  -5.524
  375   1HB   ASN1154           HB2      ASN1154  29.507  -2.974  -7.988
  376   2HB   ASN1154           HB1      ASN1154  29.205  -4.603  -7.406
  377   1HD2  ASN1154          1HD2      ASN1154  27.335  -5.624  -7.941
  378   2HD2  ASN1154          2HD2      ASN1154  26.227  -5.022  -9.122
  379    H    GLY1155           HN       GLY1155  27.436  -1.571  -4.352
  380   1HA   GLY1155           HA1      GLY1155  27.813   0.962  -5.569
  381   2HA   GLY1155           HA2      GLY1155  26.832   0.633  -4.150
  382    H    GLN1156           HN       GLN1156  25.230  -1.358  -5.752
  383    HA   GLN1156           HA       GLN1156  23.433   0.623  -6.945
  384   1HB   GLN1156           HB2      GLN1156  24.323  -1.908  -8.339
  385   2HB   GLN1156           HB1      GLN1156  23.029  -0.855  -8.894
  386   1HG   GLN1156           HG2      GLN1156  24.623   0.971  -9.168
  387   2HG   GLN1156           HG1      GLN1156  25.922  -0.080  -8.605
  388   1HE2  GLN1156          1HE2      GLN1156  23.318  -1.192 -10.640
  389   2HE2  GLN1156          2HE2      GLN1156  24.271  -1.444 -12.058
  390    H    TRP1157           HN       TRP1157  21.941   0.382  -5.326
  391    HA   TRP1157           HA       TRP1157  21.101  -2.032  -4.171
  392   1HB   TRP1157           HB2      TRP1157  19.709   0.618  -4.490
  393   2HB   TRP1157           HB1      TRP1157  19.007  -0.723  -3.602
  394    HD1  TRP1157           HD1      TRP1157  21.855   1.805  -3.417
  395    HE1  TRP1157           HE1      TRP1157  22.605   1.986  -0.969
  396    HE3  TRP1157           HE3      TRP1157  19.109  -2.023  -1.462
  397    HZ2  TRP1157           HZ2      TRP1157  22.121   0.642   1.479
  398    HZ3  TRP1157           HZ3      TRP1157  19.311  -2.522   0.937
  399    HH2  TRP1157           HH2      TRP1157  20.785  -1.218   2.376
  400    H    SER1158           HN       SER1158  18.475  -2.172  -4.218
  401    HA   SER1158           HA       SER1158  17.513  -2.435  -6.960
  402   1HB   SER1158           HB2      SER1158  16.651  -4.695  -6.512
  403   2HB   SER1158           HB1      SER1158  18.412  -4.651  -6.408
  404    HG   SER1158           HG       SER1158  18.148  -4.483  -4.111
  405    H    GLU1159           HN       GLU1159  15.681  -1.350  -7.016
  406    HA   GLU1159           HA       GLU1159  14.278  -0.192  -5.024
  407   1HB   GLU1159           HB2      GLU1159  13.816   0.273  -7.352
  408   2HB   GLU1159           HB1      GLU1159  13.179  -1.348  -7.589
  409   1HG   GLU1159           HG2      GLU1159  11.331  -0.851  -6.079
  410   2HG   GLU1159           HG1      GLU1159  11.972   0.773  -5.827
  411    HA   PRO1160           HA       PRO1160  12.445  -3.368  -2.530
  412   1HB   PRO1160           HB2      PRO1160  10.303  -1.372  -2.060
  413   2HB   PRO1160           HB1      PRO1160  11.332  -2.210  -0.896
  414   1HG   PRO1160           HG2      PRO1160  11.694   0.375  -1.467
  415   2HG   PRO1160           HG1      PRO1160  13.064  -0.702  -1.136
  416   1HD   PRO1160           HD2      PRO1160  12.055   0.362  -3.740
  417   2HD   PRO1160           HD1      PRO1160  13.726   0.082  -3.209
  418    HA   PRO1161           HA       PRO1161   9.053  -5.359  -4.561
  419   1HB   PRO1161           HB2      PRO1161   6.941  -5.305  -2.761
  420   2HB   PRO1161           HB1      PRO1161   8.241  -6.498  -2.775
  421   1HG   PRO1161           HG2      PRO1161   7.937  -4.043  -1.103
  422   2HG   PRO1161           HG1      PRO1161   8.548  -5.644  -0.646
  423   1HD   PRO1161           HD2      PRO1161  10.216  -3.605  -1.088
  424   2HD   PRO1161           HD1      PRO1161  10.632  -5.254  -1.596
  425    H    LYS1162           HN       LYS1162   6.209  -4.298  -3.342
  426    HA   LYS1162           HA       LYS1162   6.045  -1.865  -4.931
  427   1HB   LYS1162           HB2      LYS1162   5.544  -3.361  -6.637
  428   2HB   LYS1162           HB1      LYS1162   4.593  -4.404  -5.598
  429   1HG   LYS1162           HG2      LYS1162   2.857  -2.680  -5.482
  430   2HG   LYS1162           HG1      LYS1162   3.824  -1.645  -6.534
  431   1HD   LYS1162           HD2      LYS1162   2.797  -4.381  -7.283
  432   2HD   LYS1162           HD1      LYS1162   2.027  -2.859  -7.736
  433   1HE   LYS1162           HE2      LYS1162   4.056  -2.193  -8.934
  434   2HE   LYS1162           HE1      LYS1162   4.819  -3.718  -8.487
  435   1HZ   LYS1162           HZ3      LYS1162   2.380  -3.433 -10.159
  436   2HZ   LYS1162           HZ2      LYS1162   3.930  -3.797 -10.730
  437   3HZ   LYS1162           HZ1      LYS1162   3.118  -4.895  -9.733
  438    H    CYS1163           HN       CYS1163   4.171  -0.643  -4.627
  439    HA   CYS1163           HA       CYS1163   2.983  -1.048  -1.981
  440   1HB   CYS1163           HB2      CYS1163   3.140   1.366  -3.788
  441   2HB   CYS1163           HB1      CYS1163   2.223   1.341  -2.284
  442    H    LEU1164           HN       LEU1164   0.746  -0.827  -1.615
  443    HA   LEU1164           HA       LEU1164  -0.944  -1.191  -4.001
  444   1HB   LEU1164           HB2      LEU1164  -1.566  -2.458  -1.350
  445   2HB   LEU1164           HB1      LEU1164  -2.231  -2.841  -2.925
  446    HG   LEU1164           HG       LEU1164   0.577  -3.443  -2.005
  447   1HD1  LEU1164          2HD1      LEU1164  -1.785  -5.248  -2.482
  448   2HD1  LEU1164          1HD1      LEU1164  -0.149  -5.777  -2.093
  449   3HD1  LEU1164          3HD1      LEU1164  -1.076  -4.847  -0.917
  450   1HD2  LEU1164          1HD2      LEU1164   0.493  -2.977  -4.397
  451   2HD2  LEU1164          3HD2      LEU1164   0.778  -4.692  -4.098
  452   3HD2  LEU1164          2HD2      LEU1164  -0.823  -4.135  -4.583
  453    H    HIS1165           HN       HIS1165  -2.342   0.423  -4.209
  454    HA   HIS1165           HA       HIS1165  -2.785   2.459  -2.393
  455   1HB   HIS1165           HB2      HIS1165  -4.703   1.451  -4.508
  456   2HB   HIS1165           HB1      HIS1165  -4.771   3.030  -3.732
  457    HD1  HIS1165           HD1      HIS1165  -3.114   1.174  -6.455
  458    HD2  HIS1165           HD2      HIS1165  -2.669   4.813  -4.500
  459    HE1  HIS1165           HE1      HIS1165  -1.591   2.539  -7.917
  460    HE2  HIS1165           HE2      HIS1165  -1.270   4.706  -6.673
  461    HA   PRO1166           HA       PRO1166  -5.210   0.586   0.801
  462   1HB   PRO1166           HB2      PRO1166  -6.468   2.857   1.710
  463   2HB   PRO1166           HB1      PRO1166  -4.822   2.387   2.150
  464   1HG   PRO1166           HG2      PRO1166  -5.750   4.342   0.084
  465   2HG   PRO1166           HG1      PRO1166  -4.396   4.473   1.221
  466   1HD   PRO1166           HD2      PRO1166  -4.013   3.839  -1.361
  467   2HD   PRO1166           HD1      PRO1166  -3.022   3.130  -0.071
  468    H    CYS1167           HN       CYS1167  -7.616   1.033   1.679
  469    HA   CYS1167           HA       CYS1167  -9.303   0.191  -0.465
  470   1HB   CYS1167           HB2      CYS1167  -9.404  -0.496   2.015
  471   2HB   CYS1167           HB1      CYS1167 -10.260   1.022   2.265
  472    H    VAL1168           HN       VAL1168  -8.861   2.237  -1.714
  473    HA   VAL1168           HA       VAL1168 -10.476   4.507  -0.837
  474    HB   VAL1168           HB       VAL1168  -8.697   4.251  -3.268
  475   1HG1  VAL1168          1HG1      VAL1168 -10.477   5.888  -3.571
  476   2HG1  VAL1168          3HG1      VAL1168 -10.041   6.662  -2.048
  477   3HG1  VAL1168          2HG1      VAL1168  -8.915   6.689  -3.406
  478   1HG2  VAL1168          1HG2      VAL1168  -7.416   4.134  -1.201
  479   2HG2  VAL1168          3HG2      VAL1168  -7.134   5.670  -2.020
  480   3HG2  VAL1168          2HG2      VAL1168  -8.199   5.602  -0.616
  481    H    ILE1169           HN       ILE1169 -12.516   3.494  -1.081
  482    HA   ILE1169           HA       ILE1169 -13.310   2.669  -3.756
  483    HB   ILE1169           HB       ILE1169 -14.016   1.704  -1.335
  484   1HG1  ILE1169          2HG1      ILE1169 -15.788   1.701  -3.784
  485   2HG1  ILE1169          1HG1      ILE1169 -14.396   0.652  -3.533
  486   1HG2  ILE1169          3HG2      ILE1169 -16.241   3.579  -2.110
  487   2HG2  ILE1169          2HG2      ILE1169 -16.356   2.312  -0.889
  488   3HG2  ILE1169          1HG2      ILE1169 -15.248   3.662  -0.656
  489   1HD1  ILE1169          1HD1      ILE1169 -15.521  -0.304  -1.558
  490   2HD1  ILE1169          3HD1      ILE1169 -16.937   0.682  -1.925
  491   3HD1  ILE1169          2HD1      ILE1169 -16.410  -0.561  -3.060
  492    H    SER1170           HN       SER1170 -15.706   3.452  -4.287
  493    HA   SER1170           HA       SER1170 -15.481   6.318  -4.584
  494   1HB   SER1170           HB2      SER1170 -17.577   6.039  -5.958
  495   2HB   SER1170           HB1      SER1170 -16.195   5.101  -6.524
  496    HG   SER1170           HG       SER1170 -18.353   4.137  -4.951
  497    H    ARG1171           HN       ARG1171 -15.855   7.243  -2.593
  498    HA   ARG1171           HA       ARG1171 -17.937   6.549  -0.821
  499   1HB   ARG1171           HB2      ARG1171 -17.514   8.761   0.208
  500   2HB   ARG1171           HB1      ARG1171 -16.038   7.845  -0.060
  501   1HG   ARG1171           HG2      ARG1171 -15.571   9.168  -2.057
  502   2HG   ARG1171           HG1      ARG1171 -17.058  10.085  -1.796
  503   1HD   ARG1171           HD2      ARG1171 -16.197  10.864   0.357
  504   2HD   ARG1171           HD1      ARG1171 -14.711   9.951   0.095
  505    HE   ARG1171           HE       ARG1171 -15.083  11.664  -2.082
  506   1HH1  ARG1171          1HH1      ARG1171 -14.399  11.830   1.330
  507   2HH1  ARG1171          2HH1      ARG1171 -13.512  13.313   1.212
  508   1HH2  ARG1171          1HH2      ARG1171 -13.917  13.617  -2.248
  509   2HH2  ARG1171          2HH2      ARG1171 -13.238  14.329  -0.822
  510    H    GLU1172           HN       GLU1172 -17.747   8.917  -3.437
  511    HA   GLU1172           HA       GLU1172 -20.279  10.088  -2.978
  512   1HB   GLU1172           HB2      GLU1172 -18.666   9.914  -5.531
  513   2HB   GLU1172           HB1      GLU1172 -20.050  10.968  -5.276
  514   1HG   GLU1172           HG2      GLU1172 -18.841  12.131  -3.502
  515   2HG   GLU1172           HG1      GLU1172 -17.452  11.076  -3.762
  516    H    ILE1173           HN       ILE1173 -19.477   7.007  -3.978
  517    HA   ILE1173           HA       ILE1173 -21.981   6.698  -5.481
  518    HB   ILE1173           HB       ILE1173 -19.459   5.062  -5.481
  519   1HG1  ILE1173          2HG1      ILE1173 -19.787   7.169  -6.882
  520   2HG1  ILE1173          1HG1      ILE1173 -19.275   5.718  -7.740
  521   1HG2  ILE1173          3HG2      ILE1173 -22.107   4.355  -6.740
  522   2HG2  ILE1173          2HG2      ILE1173 -20.584   3.507  -7.009
  523   3HG2  ILE1173          1HG2      ILE1173 -21.324   3.505  -5.408
  524   1HD1  ILE1173          1HD1      ILE1173 -22.075   6.820  -7.617
  525   2HD1  ILE1173          3HD1      ILE1173 -20.966   6.933  -8.985
  526   3HD1  ILE1173          2HD1      ILE1173 -21.579   5.361  -8.476
  527    H    MET1174           HN       MET1174 -20.094   5.314  -2.800
  528    HA   MET1174           HA       MET1174 -22.116   3.369  -2.222
  529   1HB   MET1174           HB2      MET1174 -20.772   2.976  -0.142
  530   2HB   MET1174           HB1      MET1174 -19.872   2.785  -1.639
  531   1HG   MET1174           HG2      MET1174 -18.372   3.968  -0.413
  532   2HG   MET1174           HG1      MET1174 -19.229   5.287  -1.209
  533   1HE   MET1174           HE3      MET1174 -20.599   3.063   1.735
  534   2HE   MET1174           HE2      MET1174 -18.881   3.199   2.113
  535   3HE   MET1174           HE1      MET1174 -20.076   3.988   3.142
  536    H    GLU1175           HN       GLU1175 -20.982   6.352  -0.664
  537    HA   GLU1175           HA       GLU1175 -22.984   6.351   1.333
  538   1HB   GLU1175           HB2      GLU1175 -21.966   8.239   2.108
  539   2HB   GLU1175           HB1      GLU1175 -20.674   7.670   1.057
  540   1HG   GLU1175           HG2      GLU1175 -21.445   9.172  -0.711
  541   2HG   GLU1175           HG1      GLU1175 -22.739   9.746   0.342
  542    H    ASN1176           HN       ASN1176 -23.366   6.605  -1.889
  543    HA   ASN1176           HA       ASN1176 -25.702   8.376  -1.647
  544   1HB   ASN1176           HB2      ASN1176 -23.550   8.265  -3.622
  545   2HB   ASN1176           HB1      ASN1176 -25.154   8.243  -4.340
  546   1HD2  ASN1176          1HD2      ASN1176 -23.123  10.316  -4.430
  547   2HD2  ASN1176          2HD2      ASN1176 -23.848  11.735  -3.765
  548    H    TYR1177           HN       TYR1177 -24.414   5.400  -3.049
  549    HA   TYR1177           HA       TYR1177 -26.853   4.606  -4.308
  550   1HB   TYR1177           HB2      TYR1177 -24.275   3.216  -3.655
  551   2HB   TYR1177           HB1      TYR1177 -25.660   2.284  -4.204
  552    HD1  TYR1177           HD1      TYR1177 -25.483   5.586  -5.617
  553    HD2  TYR1177           HD2      TYR1177 -24.075   1.594  -6.039
  554    HE1  TYR1177           HE1      TYR1177 -24.864   6.056  -7.950
  555    HE2  TYR1177           HE2      TYR1177 -23.449   2.050  -8.366
  556    HH   TYR1177           HH       TYR1177 -24.063   3.615 -10.167
  557    H    ASN1178           HN       ASN1178 -26.864   5.271  -1.348
  558    HA   ASN1178           HA       ASN1178 -27.986   4.589   0.494
  559   1HB   ASN1178           HB2      ASN1178 -29.036   2.338  -1.229
  560   2HB   ASN1178           HB1      ASN1178 -29.745   2.948   0.262
  561   1HD2  ASN1178          1HD2      ASN1178 -30.886   2.712  -2.403
  562   2HD2  ASN1178          2HD2      ASN1178 -31.403   4.299  -2.842
  563    H    ILE1179           HN       ILE1179 -25.300   3.696   0.121
  564    HA   ILE1179           HA       ILE1179 -25.421   1.321   1.831
  565    HB   ILE1179           HB       ILE1179 -23.377   0.422   0.625
  566   1HG1  ILE1179          2HG1      ILE1179 -24.419   2.118  -1.648
  567   2HG1  ILE1179          1HG1      ILE1179 -23.025   2.569  -0.673
  568   1HG2  ILE1179          1HG2      ILE1179 -26.032   0.450  -0.805
  569   2HG2  ILE1179          3HG2      ILE1179 -24.742  -0.723  -1.067
  570   3HG2  ILE1179          2HG2      ILE1179 -25.553  -0.641   0.496
  571   1HD1  ILE1179          2HD1      ILE1179 -23.260   0.067  -2.322
  572   2HD1  ILE1179          1HD1      ILE1179 -22.371   1.523  -2.776
  573   3HD1  ILE1179          3HD1      ILE1179 -21.856   0.571  -1.383
  574    H    ALA1180           HN       ALA1180 -24.332   1.655   3.611
  575    HA   ALA1180           HA       ALA1180 -22.043   3.510   3.574
  576   1HB   ALA1180           HB3      ALA1180 -22.641   4.220   5.821
  577   2HB   ALA1180           HB2      ALA1180 -23.989   4.490   4.717
  578   3HB   ALA1180           HB1      ALA1180 -24.017   3.117   5.824
  579    H    LEU1181           HN       LEU1181 -20.557   3.124   5.498
  580    HA   LEU1181           HA       LEU1181 -19.536   0.535   5.387
  581   1HB   LEU1181           HB2      LEU1181 -18.837   2.981   6.591
  582   2HB   LEU1181           HB1      LEU1181 -18.835   1.787   7.876
  583    HG   LEU1181           HG       LEU1181 -16.617   2.117   6.782
  584   1HD1  LEU1181          2HD1      LEU1181 -17.130   0.051   7.966
  585   2HD1  LEU1181          1HD1      LEU1181 -17.825  -0.631   6.497
  586   3HD1  LEU1181          3HD1      LEU1181 -16.102  -0.262   6.568
  587   1HD2  LEU1181          1HD2      LEU1181 -17.408   2.504   4.505
  588   2HD2  LEU1181          3HD2      LEU1181 -16.250   1.175   4.562
  589   3HD2  LEU1181          2HD2      LEU1181 -17.974   0.836   4.414
  590    H    ARG1182           HN       ARG1182 -19.197  -0.910   7.315
  591    HA   ARG1182           HA       ARG1182 -21.636  -1.939   8.214
  592   1HB   ARG1182           HB2      ARG1182 -19.573  -3.265   8.047
  593   2HB   ARG1182           HB1      ARG1182 -18.863  -2.336   9.358
  594   1HG   ARG1182           HG2      ARG1182 -20.675  -3.170  10.845
  595   2HG   ARG1182           HG1      ARG1182 -21.205  -4.215   9.524
  596   1HD   ARG1182           HD2      ARG1182 -18.477  -4.243  10.808
  597   2HD   ARG1182           HD1      ARG1182 -19.764  -5.409  11.108
  598    HE   ARG1182           HE       ARG1182 -19.396  -5.508   8.416
  599   1HH1  ARG1182          1HH1      ARG1182 -17.300  -5.856  11.176
  600   2HH1  ARG1182          2HH1      ARG1182 -16.217  -6.948  10.378
  601   1HH2  ARG1182          1HH2      ARG1182 -17.976  -6.944   7.357
  602   2HH2  ARG1182          2HH2      ARG1182 -16.601  -7.565   8.207
  603    H    TRP1183           HN       TRP1183 -19.890   0.729   9.284
  604    HA   TRP1183           HA       TRP1183 -21.155   0.680  11.937
  605   1HB   TRP1183           HB2      TRP1183 -18.918   2.493  11.018
  606   2HB   TRP1183           HB1      TRP1183 -19.445   2.186  12.671
  607    HD1  TRP1183           HD1      TRP1183 -18.052   0.030   9.743
  608    HE1  TRP1183           HE1      TRP1183 -16.425  -1.697  10.734
  609    HE3  TRP1183           HE3      TRP1183 -18.468   1.263  14.690
  610    HZ2  TRP1183           HZ2      TRP1183 -15.436  -2.426  13.260
  611    HZ3  TRP1183           HZ3      TRP1183 -17.139  -0.001  16.332
  612    HH2  TRP1183           HH2      TRP1183 -15.654  -1.809  15.630
  613    H    THR1184           HN       THR1184 -21.409   1.986   8.877
  614    HA   THR1184           HA       THR1184 -22.544   3.711   7.936
  615    HB   THR1184           HB       THR1184 -24.732   4.178   8.819
  616    HG1  THR1184           HG1      THR1184 -24.945   2.868  11.046
  617   1HG2  THR1184          1HG2      THR1184 -23.965   1.311   9.375
  618   2HG2  THR1184          3HG2      THR1184 -25.608   1.905   9.132
  619   3HG2  THR1184          2HG2      THR1184 -24.440   1.977   7.813
  620    H    ALA1185           HN       ALA1185 -20.793   5.187   8.174
  621    HA   ALA1185           HA       ALA1185 -21.453   7.408   9.963
  622   1HB   ALA1185           HB2      ALA1185 -19.136   7.674  10.658
  623   2HB   ALA1185           HB3      ALA1185 -18.681   6.245   9.730
  624   3HB   ALA1185           HB1      ALA1185 -19.750   6.088  11.125
  625    H    LYS1186           HN       LYS1186 -21.471   6.725   6.979
  626    HA   LYS1186           HA       LYS1186 -21.327   7.944   5.075
  627   1HB   LYS1186           HB2      LYS1186 -20.360  10.029   7.011
  628   2HB   LYS1186           HB1      LYS1186 -20.347  10.321   5.277
  629   1HG   LYS1186           HG2      LYS1186 -22.337  11.268   6.171
  630   2HG   LYS1186           HG1      LYS1186 -22.790   9.835   5.248
  631   1HD   LYS1186           HD2      LYS1186 -22.913   8.545   7.335
  632   2HD   LYS1186           HD1      LYS1186 -22.500   9.999   8.246
  633   1HE   LYS1186           HE2      LYS1186 -24.522  11.094   7.415
  634   2HE   LYS1186           HE1      LYS1186 -24.935   9.642   6.502
  635   1HZ   LYS1186           HZ1      LYS1186 -25.096   8.424   8.584
  636   2HZ   LYS1186           HZ3      LYS1186 -24.703   9.819   9.459
  637   3HZ   LYS1186           HZ2      LYS1186 -26.148   9.749   8.585
  638    H    GLN1187           HN       GLN1187 -19.983   7.070   3.722
  639    HA   GLN1187           HA       GLN1187 -18.077   6.670   2.531
  640   1HB   GLN1187           HB2      GLN1187 -17.488   9.027   2.912
  641   2HB   GLN1187           HB1      GLN1187 -16.779   8.605   4.463
  642   1HG   GLN1187           HG2      GLN1187 -15.127   7.203   3.290
  643   2HG   GLN1187           HG1      GLN1187 -15.811   7.730   1.753
  644   1HE2  GLN1187          1HE2      GLN1187 -13.119   8.077   2.844
  645   2HE2  GLN1187          2HE2      GLN1187 -12.826   9.779   2.848
  646    H    LYS1188           HN       LYS1188 -16.178   7.215   5.409
  647    HA   LYS1188           HA       LYS1188 -14.769   5.809   6.534
  648   1HB   LYS1188           HB2      LYS1188 -17.091   5.615   7.566
  649   2HB   LYS1188           HB1      LYS1188 -17.214   4.068   6.741
  650   1HG   LYS1188           HG2      LYS1188 -15.306   3.224   7.958
  651   2HG   LYS1188           HG1      LYS1188 -15.065   4.798   8.719
  652   1HD   LYS1188           HD2      LYS1188 -17.298   4.600   9.757
  653   2HD   LYS1188           HD1      LYS1188 -17.453   2.988   9.055
  654   1HE   LYS1188           HE2      LYS1188 -16.738   2.787  11.343
  655   2HE   LYS1188           HE1      LYS1188 -15.421   2.304  10.277
  656   1HZ   LYS1188           HZ3      LYS1188 -15.680   4.944  11.608
  657   2HZ   LYS1188           HZ2      LYS1188 -14.631   3.703  12.076
  658   3HZ   LYS1188           HZ1      LYS1188 -14.414   4.475  10.587
  659    H    LEU1189           HN       LEU1189 -14.972   5.242   3.602
  660    HA   LEU1189           HA       LEU1189 -14.754   2.368   3.368
  661   1HB   LEU1189           HB2      LEU1189 -13.837   3.273   1.005
  662   2HB   LEU1189           HB1      LEU1189 -15.532   3.023   1.377
  663    HG   LEU1189           HG       LEU1189 -14.655   5.668   2.177
  664   1HD1  LEU1189          2HD1      LEU1189 -13.073   5.406   0.335
  665   2HD1  LEU1189          1HD1      LEU1189 -14.395   4.952  -0.740
  666   3HD1  LEU1189          3HD1      LEU1189 -14.331   6.578  -0.060
  667   1HD2  LEU1189          3HD2      LEU1189 -16.978   4.857   1.908
  668   2HD2  LEU1189          2HD2      LEU1189 -16.632   6.320   0.983
  669   3HD2  LEU1189          1HD2      LEU1189 -16.705   4.756   0.169
  670    H    TYR1190           HN       TYR1190 -12.592   5.123   3.435
  671    HA   TYR1190           HA       TYR1190 -10.246   4.018   2.521
  672   1HB   TYR1190           HB2      TYR1190 -10.739   6.081   4.661
  673   2HB   TYR1190           HB1      TYR1190  -9.123   5.667   4.096
  674    HD1  TYR1190           HD1      TYR1190 -12.140   5.844   1.938
  675    HD2  TYR1190           HD2      TYR1190  -8.531   7.759   3.162
  676    HE1  TYR1190           HE1      TYR1190 -12.364   7.456   0.092
  677    HE2  TYR1190           HE2      TYR1190  -8.753   9.370   1.318
  678    HH   TYR1190           HH       TYR1190  -9.851   9.515  -0.879
  679    H    SER1191           HN       SER1191  -9.577   2.050   3.072
  680    HA   SER1191           HA       SER1191  -9.133   1.503   5.936
  681   1HB   SER1191           HB2      SER1191  -9.986  -0.380   3.733
  682   2HB   SER1191           HB1      SER1191  -9.317  -0.953   5.260
  683    HG   SER1191           HG       SER1191 -11.192  -0.625   6.133
  684    H    ARG1192           HN       ARG1192  -7.569  -0.601   5.942
  685    HA   ARG1192           HA       ARG1192  -5.126   0.334   4.629
  686   1HB   ARG1192           HB2      ARG1192  -5.289  -0.155   7.144
  687   2HB   ARG1192           HB1      ARG1192  -5.351  -1.851   6.697
  688   1HG   ARG1192           HG2      ARG1192  -3.106  -1.325   7.273
  689   2HG   ARG1192           HG1      ARG1192  -3.175  -1.556   5.526
  690   1HD   ARG1192           HD2      ARG1192  -3.245   0.860   5.199
  691   2HD   ARG1192           HD1      ARG1192  -3.206   1.104   6.945
  692    HE   ARG1192           HE       ARG1192  -0.994  -0.362   5.735
  693   1HH1  ARG1192          1HH1      ARG1192  -2.205   2.595   7.123
  694   2HH1  ARG1192          2HH1      ARG1192  -0.630   3.258   7.407
  695   1HH2  ARG1192          1HH2      ARG1192   1.083   0.503   6.105
  696   2HH2  ARG1192          2HH2      ARG1192   1.239   2.069   6.828
  697    H    THR1193           HN       THR1193  -4.657  -0.593   2.729
  698    HA   THR1193           HA       THR1193  -5.884  -2.586   1.425
  699    HB   THR1193           HB       THR1193  -2.923  -1.999   1.423
  700    HG1  THR1193           HG1      THR1193  -5.122  -1.244  -0.200
  701   1HG2  THR1193          1HG2      THR1193  -3.393  -4.328   0.647
  702   2HG2  THR1193          3HG2      THR1193  -4.414  -3.643  -0.618
  703   3HG2  THR1193          2HG2      THR1193  -2.686  -3.284  -0.587
  704    H    GLY1194           HN       GLY1194  -6.554  -4.436   2.286
  705   1HA   GLY1194           HA1      GLY1194  -4.628  -6.049   3.824
  706   2HA   GLY1194           HA2      GLY1194  -5.556  -6.771   2.515
  707    H    GLU1195           HN       GLU1195  -7.096  -4.334   4.373
  708    HA   GLU1195           HA       GLU1195  -8.316  -6.243   6.205
  709   1HB   GLU1195           HB2      GLU1195  -8.686  -3.254   5.946
  710   2HB   GLU1195           HB1      GLU1195  -9.378  -4.259   7.213
  711   1HG   GLU1195           HG2      GLU1195  -6.441  -3.823   6.717
  712   2HG   GLU1195           HG1      GLU1195  -7.402  -3.067   7.986
  713    H    SER1196           HN       SER1196 -10.547  -6.621   6.334
  714    HA   SER1196           HA       SER1196 -11.916  -6.387   3.774
  715   1HB   SER1196           HB2      SER1196 -12.686  -7.884   6.290
  716   2HB   SER1196           HB1      SER1196 -13.545  -7.963   4.753
  717    HG   SER1196           HG       SER1196 -12.111  -9.321   4.052
  718    H    VAL1197           HN       VAL1197 -13.550  -5.026   3.375
  719    HA   VAL1197           HA       VAL1197 -14.616  -3.478   5.644
  720    HB   VAL1197           HB       VAL1197 -14.347  -2.670   2.745
  721   1HG1  VAL1197          3HG1      VAL1197 -15.483  -1.130   5.080
  722   2HG1  VAL1197          2HG1      VAL1197 -15.194  -0.482   3.464
  723   3HG1  VAL1197          1HG1      VAL1197 -16.392  -1.755   3.704
  724   1HG2  VAL1197          3HG2      VAL1197 -12.243  -2.633   3.968
  725   2HG2  VAL1197          2HG2      VAL1197 -12.789  -0.992   3.620
  726   3HG2  VAL1197          1HG2      VAL1197 -12.983  -1.662   5.240
  727    H    GLU1198           HN       GLU1198 -16.796  -3.110   5.812
  728    HA   GLU1198           HA       GLU1198 -18.518  -4.682   4.012
  729   1HB   GLU1198           HB2      GLU1198 -18.675  -5.851   6.012
  730   2HB   GLU1198           HB1      GLU1198 -18.499  -4.403   6.991
  731   1HG   GLU1198           HG2      GLU1198 -20.698  -3.892   6.898
  732   2HG   GLU1198           HG1      GLU1198 -20.928  -4.634   5.313
  733    H    PHE1199           HN       PHE1199 -19.894  -3.475   2.868
  734    HA   PHE1199           HA       PHE1199 -20.554  -0.787   3.863
  735   1HB   PHE1199           HB2      PHE1199 -20.796  -1.875   1.052
  736   2HB   PHE1199           HB1      PHE1199 -21.129  -0.221   1.552
  737    HD1  PHE1199           HD1      PHE1199 -19.389   1.364   1.799
  738    HD2  PHE1199           HD2      PHE1199 -18.488  -2.733   1.099
  739    HE1  PHE1199           HE1      PHE1199 -17.038   1.970   1.333
  740    HE2  PHE1199           HE2      PHE1199 -16.153  -2.150   0.640
  741    HZ   PHE1199           HZ       PHE1199 -15.418   0.201   0.758
  742    H    VAL1200           HN       VAL1200 -22.219  -1.586   5.277
  743    HA   VAL1200           HA       VAL1200 -24.394  -3.156   4.524
  744    HB   VAL1200           HB       VAL1200 -25.603  -2.184   6.392
  745   1HG1  VAL1200          3HG1      VAL1200 -22.668  -2.552   6.970
  746   2HG1  VAL1200          2HG1      VAL1200 -23.939  -2.535   8.192
  747   3HG1  VAL1200          1HG1      VAL1200 -23.912  -3.802   6.965
  748   1HG2  VAL1200          2HG2      VAL1200 -23.422  -0.105   6.451
  749   2HG2  VAL1200          1HG2      VAL1200 -25.107   0.159   6.004
  750   3HG2  VAL1200          3HG2      VAL1200 -24.693  -0.290   7.659
  751    H    CYS1201           HN       CYS1201 -26.745  -1.974   4.735
  752    HA   CYS1201           HA       CYS1201 -26.774  -0.080   2.489
  753   1HB   CYS1201           HB2      CYS1201 -29.250  -1.435   3.485
  754   2HB   CYS1201           HB1      CYS1201 -28.853  -0.885   1.860
  755    H    LYS1202           HN       LYS1202 -27.719   1.894   2.687
  756    HA   LYS1202           HA       LYS1202 -27.764   3.255   5.032
  757   1HB   LYS1202           HB2      LYS1202 -27.971   4.337   2.851
  758   2HB   LYS1202           HB1      LYS1202 -29.598   3.697   2.673
  759   1HG   LYS1202           HG2      LYS1202 -30.333   5.017   4.590
  760   2HG   LYS1202           HG1      LYS1202 -28.698   5.660   4.769
  761   1HD   LYS1202           HD2      LYS1202 -28.833   6.660   2.558
  762   2HD   LYS1202           HD1      LYS1202 -30.448   5.982   2.333
  763   1HE   LYS1202           HE2      LYS1202 -29.639   7.981   4.444
  764   2HE   LYS1202           HE1      LYS1202 -30.540   8.345   2.973
  765   1HZ   LYS1202           HZ3      LYS1202 -31.456   6.557   5.161
  766   2HZ   LYS1202           HZ2      LYS1202 -32.009   8.130   4.876
  767   3HZ   LYS1202           HZ1      LYS1202 -32.320   6.908   3.749
  768    H    ARG1203           HN       ARG1203 -28.634   2.337   6.776
  769    HA   ARG1203           HA       ARG1203 -30.273   0.879   7.792
  770   1HB   ARG1203           HB2      ARG1203 -30.935   3.799   8.028
  771   2HB   ARG1203           HB1      ARG1203 -31.404   2.553   9.175
  772   1HG   ARG1203           HG2      ARG1203 -28.564   3.264   8.485
  773   2HG   ARG1203           HG1      ARG1203 -29.442   3.883   9.884
  774   1HD   ARG1203           HD2      ARG1203 -28.844   0.983   9.315
  775   2HD   ARG1203           HD1      ARG1203 -28.008   1.997  10.491
  776    HE   ARG1203           HE       ARG1203 -30.782   1.990  11.016
  777   1HH1  ARG1203          1HH1      ARG1203 -27.959  -0.039  11.248
  778   2HH1  ARG1203          2HH1      ARG1203 -28.569  -0.955  12.585
  779   1HH2  ARG1203          1HH2      ARG1203 -31.592   0.789  12.777
  780   2HH2  ARG1203          2HH2      ARG1203 -30.634  -0.485  13.453
  781    H    GLY1204           HN       GLY1204 -31.472  -0.224   6.135
  782   1HA   GLY1204           HA1      GLY1204 -33.940   1.142   5.302
  783   2HA   GLY1204           HA2      GLY1204 -34.051  -0.383   6.161
  784    H    TYR1205           HN       TYR1205 -32.479   1.036   3.288
  785    HA   TYR1205           HA       TYR1205 -33.623  -0.481   1.357
  786   1HB   TYR1205           HB2      TYR1205 -30.715   0.294   1.373
  787   2HB   TYR1205           HB1      TYR1205 -31.678  -0.075  -0.043
  788    HD1  TYR1205           HD1      TYR1205 -30.906   2.420   2.507
  789    HD2  TYR1205           HD2      TYR1205 -33.320   1.530  -0.877
  790    HE1  TYR1205           HE1      TYR1205 -31.483   4.801   2.300
  791    HE2  TYR1205           HE2      TYR1205 -33.907   3.908  -1.093
  792    HH   TYR1205           HH       TYR1205 -32.262   6.363   0.571
  793    H    ARG1206           HN       ARG1206 -33.371  -2.394   0.382
  794    HA   ARG1206           HA       ARG1206 -31.742  -4.411   1.775
  795   1HB   ARG1206           HB2      ARG1206 -33.788  -5.485   0.030
  796   2HB   ARG1206           HB1      ARG1206 -33.531  -5.764   1.747
  797   1HG   ARG1206           HG2      ARG1206 -34.801  -3.222   0.834
  798   2HG   ARG1206           HG1      ARG1206 -35.753  -4.708   0.908
  799   1HD   ARG1206           HD2      ARG1206 -34.204  -3.490   3.189
  800   2HD   ARG1206           HD1      ARG1206 -35.951  -3.405   2.970
  801    HE   ARG1206           HE       ARG1206 -35.221  -6.095   2.958
  802   1HH1  ARG1206          1HH1      ARG1206 -35.252  -3.393   5.158
  803   2HH1  ARG1206          2HH1      ARG1206 -35.451  -4.378   6.569
  804   1HH2  ARG1206          1HH2      ARG1206 -35.482  -7.400   4.809
  805   2HH2  ARG1206          2HH2      ARG1206 -35.581  -6.656   6.370
  806    H    LEU1207           HN       LEU1207 -30.304  -5.614   0.635
  807    HA   LEU1207           HA       LEU1207 -29.053  -4.876  -1.618
  808   1HB   LEU1207           HB2      LEU1207 -29.660  -7.679  -0.699
  809   2HB   LEU1207           HB1      LEU1207 -28.623  -7.356  -2.073
  810    HG   LEU1207           HG       LEU1207 -28.100  -6.388   0.741
  811   1HD1  LEU1207          1HD1      LEU1207 -27.948  -8.841   0.499
  812   2HD1  LEU1207          3HD1      LEU1207 -26.778  -8.615  -0.804
  813   3HD1  LEU1207          2HD1      LEU1207 -26.388  -8.088   0.833
  814   1HD2  LEU1207          3HD2      LEU1207 -26.412  -6.300  -1.757
  815   2HD2  LEU1207          2HD2      LEU1207 -27.126  -4.919  -0.923
  816   3HD2  LEU1207          1HD2      LEU1207 -25.859  -5.867  -0.138
  817    H    SER1208           HN       SER1208 -29.394  -4.783  -3.768
  818    HA   SER1208           HA       SER1208 -32.037  -5.370  -4.758
  819   1HB   SER1208           HB2      SER1208 -31.230  -4.340  -6.848
  820   2HB   SER1208           HB1      SER1208 -30.896  -3.316  -5.451
  821    HG   SER1208           HG       SER1208 -28.903  -5.112  -6.116
  822    H    SER1209           HN       SER1209 -29.696  -7.397  -4.114
  823    HA   SER1209           HA       SER1209 -29.274  -9.545  -4.742
  824   1HB   SER1209           HB2      SER1209 -31.622  -9.748  -5.410
  825   2HB   SER1209           HB1      SER1209 -31.250  -9.026  -6.976
  826    HG   SER1209           HG       SER1209 -30.872 -10.999  -7.573
  827    H    ARG1210           HN       ARG1210 -29.637  -7.572  -7.699
  828    HA   ARG1210           HA       ARG1210 -27.495  -8.796  -9.070
  829   1HB   ARG1210           HB2      ARG1210 -28.607  -6.018  -9.499
  830   2HB   ARG1210           HB1      ARG1210 -27.699  -6.976 -10.659
  831   1HG   ARG1210           HG2      ARG1210 -29.515  -8.609 -10.736
  832   2HG   ARG1210           HG1      ARG1210 -30.426  -7.644  -9.571
  833   1HD   ARG1210           HD2      ARG1210 -30.452  -5.772 -11.149
  834   2HD   ARG1210           HD1      ARG1210 -29.552  -6.742 -12.313
  835    HE   ARG1210           HE       ARG1210 -31.837  -8.172 -11.642
  836   1HH1  ARG1210          1HH1      ARG1210 -31.014  -5.160 -13.190
  837   2HH1  ARG1210          2HH1      ARG1210 -32.416  -5.152 -14.207
  838   1HH2  ARG1210          1HH2      ARG1210 -33.686  -8.169 -12.977
  839   2HH2  ARG1210          2HH2      ARG1210 -33.935  -6.861 -14.086
  840    H    SER1211           HN       SER1211 -27.451  -6.886  -6.382
  841    HA   SER1211           HA       SER1211 -25.362  -5.084  -6.776
  842   1HB   SER1211           HB2      SER1211 -26.758  -4.999  -4.791
  843   2HB   SER1211           HB1      SER1211 -26.180  -6.583  -4.275
  844    HG   SER1211           HG       SER1211 -24.679  -5.515  -3.282
  845    H    HIS1212           HN       HIS1212 -23.232  -5.353  -5.410
  846    HA   HIS1212           HA       HIS1212 -21.866  -7.654  -6.559
  847   1HB   HIS1212           HB2      HIS1212 -20.785  -5.216  -5.128
  848   2HB   HIS1212           HB1      HIS1212 -19.797  -6.478  -5.856
  849    HD1  HIS1212           HD1      HIS1212 -21.658  -3.402  -6.646
  850    HD2  HIS1212           HD2      HIS1212 -19.913  -6.549  -8.724
  851    HE1  HIS1212           HE1      HIS1212 -21.493  -2.623  -9.032
  852    HE2  HIS1212           HE2      HIS1212 -20.358  -4.511 -10.254
  853    H    THR1213           HN       THR1213 -21.170  -6.043  -3.481
  854    HA   THR1213           HA       THR1213 -22.006  -8.222  -1.866
  855    HB   THR1213           HB       THR1213 -20.202  -9.515  -2.409
  856    HG1  THR1213           HG1      THR1213 -18.635  -9.235  -0.701
  857   1HG2  THR1213          2HG2      THR1213 -18.498  -7.027  -2.592
  858   2HG2  THR1213          1HG2      THR1213 -17.945  -8.674  -2.897
  859   3HG2  THR1213          3HG2      THR1213 -19.151  -7.938  -3.954
  860    H    LEU1214           HN       LEU1214 -21.498  -7.953   0.385
  861    HA   LEU1214           HA       LEU1214 -21.366  -5.128   1.099
  862   1HB   LEU1214           HB2      LEU1214 -22.048  -7.606   2.683
  863   2HB   LEU1214           HB1      LEU1214 -21.954  -6.005   3.392
  864    HG   LEU1214           HG       LEU1214 -24.257  -6.511   2.980
  865   1HD1  LEU1214          3HD1      LEU1214 -23.094  -4.560   1.009
  866   2HD1  LEU1214          2HD1      LEU1214 -24.827  -4.722   1.308
  867   3HD1  LEU1214          1HD1      LEU1214 -23.747  -4.226   2.611
  868   1HD2  LEU1214          2HD2      LEU1214 -23.459  -7.045   0.123
  869   2HD2  LEU1214          1HD2      LEU1214 -23.963  -8.253   1.305
  870   3HD2  LEU1214          3HD2      LEU1214 -25.107  -7.033   0.749
  871    H    ARG1215           HN       ARG1215 -19.997  -8.123   2.421
  872    HA   ARG1215           HA       ARG1215 -17.709  -6.601   3.429
  873   1HB   ARG1215           HB2      ARG1215 -19.069  -8.323   4.804
  874   2HB   ARG1215           HB1      ARG1215 -18.176  -9.534   3.895
  875   1HG   ARG1215           HG2      ARG1215 -16.066  -8.461   4.688
  876   2HG   ARG1215           HG1      ARG1215 -17.053  -7.434   5.732
  877   1HD   ARG1215           HD2      ARG1215 -16.944 -10.448   5.795
  878   2HD   ARG1215           HD1      ARG1215 -16.182  -9.359   6.953
  879    HE   ARG1215           HE       ARG1215 -18.951  -8.828   6.805
  880   1HH1  ARG1215          1HH1      ARG1215 -16.694 -11.192   8.013
  881   2HH1  ARG1215          2HH1      ARG1215 -17.732 -11.714   9.298
  882   1HH2  ARG1215          1HH2      ARG1215 -20.323  -9.509   8.494
  883   2HH2  ARG1215          2HH2      ARG1215 -19.794 -10.758   9.571
  884    H    THR1216           HN       THR1216 -16.118  -6.348   2.011
  885    HA   THR1216           HA       THR1216 -15.217  -8.704   0.491
  886    HB   THR1216           HB       THR1216 -16.291  -7.311  -1.123
  887    HG1  THR1216           HG1      THR1216 -14.584  -7.818  -2.265
  888   1HG2  THR1216          1HG2      THR1216 -14.657  -5.040   0.009
  889   2HG2  THR1216          3HG2      THR1216 -15.641  -4.944  -1.452
  890   3HG2  THR1216          2HG2      THR1216 -16.408  -5.231   0.110
  891    H    THR1217           HN       THR1217 -12.970  -8.142  -0.517
  892    HA   THR1217           HA       THR1217 -11.285  -7.188   1.695
  893    HB   THR1217           HB       THR1217 -10.738  -9.088  -0.578
  894    HG1  THR1217           HG1      THR1217 -11.609  -9.904   1.409
  895   1HG2  THR1217          2HG2      THR1217  -8.852  -7.445  -0.331
  896   2HG2  THR1217          1HG2      THR1217  -8.658  -8.011   1.328
  897   3HG2  THR1217          3HG2      THR1217  -8.405  -9.123  -0.016
  898    H    CYS1218           HN       CYS1218 -10.305  -5.284   1.496
  899    HA   CYS1218           HA       CYS1218 -10.363  -3.880  -1.009
  900   1HB   CYS1218           HB2      CYS1218  -8.968  -3.074   1.551
  901   2HB   CYS1218           HB1      CYS1218  -9.386  -2.026   0.198
  902    H    TRP1219           HN       TRP1219  -8.634  -3.364  -2.326
  903    HA   TRP1219           HA       TRP1219  -5.943  -3.975  -1.733
  904   1HB   TRP1219           HB2      TRP1219  -7.317  -6.266  -2.122
  905   2HB   TRP1219           HB1      TRP1219  -6.890  -5.896  -3.789
  906    HD1  TRP1219           HD1      TRP1219  -4.216  -5.773  -4.352
  907    HE1  TRP1219           HE1      TRP1219  -2.254  -7.030  -3.266
  908    HE3  TRP1219           HE3      TRP1219  -6.460  -7.203   0.016
  909    HZ2  TRP1219           HZ2      TRP1219  -1.715  -8.431  -0.896
  910    HZ3  TRP1219           HZ3      TRP1219  -5.146  -8.505   1.641
  911    HH2  TRP1219           HH2      TRP1219  -2.821  -9.106   1.193
  912    H    ASP1220           HN       ASP1220  -4.587  -3.124  -3.247
  913    HA   ASP1220           HA       ASP1220  -3.865  -1.991  -5.077
  914   1HB   ASP1220           HB2      ASP1220  -4.732  -3.910  -6.348
  915   2HB   ASP1220           HB1      ASP1220  -6.316  -3.144  -6.423
  916    H    GLY1221           HN       GLY1221  -6.856  -1.388  -3.633
  917   1HA   GLY1221           HA1      GLY1221  -6.864   1.322  -4.791
  918   2HA   GLY1221           HA2      GLY1221  -7.377   0.934  -3.162
  919    H    LYS1222           HN       LYS1222  -8.622  -1.520  -4.866
  920    HA   LYS1222           HA       LYS1222 -11.219  -0.206  -5.014
  921   1HB   LYS1222           HB2      LYS1222 -10.083  -0.072  -7.283
  922   2HB   LYS1222           HB1      LYS1222 -10.226  -1.823  -7.346
  923   1HG   LYS1222           HG2      LYS1222 -12.031  -0.826  -8.573
  924   2HG   LYS1222           HG1      LYS1222 -12.665  -1.613  -7.127
  925   1HD   LYS1222           HD2      LYS1222 -13.751   0.519  -7.400
  926   2HD   LYS1222           HD1      LYS1222 -12.689   0.592  -5.992
  927   1HE   LYS1222           HE2      LYS1222 -10.983   1.716  -7.340
  928   2HE   LYS1222           HE1      LYS1222 -12.046   1.643  -8.745
  929   1HZ   LYS1222           HZ1      LYS1222 -13.638   3.029  -7.570
  930   2HZ   LYS1222           HZ3      LYS1222 -12.618   3.101  -6.222
  931   3HZ   LYS1222           HZ2      LYS1222 -12.140   3.806  -7.683
  932    H    LEU1223           HN       LEU1223 -12.985  -1.634  -5.047
  933    HA   LEU1223           HA       LEU1223 -12.490  -4.478  -4.745
  934   1HB   LEU1223           HB2      LEU1223 -14.148  -4.160  -2.642
  935   2HB   LEU1223           HB1      LEU1223 -12.403  -4.267  -2.509
  936    HG   LEU1223           HG       LEU1223 -13.488  -1.551  -2.947
  937   1HD1  LEU1223          2HD1      LEU1223 -13.922  -3.052  -0.371
  938   2HD1  LEU1223          1HD1      LEU1223 -14.060  -1.303  -0.560
  939   3HD1  LEU1223          3HD1      LEU1223 -15.161  -2.371  -1.428
  940   1HD2  LEU1223          1HD2      LEU1223 -11.101  -2.040  -2.625
  941   2HD2  LEU1223          3HD2      LEU1223 -11.750  -0.962  -1.390
  942   3HD2  LEU1223          2HD2      LEU1223 -11.467  -2.662  -1.016
  943    H    GLU1224           HN       GLU1224 -15.354  -3.363  -3.329
  944    HA   GLU1224           HA       GLU1224 -16.952  -3.252  -5.721
  945   1HB   GLU1224           HB2      GLU1224 -17.006  -5.647  -3.899
  946   2HB   GLU1224           HB1      GLU1224 -18.411  -5.196  -4.855
  947   1HG   GLU1224           HG2      GLU1224 -17.099  -5.432  -6.899
  948   2HG   GLU1224           HG1      GLU1224 -15.685  -5.871  -5.942
  949    H    TYR1225           HN       TYR1225 -18.848  -2.170  -5.369
  950    HA   TYR1225           HA       TYR1225 -19.540  -1.625  -2.561
  951   1HB   TYR1225           HB2      TYR1225 -20.710   0.435  -3.998
  952   2HB   TYR1225           HB1      TYR1225 -19.248   0.545  -3.025
  953    HD1  TYR1225           HD1      TYR1225 -20.576   1.428  -6.032
  954    HD2  TYR1225           HD2      TYR1225 -17.086  -0.414  -4.452
  955    HE1  TYR1225           HE1      TYR1225 -19.314   2.124  -8.025
  956    HE2  TYR1225           HE2      TYR1225 -15.814   0.267  -6.437
  957    HH   TYR1225           HH       TYR1225 -16.245   0.886  -8.782
  958    HA   PRO1226           HA       PRO1226 -23.327  -3.724  -3.436
  959   1HB   PRO1226           HB2      PRO1226 -24.358  -2.208  -1.120
  960   2HB   PRO1226           HB1      PRO1226 -24.255  -3.953  -1.367
  961   1HG   PRO1226           HG2      PRO1226 -22.620  -2.688   0.333
  962   2HG   PRO1226           HG1      PRO1226 -22.063  -4.061  -0.641
  963   1HD   PRO1226           HD2      PRO1226 -21.598  -1.136  -1.045
  964   2HD   PRO1226           HD1      PRO1226 -20.482  -2.498  -1.273
  965    H    THR1227           HN       THR1227 -25.807  -2.939  -3.052
  966    HA   THR1227           HA       THR1227 -26.421  -0.267  -3.800
  967    HB   THR1227           HB       THR1227 -26.827  -2.327  -5.985
  968    HG1  THR1227           HG1      THR1227 -25.053  -0.108  -6.065
  969   1HG2  THR1227          3HG2      THR1227 -27.260   0.663  -5.935
  970   2HG2  THR1227          2HG2      THR1227 -27.481  -0.386  -7.336
  971   3HG2  THR1227          1HG2      THR1227 -28.524  -0.569  -5.926
  972    H    CYS1228           HN       CYS1228 -27.566  -1.082  -1.805
  973    HA   CYS1228           HA       CYS1228 -29.727  -2.935  -2.172
  974   1HB   CYS1228           HB2      CYS1228 -29.289  -1.073   0.166
  975   2HB   CYS1228           HB1      CYS1228 -30.197  -2.583   0.147
  976    H    ALA1229           HN       ALA1229 -31.973  -2.194  -1.314
  977    HA   ALA1229           HA       ALA1229 -32.725   0.493  -1.955
  978   1HB   ALA1229           HB2      ALA1229 -33.601  -1.730  -3.789
  979   2HB   ALA1229           HB1      ALA1229 -34.199  -0.070  -3.826
  980   3HB   ALA1229           HB3      ALA1229 -32.508  -0.409  -4.202
  981    H    LYS1230           HN       LYS1230 -34.686   1.037  -1.189
  982    HA   LYS1230           HA       LYS1230 -36.797   0.818  -0.334
  983   1HB   LYS1230           HB2      LYS1230 -36.137  -2.095   0.032
  984   2HB   LYS1230           HB1      LYS1230 -37.675  -1.358   0.462
  985   1HG   LYS1230           HG2      LYS1230 -38.043  -0.765  -1.878
  986   2HG   LYS1230           HG1      LYS1230 -36.495  -1.496  -2.303
  987   1HD   LYS1230           HD2      LYS1230 -38.797  -2.972  -1.029
  988   2HD   LYS1230           HD1      LYS1230 -38.441  -2.970  -2.757
  989   1HE   LYS1230           HE2      LYS1230 -36.246  -3.954  -2.304
  990   2HE   LYS1230           HE1      LYS1230 -36.605  -3.959  -0.578
  991   1HZ   LYS1230           HZ3      LYS1230 -38.445  -5.467  -1.002
  992   2HZ   LYS1230           HZ2      LYS1230 -38.100  -5.463  -2.657
  993   3HZ   LYS1230           HZ1      LYS1230 -36.991  -6.126  -1.565
  994    H    ARG1231           HN       ARG1231 -35.469   2.192   1.064
  995    HA   ARG1231           HA       ARG1231 -34.331   1.313   3.447
  996   1HB   ARG1231           HB2      ARG1231 -34.689   3.703   4.178
  997   2HB   ARG1231           HB1      ARG1231 -33.799   3.489   2.688
  998   1HG   ARG1231           HG2      ARG1231 -35.761   4.048   1.391
  999   2HG   ARG1231           HG1      ARG1231 -36.727   4.165   2.864
 1000   1HD   ARG1231           HD2      ARG1231 -34.362   5.899   2.160
 1001   2HD   ARG1231           HD1      ARG1231 -36.057   6.372   2.048
 1002    HE   ARG1231           HE       ARG1231 -35.518   5.514   4.665
 1003   1HH1  ARG1231          1HH1      ARG1231 -34.775   8.138   2.498
 1004   2HH1  ARG1231          2HH1      ARG1231 -34.567   9.298   3.767
 1005   1HH2  ARG1231          1HH2      ARG1231 -35.247   7.033   6.343
 1006   2HH2  ARG1231          2HH2      ARG1231 -34.835   8.670   5.953

  No H/Q in entry =        1006
  Start of MODEL   18
    1    H1   GLU1103           HT2      GLU1103  36.990 -11.797  -0.091
    2    H2   GLU1103           HT1      GLU1103  36.533 -10.923  -1.466
    3    H3   GLU1103           HT3      GLU1103  36.904 -12.569  -1.593
    4    HA   GLU1103           HA       GLU1103  39.189 -12.137  -0.976
    5   1HB   GLU1103           HB2      GLU1103  39.859 -10.955  -3.035
    6   2HB   GLU1103           HB1      GLU1103  38.622 -12.166  -3.341
    7   1HG   GLU1103           HG2      GLU1103  36.921 -10.414  -3.396
    8   2HG   GLU1103           HG1      GLU1103  38.164  -9.201  -3.094
    9    H    ALA1104           HN       ALA1104  37.072  -9.385  -0.792
   10    HA   ALA1104           HA       ALA1104  38.978  -8.025   0.918
   11   1HB   ALA1104           HB1      ALA1104  39.603  -7.229  -1.311
   12   2HB   ALA1104           HB2      ALA1104  38.927  -5.930  -0.327
   13   3HB   ALA1104           HB3      ALA1104  37.946  -6.688  -1.582
   14    H    GLU1105           HN       GLU1105  35.854  -7.844  -0.752
   15    HA   GLU1105           HA       GLU1105  33.791  -7.169  -0.083
   16   1HB   GLU1105           HB2      GLU1105  34.115  -8.899   1.628
   17   2HB   GLU1105           HB1      GLU1105  34.900  -7.725   2.674
   18   1HG   GLU1105           HG2      GLU1105  32.615  -8.100   3.370
   19   2HG   GLU1105           HG1      GLU1105  32.826  -6.444   2.801
   20    H    PHE1106           HN       PHE1106  33.733  -5.059  -0.693
   21    HA   PHE1106           HA       PHE1106  33.731  -3.089   1.384
   22   1HB   PHE1106           HB2      PHE1106  36.147  -3.188   0.886
   23   2HB   PHE1106           HB1      PHE1106  35.807  -2.837  -0.805
   24    HD1  PHE1106           HD1      PHE1106  35.429  -0.628  -1.550
   25    HD2  PHE1106           HD2      PHE1106  35.702  -1.462   2.614
   26    HE1  PHE1106           HE1      PHE1106  35.563   1.783  -1.080
   27    HE2  PHE1106           HE2      PHE1106  35.835   0.948   3.092
   28    HZ   PHE1106           HZ       PHE1106  35.766   2.575   1.244
   29    H    GLY1107           HN       GLY1107  31.862  -2.132   0.909
   30   1HA   GLY1107           HA1      GLY1107  30.552  -2.107  -1.518
   31   2HA   GLY1107           HA2      GLY1107  31.523  -0.645  -1.479
   32    H    LYS1108           HN       LYS1108  31.195   0.792   0.450
   33    HA   LYS1108           HA       LYS1108  29.044   0.537   2.183
   34   1HB   LYS1108           HB2      LYS1108  30.283   3.048   1.053
   35   2HB   LYS1108           HB1      LYS1108  29.107   3.025   2.361
   36   1HG   LYS1108           HG2      LYS1108  30.795   1.413   3.501
   37   2HG   LYS1108           HG1      LYS1108  31.945   2.105   2.355
   38   1HD   LYS1108           HD2      LYS1108  31.375   4.356   3.167
   39   2HD   LYS1108           HD1      LYS1108  30.267   3.637   4.339
   40   1HE   LYS1108           HE2      LYS1108  33.248   3.200   4.207
   41   2HE   LYS1108           HE1      LYS1108  32.393   4.199   5.383
   42   1HZ   LYS1108           HZ1      LYS1108  31.259   2.220   6.183
   43   2HZ   LYS1108           HZ3      LYS1108  32.086   1.262   5.059
   44   3HZ   LYS1108           HZ2      LYS1108  32.937   2.036   6.299
   45    H    CYS1109           HN       CYS1109  27.004   0.318   1.766
   46    HA   CYS1109           HA       CYS1109  25.815   0.634  -0.733
   47   1HB   CYS1109           HB2      CYS1109  24.460   0.703   1.970
   48   2HB   CYS1109           HB1      CYS1109  23.687   0.361   0.427
   49    H    GLY1110           HN       GLY1110  25.197   2.371  -1.824
   50   1HA   GLY1110           HA1      GLY1110  25.297   4.730  -2.146
   51   2HA   GLY1110           HA2      GLY1110  25.110   4.944  -0.411
   52    HA   PRO1111           HA       PRO1111  20.923   6.202  -1.242
   53   1HB   PRO1111           HB2      PRO1111  21.506   7.106  -4.035
   54   2HB   PRO1111           HB1      PRO1111  20.622   7.935  -2.748
   55   1HG   PRO1111           HG2      PRO1111  23.107   8.655  -3.322
   56   2HG   PRO1111           HG1      PRO1111  22.575   8.556  -1.635
   57   1HD   PRO1111           HD2      PRO1111  24.298   6.679  -3.193
   58   2HD   PRO1111           HD1      PRO1111  24.393   7.143  -1.482
   59    HA   PRO1112           HA       PRO1112  19.651   2.583  -3.606
   60   1HB   PRO1112           HB2      PRO1112  17.556   1.928  -2.102
   61   2HB   PRO1112           HB1      PRO1112  19.203   1.739  -1.492
   62   1HG   PRO1112           HG2      PRO1112  17.178   3.831  -0.866
   63   2HG   PRO1112           HG1      PRO1112  18.392   3.090   0.189
   64   1HD   PRO1112           HD2      PRO1112  18.606   5.572  -1.119
   65   2HD   PRO1112           HD1      PRO1112  19.919   4.683  -0.325
   66    HA   PRO1113           HA       PRO1113  16.502   4.559  -6.128
   67   1HB   PRO1113           HB2      PRO1113  16.097   2.522  -7.861
   68   2HB   PRO1113           HB1      PRO1113  17.534   3.549  -7.933
   69   1HG   PRO1113           HG2      PRO1113  17.210   0.819  -6.744
   70   2HG   PRO1113           HG1      PRO1113  18.539   1.461  -7.727
   71   1HD   PRO1113           HD2      PRO1113  18.662   1.255  -5.017
   72   2HD   PRO1113           HD1      PRO1113  19.527   2.506  -5.933
   73    HA   PRO1114           HA       PRO1114  13.230   2.388  -3.818
   74   1HB   PRO1114           HB2      PRO1114  11.901   4.928  -3.559
   75   2HB   PRO1114           HB1      PRO1114  12.713   3.987  -2.310
   76   1HG   PRO1114           HG2      PRO1114  13.621   6.400  -3.221
   77   2HG   PRO1114           HG1      PRO1114  14.667   5.149  -2.526
   78   1HD   PRO1114           HD2      PRO1114  14.146   5.786  -5.412
   79   2HD   PRO1114           HD1      PRO1114  15.687   5.428  -4.600
   80    H    ILE1115           HN       ILE1115  10.784   2.606  -3.940
   81    HA   ILE1115           HA       ILE1115   9.981   2.229  -6.649
   82    HB   ILE1115           HB       ILE1115   7.633   2.172  -5.475
   83   1HG1  ILE1115          2HG1      ILE1115   9.565   1.995  -3.150
   84   2HG1  ILE1115          1HG1      ILE1115   8.300   3.195  -3.380
   85   1HG2  ILE1115          1HG2      ILE1115   8.813   0.244  -6.401
   86   2HG2  ILE1115          3HG2      ILE1115   9.761   0.108  -4.918
   87   3HG2  ILE1115          2HG2      ILE1115   8.018  -0.164  -4.880
   88   1HD1  ILE1115          3HD1      ILE1115   7.827   0.257  -2.950
   89   2HD1  ILE1115          2HD1      ILE1115   7.718   1.503  -1.704
   90   3HD1  ILE1115          1HD1      ILE1115   6.599   1.516  -3.069
   91    H    ASP1116           HN       ASP1116   8.473   3.440  -7.846
   92    HA   ASP1116           HA       ASP1116   8.702   6.268  -7.476
   93   1HB   ASP1116           HB2      ASP1116   8.681   5.103  -9.709
   94   2HB   ASP1116           HB1      ASP1116   6.961   4.816  -9.469
   95    H    ASN1117           HN       ASN1117   7.301   4.869  -5.378
   96    HA   ASN1117           HA       ASN1117   5.119   6.637  -5.042
   97   1HB   ASN1117           HB2      ASN1117   4.547   3.796  -5.823
   98   2HB   ASN1117           HB1      ASN1117   3.439   4.663  -4.764
   99   1HD2  ASN1117          1HD2      ASN1117   3.412   3.661  -7.648
  100   2HD2  ASN1117          2HD2      ASN1117   2.811   5.015  -8.538
  101    H    GLY1118           HN       GLY1118   7.554   4.948  -3.826
  102   1HA   GLY1118           HA1      GLY1118   7.160   3.473  -1.714
  103   2HA   GLY1118           HA2      GLY1118   6.341   4.918  -1.148
  104    H    ASP1119           HN       ASP1119   8.683   3.498  -0.099
  105    HA   ASP1119           HA       ASP1119  11.133   4.639  -0.491
  106   1HB   ASP1119           HB2      ASP1119  11.230   6.458   1.209
  107   2HB   ASP1119           HB1      ASP1119  10.197   6.851  -0.158
  108    H    ILE1120           HN       ILE1120  12.218   5.035   1.958
  109    HA   ILE1120           HA       ILE1120  12.065   2.410   3.074
  110    HB   ILE1120           HB       ILE1120  13.496   4.465   4.618
  111   1HG1  ILE1120          2HG1      ILE1120  14.435   3.698   1.851
  112   2HG1  ILE1120          1HG1      ILE1120  13.750   5.265   2.254
  113   1HG2  ILE1120          2HG2      ILE1120  14.200   1.800   3.420
  114   2HG2  ILE1120          1HG2      ILE1120  15.251   2.733   4.487
  115   3HG2  ILE1120          3HG2      ILE1120  13.714   2.109   5.087
  116   1HD1  ILE1120          2HD1      ILE1120  16.253   4.112   3.451
  117   2HD1  ILE1120          1HD1      ILE1120  16.194   5.300   2.148
  118   3HD1  ILE1120          3HD1      ILE1120  15.587   5.718   3.751
  119    H    THR1121           HN       THR1121  11.503   1.847   5.178
  120    HA   THR1121           HA       THR1121   9.467   3.591   6.364
  121    HB   THR1121           HB       THR1121   8.483   1.671   7.337
  122    HG1  THR1121           HG1      THR1121   9.761  -0.428   6.886
  123   1HG2  THR1121          2HG2      THR1121   8.100   1.845   4.917
  124   2HG2  THR1121          1HG2      THR1121   9.523   0.848   4.618
  125   3HG2  THR1121          3HG2      THR1121   8.122   0.160   5.440
  126    H    SER1122           HN       SER1122  12.583   3.387   6.681
  127    HA   SER1122           HA       SER1122  12.656   3.102   9.604
  128   1HB   SER1122           HB2      SER1122  14.303   1.800   8.286
  129   2HB   SER1122           HB1      SER1122  14.959   3.307   7.651
  130    HG   SER1122           HG       SER1122  14.986   3.674  10.190
  131    H    PHE1123           HN       PHE1123  14.737   5.066   7.547
  132    HA   PHE1123           HA       PHE1123  13.657   7.578   8.286
  133   1HB   PHE1123           HB2      PHE1123  14.653   6.837  10.461
  134   2HB   PHE1123           HB1      PHE1123  16.228   6.814   9.678
  135    HD1  PHE1123           HD1      PHE1123  17.439   8.815   9.266
  136    HD2  PHE1123           HD2      PHE1123  13.470   8.978  10.795
  137    HE1  PHE1123           HE1      PHE1123  17.740  11.201   9.782
  138    HE2  PHE1123           HE2      PHE1123  13.764  11.365  11.314
  139    HZ   PHE1123           HZ       PHE1123  15.902  12.480  10.807
  140    HA   PRO1124           HA       PRO1124  15.688   8.412   4.406
  141   1HB   PRO1124           HB2      PRO1124  15.837  11.094   5.734
  142   2HB   PRO1124           HB1      PRO1124  15.393  10.688   4.072
  143   1HG   PRO1124           HG2      PRO1124  13.521  11.227   5.896
  144   2HG   PRO1124           HG1      PRO1124  13.274   9.965   4.675
  145   1HD   PRO1124           HD2      PRO1124  13.794   9.705   7.578
  146   2HD   PRO1124           HD1      PRO1124  12.974   8.587   6.471
  147    H    LEU1125           HN       LEU1125  17.678   7.585   4.244
  148    HA   LEU1125           HA       LEU1125  19.883   9.054   5.494
  149   1HB   LEU1125           HB2      LEU1125  21.114   6.958   5.888
  150   2HB   LEU1125           HB1      LEU1125  19.621   7.029   6.807
  151    HG   LEU1125           HG       LEU1125  19.994   5.485   4.244
  152   1HD1  LEU1125          1HD1      LEU1125  19.959   4.537   7.104
  153   2HD1  LEU1125          3HD1      LEU1125  19.989   3.501   5.677
  154   3HD1  LEU1125          2HD1      LEU1125  21.357   4.557   6.028
  155   1HD2  LEU1125          3HD2      LEU1125  17.742   5.536   6.239
  156   2HD2  LEU1125          2HD2      LEU1125  17.690   6.147   4.585
  157   3HD2  LEU1125          1HD2      LEU1125  17.877   4.417   4.883
  158    H    SER1126           HN       SER1126  21.906   8.926   4.302
  159    HA   SER1126           HA       SER1126  21.433   8.358   1.445
  160   1HB   SER1126           HB2      SER1126  21.898  10.686   1.728
  161   2HB   SER1126           HB1      SER1126  23.270  10.350   2.786
  162    HG   SER1126           HG       SER1126  24.467   9.790   1.086
  163    H    VAL1127           HN       VAL1127  23.688   8.041   4.114
  164    HA   VAL1127           HA       VAL1127  25.335   6.221   2.518
  165    HB   VAL1127           HB       VAL1127  26.642   7.865   3.668
  166   1HG1  VAL1127          1HG1      VAL1127  24.848   8.320   5.396
  167   2HG1  VAL1127          3HG1      VAL1127  25.495   6.941   6.290
  168   3HG1  VAL1127          2HG1      VAL1127  26.516   8.346   5.979
  169   1HG2  VAL1127          3HG2      VAL1127  27.383   5.436   3.619
  170   2HG2  VAL1127          2HG2      VAL1127  28.177   6.475   4.804
  171   3HG2  VAL1127          1HG2      VAL1127  26.907   5.363   5.315
  172    H    TYR1128           HN       TYR1128  24.740   4.198   2.569
  173    HA   TYR1128           HA       TYR1128  23.478   3.109   4.990
  174   1HB   TYR1128           HB2      TYR1128  23.434   2.025   2.166
  175   2HB   TYR1128           HB1      TYR1128  22.583   1.343   3.545
  176    HD1  TYR1128           HD1      TYR1128  20.327   1.709   3.553
  177    HD2  TYR1128           HD2      TYR1128  22.865   4.706   1.918
  178    HE1  TYR1128           HE1      TYR1128  18.355   3.069   3.002
  179    HE2  TYR1128           HE2      TYR1128  20.902   6.076   1.367
  180    HH   TYR1128           HH       TYR1128  18.519   5.802   0.968
  181    H    ALA1129           HN       ALA1129  24.508   1.611   6.141
  182    HA   ALA1129           HA       ALA1129  27.162   0.915   5.790
  183   1HB   ALA1129           HB2      ALA1129  25.942   0.559   7.884
  184   2HB   ALA1129           HB3      ALA1129  26.774  -0.909   7.371
  185   3HB   ALA1129           HB1      ALA1129  25.033  -0.754   7.133
  186    HA   PRO1130           HA       PRO1130  27.110  -1.882   2.356
  187   1HB   PRO1130           HB2      PRO1130  29.515  -3.183   3.339
  188   2HB   PRO1130           HB1      PRO1130  29.310  -2.134   1.938
  189   1HG   PRO1130           HG2      PRO1130  30.674  -1.415   4.202
  190   2HG   PRO1130           HG1      PRO1130  29.906  -0.263   3.099
  191   1HD   PRO1130           HD2      PRO1130  28.994  -1.234   5.759
  192   2HD   PRO1130           HD1      PRO1130  28.780   0.355   4.999
  193    H    ALA1131           HN       ALA1131  26.646  -4.004   1.819
  194    HA   ALA1131           HA       ALA1131  25.779  -6.088   2.095
  195   1HB   ALA1131           HB3      ALA1131  28.041  -6.586   2.886
  196   2HB   ALA1131           HB1      ALA1131  26.832  -7.547   3.737
  197   3HB   ALA1131           HB2      ALA1131  27.563  -6.151   4.527
  198    H    SER1132           HN       SER1132  24.619  -3.678   3.530
  199    HA   SER1132           HA       SER1132  23.199  -5.025   5.712
  200   1HB   SER1132           HB2      SER1132  23.284  -2.099   4.940
  201   2HB   SER1132           HB1      SER1132  22.410  -2.759   6.323
  202    HG   SER1132           HG       SER1132  24.249  -3.071   7.363
  203    H    SER1133           HN       SER1133  20.828  -3.904   5.859
  204    HA   SER1133           HA       SER1133  19.522  -3.843   3.270
  205   1HB   SER1133           HB2      SER1133  18.675  -5.904   5.319
  206   2HB   SER1133           HB1      SER1133  18.021  -5.679   3.696
  207    HG   SER1133           HG       SER1133  19.483  -7.385   3.683
  208    H    VAL1134           HN       VAL1134  17.275  -3.164   3.417
  209    HA   VAL1134           HA       VAL1134  16.499  -2.068   6.023
  210    HB   VAL1134           HB       VAL1134  15.739   0.037   4.924
  211   1HG1  VAL1134          2HG1      VAL1134  18.692  -0.551   4.836
  212   2HG1  VAL1134          1HG1      VAL1134  17.975   1.059   4.837
  213   3HG1  VAL1134          3HG1      VAL1134  17.766   0.001   6.232
  214   1HG2  VAL1134          2HG2      VAL1134  15.667  -0.774   2.624
  215   2HG2  VAL1134          1HG2      VAL1134  16.685   0.660   2.766
  216   3HG2  VAL1134          3HG2      VAL1134  17.423  -0.935   2.620
  217    H    GLU1135           HN       GLU1135  14.243  -1.186   5.951
  218    HA   GLU1135           HA       GLU1135  12.551  -3.055   4.438
  219   1HB   GLU1135           HB2      GLU1135  12.371  -3.192   6.889
  220   2HB   GLU1135           HB1      GLU1135  11.941  -1.488   6.954
  221   1HG   GLU1135           HG2      GLU1135   9.904  -1.942   5.701
  222   2HG   GLU1135           HG1      GLU1135  10.339  -3.648   5.601
  223    H    TYR1136           HN       TYR1136  10.961  -2.326   3.105
  224    HA   TYR1136           HA       TYR1136  10.689   0.596   2.867
  225   1HB   TYR1136           HB2      TYR1136  11.194  -1.479   0.820
  226   2HB   TYR1136           HB1      TYR1136  10.043  -0.220   0.383
  227    HD1  TYR1136           HD1      TYR1136  10.930   1.511  -0.816
  228    HD2  TYR1136           HD2      TYR1136  13.367  -0.384   2.108
  229    HE1  TYR1136           HE1      TYR1136  12.777   3.022  -1.387
  230    HE2  TYR1136           HE2      TYR1136  15.224   1.126   1.545
  231    HH   TYR1136           HH       TYR1136  14.821   3.912  -0.344
  232    H    GLN1137           HN       GLN1137   8.691   1.148   1.514
  233    HA   GLN1137           HA       GLN1137   6.427  -0.502   1.470
  234   1HB   GLN1137           HB2      GLN1137   6.586  -0.311   3.934
  235   2HB   GLN1137           HB1      GLN1137   6.485   1.438   3.792
  236   1HG   GLN1137           HG2      GLN1137   4.253   1.232   2.824
  237   2HG   GLN1137           HG1      GLN1137   4.353  -0.522   2.970
  238   1HE2  GLN1137          1HE2      GLN1137   5.757  -0.372   5.530
  239   2HE2  GLN1137          2HE2      GLN1137   4.563   0.059   6.702
  240    H    CYS1138           HN       CYS1138   4.594   0.574   0.626
  241    HA   CYS1138           HA       CYS1138   5.266   2.868  -0.945
  242   1HB   CYS1138           HB2      CYS1138   3.598   0.829  -1.374
  243   2HB   CYS1138           HB1      CYS1138   2.441   1.968  -0.697
  244    H    GLN1139           HN       GLN1139   4.188   4.899  -0.921
  245    HA   GLN1139           HA       GLN1139   4.090   6.237   1.446
  246   1HB   GLN1139           HB2      GLN1139   2.496   6.794  -1.056
  247   2HB   GLN1139           HB1      GLN1139   2.660   7.927   0.278
  248   1HG   GLN1139           HG2      GLN1139   5.073   7.989  -0.064
  249   2HG   GLN1139           HG1      GLN1139   4.915   6.844  -1.395
  250   1HE2  GLN1139          1HE2      GLN1139   4.008   7.525  -3.337
  251   2HE2  GLN1139          2HE2      GLN1139   3.838   9.197  -3.734
  252    H    ASN1140           HN       ASN1140   2.284   7.256   2.584
  253    HA   ASN1140           HA       ASN1140   0.700   5.627   3.988
  254   1HB   ASN1140           HB2      ASN1140  -0.813   7.524   4.409
  255   2HB   ASN1140           HB1      ASN1140   0.879   8.013   4.458
  256   1HD2  ASN1140          1HD2      ASN1140  -2.111   8.193   2.705
  257   2HD2  ASN1140          2HD2      ASN1140  -1.656   9.492   1.661
  258    H    LEU1141           HN       LEU1141  -1.261   4.662   3.907
  259    HA   LEU1141           HA       LEU1141  -3.218   3.833   3.095
  260   1HB   LEU1141           HB2      LEU1141  -2.812   5.779   0.825
  261   2HB   LEU1141           HB1      LEU1141  -4.243   4.794   1.057
  262    HG   LEU1141           HG       LEU1141  -3.272   6.919   2.972
  263   1HD1  LEU1141          1HD1      LEU1141  -5.561   6.948   1.011
  264   2HD1  LEU1141          3HD1      LEU1141  -5.204   8.201   2.198
  265   3HD1  LEU1141          2HD1      LEU1141  -4.071   7.883   0.884
  266   1HD2  LEU1141          1HD2      LEU1141  -5.806   5.286   2.945
  267   2HD2  LEU1141          3HD2      LEU1141  -4.477   5.123   4.093
  268   3HD2  LEU1141          2HD2      LEU1141  -5.438   6.602   4.060
  269    H    TYR1142           HN       TYR1142  -0.842   4.390   0.493
  270    HA   TYR1142           HA       TYR1142  -1.563   2.131  -1.028
  271   1HB   TYR1142           HB2      TYR1142   0.993   3.730  -0.886
  272   2HB   TYR1142           HB1      TYR1142   0.751   2.413  -2.029
  273    HD1  TYR1142           HD1      TYR1142  -0.817   5.621  -0.939
  274    HD2  TYR1142           HD2      TYR1142  -0.141   2.872  -4.115
  275    HE1  TYR1142           HE1      TYR1142  -1.883   7.184  -2.511
  276    HE2  TYR1142           HE2      TYR1142  -1.203   4.426  -5.696
  277    HH   TYR1142           HH       TYR1142  -2.810   6.288  -5.648
  278    H    GLN1143           HN       GLN1143  -0.584   0.095  -1.226
  279    HA   GLN1143           HA       GLN1143   1.009  -0.725   1.114
  280   1HB   GLN1143           HB2      GLN1143  -1.304  -2.068  -0.238
  281   2HB   GLN1143           HB1      GLN1143  -0.094  -3.036   0.592
  282   1HG   GLN1143           HG2      GLN1143  -1.292  -0.735   2.037
  283   2HG   GLN1143           HG1      GLN1143  -2.267  -2.186   1.807
  284   1HE2  GLN1143          1HE2      GLN1143   1.195  -2.321   2.111
  285   2HE2  GLN1143          2HE2      GLN1143   1.230  -3.052   3.674
  286    H    LEU1144           HN       LEU1144   2.988  -1.319   0.605
  287    HA   LEU1144           HA       LEU1144   3.853  -1.722  -2.062
  288   1HB   LEU1144           HB2      LEU1144   5.270  -0.841  -0.212
  289   2HB   LEU1144           HB1      LEU1144   5.280  -2.440   0.501
  290    HG   LEU1144           HG       LEU1144   6.317  -1.971  -2.285
  291   1HD1  LEU1144          2HD1      LEU1144   7.864  -1.762   0.294
  292   2HD1  LEU1144          1HD1      LEU1144   8.558  -1.769  -1.328
  293   3HD1  LEU1144          3HD1      LEU1144   7.516  -0.440  -0.820
  294   1HD2  LEU1144          3HD2      LEU1144   6.831  -4.080  -0.192
  295   2HD2  LEU1144          2HD2      LEU1144   5.911  -4.277  -1.684
  296   3HD2  LEU1144          1HD2      LEU1144   7.648  -3.978  -1.752
  297    H    GLU1145           HN       GLU1145   3.519  -3.456  -3.259
  298    HA   GLU1145           HA       GLU1145   2.956  -6.023  -2.002
  299   1HB   GLU1145           HB2      GLU1145   1.570  -5.073  -3.896
  300   2HB   GLU1145           HB1      GLU1145   2.949  -5.359  -4.948
  301   1HG   GLU1145           HG2      GLU1145   1.621  -7.526  -3.344
  302   2HG   GLU1145           HG1      GLU1145   1.156  -7.108  -4.993
  303    H    GLY1146           HN       GLY1146   4.392  -7.624  -1.854
  304   1HA   GLY1146           HA1      GLY1146   6.774  -7.538  -3.592
  305   2HA   GLY1146           HA2      GLY1146   6.108  -8.997  -2.874
  306    H    ASN1147           HN       ASN1147   8.716  -8.690  -2.548
  307    HA   ASN1147           HA       ASN1147   9.001  -8.508   0.283
  308   1HB   ASN1147           HB2      ASN1147  11.429  -8.940  -0.205
  309   2HB   ASN1147           HB1      ASN1147  10.324 -10.135  -0.875
  310   1HD2  ASN1147          1HD2      ASN1147  12.629  -7.675  -1.555
  311   2HD2  ASN1147          2HD2      ASN1147  12.693  -7.905  -3.265
  312    H    LYS1148           HN       LYS1148   8.465  -6.385   0.833
  313    HA   LYS1148           HA       LYS1148   9.568  -4.069  -0.288
  314   1HB   LYS1148           HB2      LYS1148   8.993  -3.068   2.011
  315   2HB   LYS1148           HB1      LYS1148   7.685  -3.725   1.034
  316   1HG   LYS1148           HG2      LYS1148   7.280  -4.468   3.219
  317   2HG   LYS1148           HG1      LYS1148   7.948  -5.861   2.368
  318   1HD   LYS1148           HD2      LYS1148  10.154  -5.382   3.328
  319   2HD   LYS1148           HD1      LYS1148   9.470  -4.007   4.197
  320   1HE   LYS1148           HE2      LYS1148   8.666  -6.893   4.537
  321   2HE   LYS1148           HE1      LYS1148   9.674  -5.964   5.645
  322   1HZ   LYS1148           HZ2      LYS1148   6.843  -5.367   4.975
  323   2HZ   LYS1148           HZ1      LYS1148   7.388  -6.074   6.411
  324   3HZ   LYS1148           HZ3      LYS1148   7.811  -4.479   6.040
  325    H    ARG1149           HN       ARG1149  11.022  -6.450   1.642
  326    HA   ARG1149           HA       ARG1149  13.040  -4.729   2.790
  327   1HB   ARG1149           HB2      ARG1149  12.336  -6.719   4.015
  328   2HB   ARG1149           HB1      ARG1149  12.820  -7.744   2.670
  329   1HG   ARG1149           HG2      ARG1149  14.601  -7.970   4.106
  330   2HG   ARG1149           HG1      ARG1149  15.159  -6.682   3.039
  331   1HD   ARG1149           HD2      ARG1149  15.627  -6.137   5.362
  332   2HD   ARG1149           HD1      ARG1149  14.457  -5.011   4.674
  333    HE   ARG1149           HE       ARG1149  13.087  -7.111   5.945
  334   1HH1  ARG1149          1HH1      ARG1149  15.055  -4.335   6.698
  335   2HH1  ARG1149          2HH1      ARG1149  14.328  -4.079   8.249
  336   1HH2  ARG1149          1HH2      ARG1149  12.124  -6.781   7.987
  337   2HH2  ARG1149          2HH2      ARG1149  12.663  -5.469   8.982
  338    H    ILE1150           HN       ILE1150  14.633  -3.933   1.575
  339    HA   ILE1150           HA       ILE1150  15.580  -5.542  -0.697
  340    HB   ILE1150           HB       ILE1150  16.448  -3.482  -1.669
  341   1HG1  ILE1150          2HG1      ILE1150  15.156  -2.076   0.680
  342   2HG1  ILE1150          1HG1      ILE1150  16.891  -2.299   0.475
  343   1HG2  ILE1150          2HG2      ILE1150  13.554  -3.294  -0.842
  344   2HG2  ILE1150          1HG2      ILE1150  14.295  -2.412  -2.178
  345   3HG2  ILE1150          3HG2      ILE1150  14.193  -4.172  -2.232
  346   1HD1  ILE1150          1HD1      ILE1150  16.822  -0.963  -1.564
  347   2HD1  ILE1150          3HD1      ILE1150  15.085  -0.737  -1.355
  348   3HD1  ILE1150          2HD1      ILE1150  16.210  -0.066  -0.173
  349    H    THR1151           HN       THR1151  17.921  -5.175  -1.248
  350    HA   THR1151           HA       THR1151  19.663  -4.672   1.022
  351    HB   THR1151           HB       THR1151  19.696  -7.350  -0.387
  352    HG1  THR1151           HG1      THR1151  18.478  -6.452   1.942
  353   1HG2  THR1151          2HG2      THR1151  21.918  -6.583   0.295
  354   2HG2  THR1151          1HG2      THR1151  21.327  -6.310   1.934
  355   3HG2  THR1151          3HG2      THR1151  21.390  -7.947   1.280
  356    H    CYS1152           HN       CYS1152  21.505  -3.734   0.365
  357    HA   CYS1152           HA       CYS1152  21.945  -3.365  -2.460
  358   1HB   CYS1152           HB2      CYS1152  22.875  -1.451  -1.798
  359   2HB   CYS1152           HB1      CYS1152  22.518  -1.897  -0.133
  360    H    ARG1153           HN       ARG1153  23.856  -3.781  -3.545
  361    HA   ARG1153           HA       ARG1153  25.686  -5.717  -2.312
  362   1HB   ARG1153           HB2      ARG1153  25.809  -6.873  -4.545
  363   2HB   ARG1153           HB1      ARG1153  24.307  -7.099  -3.662
  364   1HG   ARG1153           HG2      ARG1153  24.567  -4.982  -5.762
  365   2HG   ARG1153           HG1      ARG1153  24.183  -6.652  -6.179
  366   1HD   ARG1153           HD2      ARG1153  22.299  -6.473  -4.475
  367   2HD   ARG1153           HD1      ARG1153  22.599  -4.733  -4.491
  368    HE   ARG1153           HE       ARG1153  22.222  -5.016  -7.020
  369   1HH1  ARG1153          1HH1      ARG1153  20.602  -6.838  -4.530
  370   2HH1  ARG1153          2HH1      ARG1153  19.173  -7.101  -5.474
  371   1HH2  ARG1153          1HH2      ARG1153  20.346  -5.359  -8.269
  372   2HH2  ARG1153          2HH2      ARG1153  19.028  -6.260  -7.599
  373    H    ASN1154           HN       ASN1154  27.495  -4.583  -2.150
  374    HA   ASN1154           HA       ASN1154  29.316  -3.324  -2.689
  375   1HB   ASN1154           HB2      ASN1154  28.507  -3.990  -5.533
  376   2HB   ASN1154           HB1      ASN1154  30.061  -3.320  -5.043
  377   1HD2  ASN1154          1HD2      ASN1154  28.028  -6.131  -5.067
  378   2HD2  ASN1154          2HD2      ASN1154  29.246  -7.267  -4.611
  379    H    GLY1155           HN       GLY1155  26.747  -2.100  -2.302
  380   1HA   GLY1155           HA1      GLY1155  27.334   0.526  -3.292
  381   2HA   GLY1155           HA2      GLY1155  25.961   0.071  -2.287
  382    H    GLN1156           HN       GLN1156  25.277  -2.070  -4.321
  383    HA   GLN1156           HA       GLN1156  24.078  -0.290  -6.344
  384   1HB   GLN1156           HB2      GLN1156  25.765  -1.850  -7.277
  385   2HB   GLN1156           HB1      GLN1156  24.821  -3.204  -6.673
  386   1HG   GLN1156           HG2      GLN1156  22.962  -2.553  -8.117
  387   2HG   GLN1156           HG1      GLN1156  23.909  -1.194  -8.721
  388   1HE2  GLN1156          1HE2      GLN1156  25.647  -1.580 -10.094
  389   2HE2  GLN1156          2HE2      GLN1156  25.851  -3.086 -10.915
  390    H    TRP1157           HN       TRP1157  22.495  -0.137  -4.491
  391    HA   TRP1157           HA       TRP1157  20.882  -2.129  -3.544
  392   1HB   TRP1157           HB2      TRP1157  20.244   0.736  -4.195
  393   2HB   TRP1157           HB1      TRP1157  19.113  -0.328  -3.364
  394    HD1  TRP1157           HD1      TRP1157  22.480   1.412  -2.878
  395    HE1  TRP1157           HE1      TRP1157  23.006   1.474  -0.366
  396    HE3  TRP1157           HE3      TRP1157  18.637  -1.493  -1.213
  397    HZ2  TRP1157           HZ2      TRP1157  21.908   0.397   2.036
  398    HZ3  TRP1157           HZ3      TRP1157  18.440  -1.942   1.195
  399    HH2  TRP1157           HH2      TRP1157  20.040  -1.021   2.783
  400    H    SER1158           HN       SER1158  18.754  -2.750  -3.965
  401    HA   SER1158           HA       SER1158  18.011  -2.734  -6.816
  402   1HB   SER1158           HB2      SER1158  16.784  -4.873  -6.248
  403   2HB   SER1158           HB1      SER1158  18.543  -4.978  -6.184
  404    HG   SER1158           HG       SER1158  16.834  -5.561  -4.275
  405    H    GLU1159           HN       GLU1159  16.225  -1.641  -7.275
  406    HA   GLU1159           HA       GLU1159  14.631  -0.288  -5.476
  407   1HB   GLU1159           HB2      GLU1159  14.737   0.241  -7.866
  408   2HB   GLU1159           HB1      GLU1159  13.903  -1.259  -8.246
  409   1HG   GLU1159           HG2      GLU1159  11.925  -0.461  -7.056
  410   2HG   GLU1159           HG1      GLU1159  12.762   1.044  -6.681
  411    HA   PRO1160           HA       PRO1160  12.014  -3.262  -3.498
  412   1HB   PRO1160           HB2      PRO1160   9.909  -1.180  -3.853
  413   2HB   PRO1160           HB1      PRO1160  10.401  -2.045  -2.392
  414   1HG   PRO1160           HG2      PRO1160  11.133   0.481  -2.772
  415   2HG   PRO1160           HG1      PRO1160  12.258  -0.691  -2.059
  416   1HD   PRO1160           HD2      PRO1160  12.187   0.439  -4.820
  417   2HD   PRO1160           HD1      PRO1160  13.584   0.025  -3.808
  418    HA   PRO1161           HA       PRO1161   9.666  -5.503  -6.465
  419   1HB   PRO1161           HB2      PRO1161   7.365  -5.438  -4.575
  420   2HB   PRO1161           HB1      PRO1161   8.131  -6.817  -5.370
  421   1HG   PRO1161           HG2      PRO1161   8.585  -6.318  -2.798
  422   2HG   PRO1161           HG1      PRO1161   9.894  -6.873  -3.858
  423   1HD   PRO1161           HD2      PRO1161   9.338  -4.136  -2.800
  424   2HD   PRO1161           HD1      PRO1161  10.894  -4.947  -3.072
  425    H    LYS1162           HN       LYS1162   6.816  -4.017  -4.995
  426    HA   LYS1162           HA       LYS1162   6.562  -1.959  -6.969
  427   1HB   LYS1162           HB2      LYS1162   6.064  -4.101  -8.240
  428   2HB   LYS1162           HB1      LYS1162   4.625  -4.253  -7.244
  429   1HG   LYS1162           HG2      LYS1162   3.817  -2.100  -8.084
  430   2HG   LYS1162           HG1      LYS1162   5.254  -1.967  -9.100
  431   1HD   LYS1162           HD2      LYS1162   3.229  -4.198  -9.263
  432   2HD   LYS1162           HD1      LYS1162   3.266  -2.790 -10.327
  433   1HE   LYS1162           HE2      LYS1162   5.500  -3.425 -11.092
  434   2HE   LYS1162           HE1      LYS1162   5.470  -4.827 -10.023
  435   1HZ   LYS1162           HZ1      LYS1162   3.572  -5.678 -11.261
  436   2HZ   LYS1162           HZ3      LYS1162   3.618  -4.338 -12.293
  437   3HZ   LYS1162           HZ2      LYS1162   4.900  -5.441 -12.282
  438    H    CYS1163           HN       CYS1163   4.299  -0.985  -6.919
  439    HA   CYS1163           HA       CYS1163   3.317  -1.037  -4.147
  440   1HB   CYS1163           HB2      CYS1163   3.528   1.116  -6.210
  441   2HB   CYS1163           HB1      CYS1163   2.253   1.224  -5.002
  442    H    LEU1164           HN       LEU1164   1.059  -0.897  -3.757
  443    HA   LEU1164           HA       LEU1164  -0.653  -1.656  -6.028
  444   1HB   LEU1164           HB2      LEU1164  -0.066  -3.152  -3.600
  445   2HB   LEU1164           HB1      LEU1164  -1.785  -2.881  -3.809
  446    HG   LEU1164           HG       LEU1164  -0.961  -5.041  -4.749
  447   1HD1  LEU1164          3HD1      LEU1164  -2.129  -3.091  -6.727
  448   2HD1  LEU1164          2HD1      LEU1164  -2.171  -4.849  -6.868
  449   3HD1  LEU1164          1HD1      LEU1164  -3.027  -4.049  -5.549
  450   1HD2  LEU1164          3HD2      LEU1164   1.220  -4.226  -5.540
  451   2HD2  LEU1164          2HD2      LEU1164   0.309  -5.045  -6.807
  452   3HD2  LEU1164          1HD2      LEU1164   0.401  -3.285  -6.784
  453    H    HIS1165           HN       HIS1165  -2.332  -0.353  -6.267
  454    HA   HIS1165           HA       HIS1165  -2.873   1.872  -4.741
  455   1HB   HIS1165           HB2      HIS1165  -4.838   0.279  -6.403
  456   2HB   HIS1165           HB1      HIS1165  -5.071   1.939  -5.866
  457    HD1  HIS1165           HD1      HIS1165  -3.550  -0.071  -8.529
  458    HD2  HIS1165           HD2      HIS1165  -3.259   3.820  -7.102
  459    HE1  HIS1165           HE1      HIS1165  -2.395   1.227 -10.347
  460    HE2  HIS1165           HE2      HIS1165  -2.152   3.559  -9.425
  461    HA   PRO1166           HA       PRO1166  -4.689   0.155  -1.076
  462   1HB   PRO1166           HB2      PRO1166  -5.611   2.440   0.026
  463   2HB   PRO1166           HB1      PRO1166  -3.889   2.046  -0.028
  464   1HG   PRO1166           HG2      PRO1166  -5.478   3.830  -1.839
  465   2HG   PRO1166           HG1      PRO1166  -3.890   4.119  -1.102
  466   1HD   PRO1166           HD2      PRO1166  -4.175   3.294  -3.664
  467   2HD   PRO1166           HD1      PRO1166  -2.796   2.818  -2.659
  468    H    CYS1167           HN       CYS1167  -6.825   0.546   0.196
  469    HA   CYS1167           HA       CYS1167  -8.958  -0.264  -1.457
  470   1HB   CYS1167           HB2      CYS1167  -8.514  -0.612   1.099
  471   2HB   CYS1167           HB1      CYS1167  -9.393   0.902   1.270
  472    H    VAL1168           HN       VAL1168  -8.830   1.584  -3.015
  473    HA   VAL1168           HA       VAL1168 -10.059   4.044  -2.024
  474    HB   VAL1168           HB       VAL1168  -8.945   3.434  -4.765
  475   1HG1  VAL1168          1HG1      VAL1168  -9.857   6.035  -3.540
  476   2HG1  VAL1168          3HG1      VAL1168  -9.077   5.861  -5.112
  477   3HG1  VAL1168          2HG1      VAL1168 -10.667   5.151  -4.833
  478   1HG2  VAL1168          3HG2      VAL1168  -7.208   3.431  -3.058
  479   2HG2  VAL1168          2HG2      VAL1168  -7.066   4.857  -4.087
  480   3HG2  VAL1168          1HG2      VAL1168  -7.763   4.999  -2.473
  481    H    ILE1169           HN       ILE1169 -12.183   3.285  -1.677
  482    HA   ILE1169           HA       ILE1169 -13.642   2.525  -4.117
  483    HB   ILE1169           HB       ILE1169 -14.025   1.855  -1.250
  484   1HG1  ILE1169          2HG1      ILE1169 -14.220   0.465  -3.910
  485   2HG1  ILE1169          1HG1      ILE1169 -13.140   0.121  -2.563
  486   1HG2  ILE1169          1HG2      ILE1169 -16.339   2.070  -3.172
  487   2HG2  ILE1169          3HG2      ILE1169 -16.393   1.300  -1.587
  488   3HG2  ILE1169          2HG2      ILE1169 -16.097   3.032  -1.714
  489   1HD1  ILE1169          2HD1      ILE1169 -16.108  -0.369  -2.594
  490   2HD1  ILE1169          1HD1      ILE1169 -14.852  -1.588  -2.815
  491   3HD1  ILE1169          3HD1      ILE1169 -15.000  -0.745  -1.273
  492    H    SER1170           HN       SER1170 -15.740   3.424  -4.480
  493    HA   SER1170           HA       SER1170 -15.780   6.233  -4.311
  494   1HB   SER1170           HB2      SER1170 -18.047   4.319  -4.909
  495   2HB   SER1170           HB1      SER1170 -18.077   6.056  -5.215
  496    HG   SER1170           HG       SER1170 -17.337   4.351  -6.916
  497    H    ARG1171           HN       ARG1171 -16.531   7.626  -2.853
  498    HA   ARG1171           HA       ARG1171 -18.012   6.591  -0.520
  499   1HB   ARG1171           HB2      ARG1171 -17.139   8.502   0.701
  500   2HB   ARG1171           HB1      ARG1171 -15.816   7.619  -0.048
  501   1HG   ARG1171           HG2      ARG1171 -15.702   9.272  -1.831
  502   2HG   ARG1171           HG1      ARG1171 -17.044  10.156  -1.103
  503   1HD   ARG1171           HD2      ARG1171 -15.705  10.516   0.917
  504   2HD   ARG1171           HD1      ARG1171 -14.363   9.642   0.180
  505    HE   ARG1171           HE       ARG1171 -15.085  11.722  -1.535
  506   1HH1  ARG1171          1HH1      ARG1171 -13.718  11.275   1.639
  507   2HH1  ARG1171          2HH1      ARG1171 -12.805  12.746   1.593
  508   1HH2  ARG1171          1HH2      ARG1171 -13.886  13.660  -1.604
  509   2HH2  ARG1171          2HH2      ARG1171 -12.900  14.102  -0.250
  510    H    GLU1172           HN       GLU1172 -17.932   9.117  -2.969
  511    HA   GLU1172           HA       GLU1172 -20.313  10.405  -2.004
  512   1HB   GLU1172           HB2      GLU1172 -18.865  10.684  -4.646
  513   2HB   GLU1172           HB1      GLU1172 -20.157  11.733  -4.079
  514   1HG   GLU1172           HG2      GLU1172 -18.764  12.437  -2.200
  515   2HG   GLU1172           HG1      GLU1172 -17.467  11.386  -2.772
  516    H    ILE1173           HN       ILE1173 -19.977   7.475  -3.164
  517    HA   ILE1173           HA       ILE1173 -22.491   7.565  -4.688
  518    HB   ILE1173           HB       ILE1173 -20.070   5.843  -5.200
  519   1HG1  ILE1173          2HG1      ILE1173 -20.991   6.965  -7.562
  520   2HG1  ILE1173          1HG1      ILE1173 -21.233   8.240  -6.369
  521   1HG2  ILE1173          2HG2      ILE1173 -22.101   4.478  -5.347
  522   2HG2  ILE1173          1HG2      ILE1173 -22.785   5.637  -6.487
  523   3HG2  ILE1173          3HG2      ILE1173 -21.344   4.718  -6.923
  524   1HD1  ILE1173          2HD1      ILE1173 -18.650   6.799  -6.893
  525   2HD1  ILE1173          1HD1      ILE1173 -19.067   8.414  -7.467
  526   3HD1  ILE1173          3HD1      ILE1173 -18.895   8.110  -5.738
  527    H    MET1174           HN       MET1174 -20.451   5.729  -2.448
  528    HA   MET1174           HA       MET1174 -22.425   3.709  -1.981
  529   1HB   MET1174           HB2      MET1174 -19.846   4.479  -0.626
  530   2HB   MET1174           HB1      MET1174 -20.909   3.261   0.062
  531   1HG   MET1174           HG2      MET1174 -18.987   2.439  -1.359
  532   2HG   MET1174           HG1      MET1174 -20.586   1.798  -1.732
  533   1HE   MET1174           HE1      MET1174 -21.325   1.515  -4.063
  534   2HE   MET1174           HE3      MET1174 -22.146   3.027  -3.677
  535   3HE   MET1174           HE2      MET1174 -21.328   2.838  -5.228
  536    H    GLU1175           HN       GLU1175 -21.136   6.434  -0.103
  537    HA   GLU1175           HA       GLU1175 -23.003   6.281   1.985
  538   1HB   GLU1175           HB2      GLU1175 -21.921   8.106   2.815
  539   2HB   GLU1175           HB1      GLU1175 -20.757   7.740   1.544
  540   1HG   GLU1175           HG2      GLU1175 -21.841   9.360   0.074
  541   2HG   GLU1175           HG1      GLU1175 -23.013   9.729   1.340
  542    H    ASN1176           HN       ASN1176 -23.524   6.833  -1.211
  543    HA   ASN1176           HA       ASN1176 -25.871   8.540  -0.788
  544   1HB   ASN1176           HB2      ASN1176 -23.973   8.139  -3.039
  545   2HB   ASN1176           HB1      ASN1176 -25.646   8.476  -3.447
  546   1HD2  ASN1176          1HD2      ASN1176 -22.743   9.691  -2.003
  547   2HD2  ASN1176          2HD2      ASN1176 -23.224  11.348  -1.926
  548    H    TYR1177           HN       TYR1177 -24.755   5.475  -2.151
  549    HA   TYR1177           HA       TYR1177 -27.291   4.710  -3.228
  550   1HB   TYR1177           HB2      TYR1177 -24.697   3.277  -2.714
  551   2HB   TYR1177           HB1      TYR1177 -26.132   2.383  -3.193
  552    HD1  TYR1177           HD1      TYR1177 -26.370   5.495  -4.748
  553    HD2  TYR1177           HD2      TYR1177 -24.221   1.831  -4.972
  554    HE1  TYR1177           HE1      TYR1177 -25.860   5.945  -7.108
  555    HE2  TYR1177           HE2      TYR1177 -23.701   2.268  -7.331
  556    HH   TYR1177           HH       TYR1177 -24.600   3.581  -9.201
  557    H    ASN1178           HN       ASN1178 -27.219   5.504  -0.377
  558    HA   ASN1178           HA       ASN1178 -28.156   4.898   1.588
  559   1HB   ASN1178           HB2      ASN1178 -29.306   2.439   0.313
  560   2HB   ASN1178           HB1      ASN1178 -30.020   3.499   1.524
  561   1HD2  ASN1178          1HD2      ASN1178 -29.515   2.916  -1.825
  562   2HD2  ASN1178          2HD2      ASN1178 -30.524   4.184  -2.421
  563    H    ILE1179           HN       ILE1179 -25.581   3.598   0.461
  564    HA   ILE1179           HA       ILE1179 -25.498   1.344   2.358
  565    HB   ILE1179           HB       ILE1179 -23.397   0.709   1.001
  566   1HG1  ILE1179          2HG1      ILE1179 -24.836   2.447  -1.016
  567   2HG1  ILE1179          1HG1      ILE1179 -23.289   2.828  -0.269
  568   1HG2  ILE1179          2HG2      ILE1179 -26.157   0.451  -0.180
  569   2HG2  ILE1179          1HG2      ILE1179 -24.771  -0.558  -0.588
  570   3HG2  ILE1179          3HG2      ILE1179 -25.440  -0.598   1.043
  571   1HD1  ILE1179          1HD1      ILE1179 -22.300   0.861  -1.322
  572   2HD1  ILE1179          3HD1      ILE1179 -23.849   0.500  -2.083
  573   3HD1  ILE1179          2HD1      ILE1179 -22.980   1.975  -2.509
  574    H    ALA1180           HN       ALA1180 -24.121   1.393   3.998
  575    HA   ALA1180           HA       ALA1180 -22.442   3.766   4.301
  576   1HB   ALA1180           HB3      ALA1180 -24.041   3.286   6.089
  577   2HB   ALA1180           HB2      ALA1180 -23.281   1.715   6.348
  578   3HB   ALA1180           HB1      ALA1180 -22.379   3.197   6.671
  579    H    LEU1181           HN       LEU1181 -20.640   2.839   6.160
  580    HA   LEU1181           HA       LEU1181 -19.053   0.908   4.607
  581   1HB   LEU1181           HB2      LEU1181 -18.175   3.232   4.613
  582   2HB   LEU1181           HB1      LEU1181 -18.062   3.157   6.358
  583    HG   LEU1181           HG       LEU1181 -15.914   2.819   5.030
  584   1HD1  LEU1181          2HD1      LEU1181 -16.118   2.290   7.408
  585   2HD1  LEU1181          1HD1      LEU1181 -16.717   0.683   6.998
  586   3HD1  LEU1181          3HD1      LEU1181 -15.068   1.144   6.575
  587   1HD2  LEU1181          2HD2      LEU1181 -16.823   1.338   3.326
  588   2HD2  LEU1181          1HD2      LEU1181 -15.495   0.571   4.196
  589   3HD2  LEU1181          3HD2      LEU1181 -17.161   0.120   4.555
  590    H    ARG1182           HN       ARG1182 -19.742   2.156   7.800
  591    HA   ARG1182           HA       ARG1182 -20.129  -0.206   9.135
  592   1HB   ARG1182           HB2      ARG1182 -17.754  -0.661   8.505
  593   2HB   ARG1182           HB1      ARG1182 -17.270   0.739   9.449
  594   1HG   ARG1182           HG2      ARG1182 -18.176  -0.328  11.468
  595   2HG   ARG1182           HG1      ARG1182 -18.592  -1.749  10.508
  596   1HD   ARG1182           HD2      ARG1182 -16.453  -1.979  11.745
  597   2HD   ARG1182           HD1      ARG1182 -16.283  -2.157  10.000
  598    HE   ARG1182           HE       ARG1182 -15.812   0.518  10.665
  599   1HH1  ARG1182          1HH1      ARG1182 -14.372  -2.622  11.124
  600   2HH1  ARG1182          2HH1      ARG1182 -12.756  -2.009  11.221
  601   1HH2  ARG1182          1HH2      ARG1182 -13.687   1.334  10.790
  602   2HH2  ARG1182          2HH2      ARG1182 -12.366   0.239  11.031
  603    H    TRP1183           HN       TRP1183 -19.953   2.999   8.868
  604    HA   TRP1183           HA       TRP1183 -20.345   3.449  11.751
  605   1HB   TRP1183           HB2      TRP1183 -19.136   5.484   9.875
  606   2HB   TRP1183           HB1      TRP1183 -19.188   5.530  11.636
  607    HD1  TRP1183           HD1      TRP1183 -17.577   3.342   8.858
  608    HE1  TRP1183           HE1      TRP1183 -15.306   2.497   9.725
  609    HE3  TRP1183           HE3      TRP1183 -17.716   5.322  13.573
  610    HZ2  TRP1183           HZ2      TRP1183 -13.775   2.663  12.073
  611    HZ3  TRP1183           HZ3      TRP1183 -15.800   4.933  15.067
  612    HH2  TRP1183           HH2      TRP1183 -13.870   3.629  14.332
  613    H    THR1184           HN       THR1184 -21.439   3.864   8.534
  614    HA   THR1184           HA       THR1184 -23.292   4.786   7.601
  615    HB   THR1184           HB       THR1184 -25.353   4.661   8.820
  616    HG1  THR1184           HG1      THR1184 -24.171   4.020  11.259
  617   1HG2  THR1184          1HG2      THR1184 -23.492   2.459   9.719
  618   2HG2  THR1184          3HG2      THR1184 -25.253   2.375   9.719
  619   3HG2  THR1184          2HG2      THR1184 -24.377   2.515   8.195
  620    H    ALA1185           HN       ALA1185 -21.357   6.665   8.398
  621    HA   ALA1185           HA       ALA1185 -23.027   9.025   8.553
  622   1HB   ALA1185           HB3      ALA1185 -20.930   8.516  10.661
  623   2HB   ALA1185           HB1      ALA1185 -22.675   8.517  10.915
  624   3HB   ALA1185           HB2      ALA1185 -21.849  10.007  10.455
  625    H    LYS1186           HN       LYS1186 -20.555   7.401   7.246
  626    HA   LYS1186           HA       LYS1186 -19.604   9.368   5.588
  627   1HB   LYS1186           HB2      LYS1186 -18.672  10.457   7.585
  628   2HB   LYS1186           HB1      LYS1186 -17.791   8.987   7.983
  629   1HG   LYS1186           HG2      LYS1186 -16.518   9.211   5.888
  630   2HG   LYS1186           HG1      LYS1186 -17.368  10.723   5.559
  631   1HD   LYS1186           HD2      LYS1186 -16.467  11.682   7.619
  632   2HD   LYS1186           HD1      LYS1186 -15.628  10.167   7.961
  633   1HE   LYS1186           HE2      LYS1186 -14.110  11.809   6.988
  634   2HE   LYS1186           HE1      LYS1186 -14.319  10.423   5.916
  635   1HZ   LYS1186           HZ3      LYS1186 -15.694  13.042   5.641
  636   2HZ   LYS1186           HZ2      LYS1186 -14.397  12.504   4.697
  637   3HZ   LYS1186           HZ1      LYS1186 -15.889  11.713   4.611
  638    H    GLN1187           HN       GLN1187 -19.351   7.910   4.011
  639    HA   GLN1187           HA       GLN1187 -18.779   5.309   3.993
  640   1HB   GLN1187           HB2      GLN1187 -18.131   7.492   2.110
  641   2HB   GLN1187           HB1      GLN1187 -17.241   5.995   1.874
  642   1HG   GLN1187           HG2      GLN1187 -20.020   6.633   1.303
  643   2HG   GLN1187           HG1      GLN1187 -18.973   5.397   0.617
  644   1HE2  GLN1187          1HE2      GLN1187 -21.215   6.163   3.165
  645   2HE2  GLN1187          2HE2      GLN1187 -21.529   4.536   3.649
  646    H    LYS1188           HN       LYS1188 -15.996   7.284   3.065
  647    HA   LYS1188           HA       LYS1188 -13.782   7.092   3.568
  648   1HB   LYS1188           HB2      LYS1188 -14.586   7.808   5.771
  649   2HB   LYS1188           HB1      LYS1188 -14.911   6.139   6.210
  650   1HG   LYS1188           HG2      LYS1188 -12.515   5.641   6.067
  651   2HG   LYS1188           HG1      LYS1188 -12.196   7.319   5.619
  652   1HD   LYS1188           HD2      LYS1188 -13.109   8.065   7.764
  653   2HD   LYS1188           HD1      LYS1188 -13.428   6.388   8.211
  654   1HE   LYS1188           HE2      LYS1188 -11.369   7.191   9.239
  655   2HE   LYS1188           HE1      LYS1188 -11.043   5.893   8.093
  656   1HZ   LYS1188           HZ1      LYS1188 -10.700   8.795   7.561
  657   2HZ   LYS1188           HZ3      LYS1188  -9.453   7.692   7.863
  658   3HZ   LYS1188           HZ2      LYS1188 -10.387   7.549   6.460
  659    H    LEU1189           HN       LEU1189 -14.631   5.118   2.020
  660    HA   LEU1189           HA       LEU1189 -14.087   2.493   3.048
  661   1HB   LEU1189           HB2      LEU1189 -14.042   2.978   0.133
  662   2HB   LEU1189           HB1      LEU1189 -14.831   1.709   1.046
  663    HG   LEU1189           HG       LEU1189 -16.581   2.924   0.102
  664   1HD1  LEU1189          2HD1      LEU1189 -16.956   2.501   2.459
  665   2HD1  LEU1189          1HD1      LEU1189 -16.218   4.050   2.865
  666   3HD1  LEU1189          3HD1      LEU1189 -17.729   4.004   1.958
  667   1HD2  LEU1189          2HD2      LEU1189 -15.310   4.825  -0.698
  668   2HD2  LEU1189          1HD2      LEU1189 -16.775   5.351   0.130
  669   3HD2  LEU1189          3HD2      LEU1189 -15.214   5.465   0.942
  670    H    TYR1190           HN       TYR1190 -12.024   4.766   2.927
  671    HA   TYR1190           HA       TYR1190  -9.999   3.654   1.189
  672   1HB   TYR1190           HB2      TYR1190  -9.996   6.041   3.036
  673   2HB   TYR1190           HB1      TYR1190  -8.638   5.579   2.015
  674    HD1  TYR1190           HD1      TYR1190 -12.163   5.270   0.898
  675    HD2  TYR1190           HD2      TYR1190  -8.600   7.618   0.758
  676    HE1  TYR1190           HE1      TYR1190 -13.095   6.585  -0.958
  677    HE2  TYR1190           HE2      TYR1190  -9.534   8.929  -1.099
  678    HH   TYR1190           HH       TYR1190 -11.226   8.684  -2.859
  679    H    SER1191           HN       SER1191  -8.710   2.091   1.777
  680    HA   SER1191           HA       SER1191  -7.721   1.953   4.535
  681   1HB   SER1191           HB2      SER1191  -9.039  -0.285   2.994
  682   2HB   SER1191           HB1      SER1191  -7.975  -0.586   4.365
  683    HG   SER1191           HG       SER1191 -10.120   1.217   4.622
  684    H    ARG1192           HN       ARG1192  -6.059  -0.018   4.561
  685    HA   ARG1192           HA       ARG1192  -4.154   0.541   2.428
  686   1HB   ARG1192           HB2      ARG1192  -3.930  -0.720   5.159
  687   2HB   ARG1192           HB1      ARG1192  -2.624  -0.787   3.992
  688   1HG   ARG1192           HG2      ARG1192  -2.542   1.660   3.943
  689   2HG   ARG1192           HG1      ARG1192  -3.848   1.716   5.129
  690   1HD   ARG1192           HD2      ARG1192  -2.444   0.524   6.735
  691   2HD   ARG1192           HD1      ARG1192  -1.140   0.456   5.550
  692    HE   ARG1192           HE       ARG1192  -1.889   3.133   5.914
  693   1HH1  ARG1192          1HH1      ARG1192  -0.351   0.532   7.650
  694   2HH1  ARG1192          2HH1      ARG1192   0.616   1.585   8.628
  695   1HH2  ARG1192          1HH2      ARG1192  -0.620   4.526   7.197
  696   2HH2  ARG1192          2HH2      ARG1192   0.463   3.856   8.370
  697    H    THR1193           HN       THR1193  -4.085  -0.822   0.759
  698    HA   THR1193           HA       THR1193  -5.553  -2.971   0.211
  699    HB   THR1193           HB       THR1193  -2.621  -2.708  -0.475
  700    HG1  THR1193           HG1      THR1193  -5.030  -1.818  -1.649
  701   1HG2  THR1193          1HG2      THR1193  -4.736  -4.473  -1.706
  702   2HG2  THR1193          3HG2      THR1193  -3.112  -4.226  -2.348
  703   3HG2  THR1193          2HG2      THR1193  -3.332  -5.013  -0.785
  704    H    GLY1194           HN       GLY1194  -5.956  -4.871   1.077
  705   1HA   GLY1194           HA1      GLY1194  -3.893  -6.091   2.805
  706   2HA   GLY1194           HA2      GLY1194  -4.923  -7.042   1.741
  707    H    GLU1195           HN       GLU1195  -6.154  -4.279   3.442
  708    HA   GLU1195           HA       GLU1195  -7.202  -5.804   5.655
  709   1HB   GLU1195           HB2      GLU1195  -7.733  -2.953   4.795
  710   2HB   GLU1195           HB1      GLU1195  -8.275  -3.674   6.304
  711   1HG   GLU1195           HG2      GLU1195  -5.410  -3.287   5.467
  712   2HG   GLU1195           HG1      GLU1195  -6.296  -2.295   6.624
  713    H    SER1196           HN       SER1196  -9.404  -6.198   6.084
  714    HA   SER1196           HA       SER1196 -11.022  -6.449   3.656
  715   1HB   SER1196           HB2      SER1196 -12.344  -8.077   4.919
  716   2HB   SER1196           HB1      SER1196 -10.631  -8.490   4.981
  717    HG   SER1196           HG       SER1196 -11.272  -8.642   7.048
  718    H    VAL1197           HN       VAL1197 -12.601  -5.059   3.278
  719    HA   VAL1197           HA       VAL1197 -13.533  -3.304   5.407
  720    HB   VAL1197           HB       VAL1197 -14.013  -3.312   2.425
  721   1HG1  VAL1197          2HG1      VAL1197 -15.087  -1.388   4.483
  722   2HG1  VAL1197          1HG1      VAL1197 -15.195  -1.188   2.734
  723   3HG1  VAL1197          3HG1      VAL1197 -16.033  -2.524   3.523
  724   1HG2  VAL1197          3HG2      VAL1197 -11.803  -2.567   3.136
  725   2HG2  VAL1197          2HG2      VAL1197 -12.745  -1.221   2.491
  726   3HG2  VAL1197          1HG2      VAL1197 -12.540  -1.401   4.235
  727    H    GLU1198           HN       GLU1198 -15.823  -2.954   5.781
  728    HA   GLU1198           HA       GLU1198 -17.552  -5.203   5.019
  729   1HB   GLU1198           HB2      GLU1198 -18.439  -5.144   7.404
  730   2HB   GLU1198           HB1      GLU1198 -16.845  -5.850   7.176
  731   1HG   GLU1198           HG2      GLU1198 -15.806  -3.780   7.915
  732   2HG   GLU1198           HG1      GLU1198 -17.395  -3.043   8.127
  733    H    PHE1199           HN       PHE1199 -18.298  -3.416   3.528
  734    HA   PHE1199           HA       PHE1199 -19.460  -1.053   4.411
  735   1HB   PHE1199           HB2      PHE1199 -20.243  -2.800   2.075
  736   2HB   PHE1199           HB1      PHE1199 -20.806  -1.151   2.320
  737    HD1  PHE1199           HD1      PHE1199 -19.304   0.738   2.038
  738    HD2  PHE1199           HD2      PHE1199 -18.004  -3.258   1.366
  739    HE1  PHE1199           HE1      PHE1199 -17.313   1.591   0.851
  740    HE2  PHE1199           HE2      PHE1199 -16.020  -2.420   0.187
  741    HZ   PHE1199           HZ       PHE1199 -15.673   0.004  -0.069
  742    H    VAL1200           HN       VAL1200 -21.728  -0.467   4.488
  743    HA   VAL1200           HA       VAL1200 -23.568  -2.585   5.337
  744    HB   VAL1200           HB       VAL1200 -23.687  -0.083   6.914
  745   1HG1  VAL1200          1HG1      VAL1200 -23.958  -3.003   7.617
  746   2HG1  VAL1200          3HG1      VAL1200 -24.273  -1.653   8.707
  747   3HG1  VAL1200          2HG1      VAL1200 -25.276  -1.883   7.275
  748   1HG2  VAL1200          2HG2      VAL1200 -21.530  -2.133   7.402
  749   2HG2  VAL1200          1HG2      VAL1200 -21.289  -0.454   6.919
  750   3HG2  VAL1200          3HG2      VAL1200 -21.972  -0.827   8.501
  751    H    CYS1201           HN       CYS1201 -25.493  -0.596   6.235
  752    HA   CYS1201           HA       CYS1201 -26.066   0.855   3.748
  753   1HB   CYS1201           HB2      CYS1201 -28.416  -0.219   5.182
  754   2HB   CYS1201           HB1      CYS1201 -28.126  -0.057   3.454
  755    H    LYS1202           HN       LYS1202 -26.551   2.935   4.115
  756    HA   LYS1202           HA       LYS1202 -26.288   4.197   6.502
  757   1HB   LYS1202           HB2      LYS1202 -27.479   6.091   5.592
  758   2HB   LYS1202           HB1      LYS1202 -26.507   5.355   4.326
  759   1HG   LYS1202           HG2      LYS1202 -28.286   5.076   3.051
  760   2HG   LYS1202           HG1      LYS1202 -29.127   4.201   4.332
  761   1HD   LYS1202           HD2      LYS1202 -29.030   7.193   3.957
  762   2HD   LYS1202           HD1      LYS1202 -30.415   6.134   3.678
  763   1HE   LYS1202           HE2      LYS1202 -30.455   5.552   6.050
  764   2HE   LYS1202           HE1      LYS1202 -29.069   6.605   6.333
  765   1HZ   LYS1202           HZ3      LYS1202 -31.731   7.481   5.348
  766   2HZ   LYS1202           HZ2      LYS1202 -31.143   7.693   6.920
  767   3HZ   LYS1202           HZ1      LYS1202 -30.402   8.491   5.625
  768    H    ARG1203           HN       ARG1203 -27.193   3.821   8.334
  769    HA   ARG1203           HA       ARG1203 -28.820   2.520   9.592
  770   1HB   ARG1203           HB2      ARG1203 -29.399   5.463   9.451
  771   2HB   ARG1203           HB1      ARG1203 -29.891   4.398  10.758
  772   1HG   ARG1203           HG2      ARG1203 -27.542   3.942  11.266
  773   2HG   ARG1203           HG1      ARG1203 -27.060   5.029   9.962
  774   1HD   ARG1203           HD2      ARG1203 -28.188   6.883  11.102
  775   2HD   ARG1203           HD1      ARG1203 -28.645   5.794  12.411
  776    HE   ARG1203           HE       ARG1203 -25.898   5.620  12.184
  777   1HH1  ARG1203          1HH1      ARG1203 -28.250   8.095  12.878
  778   2HH1  ARG1203          2HH1      ARG1203 -27.179   9.012  13.884
  779   1HH2  ARG1203          1HH2      ARG1203 -24.481   6.821  13.508
  780   2HH2  ARG1203          2HH2      ARG1203 -25.037   8.288  14.242
  781    H    GLY1204           HN       GLY1204 -30.295   1.194   8.582
  782   1HA   GLY1204           HA1      GLY1204 -32.689   2.539   7.503
  783   2HA   GLY1204           HA2      GLY1204 -32.820   1.205   8.636
  784    H    TYR1205           HN       TYR1205 -31.674   2.077   5.407
  785    HA   TYR1205           HA       TYR1205 -32.962   0.189   3.969
  786   1HB   TYR1205           HB2      TYR1205 -30.174   1.215   3.465
  787   2HB   TYR1205           HB1      TYR1205 -31.138   0.351   2.280
  788    HD1  TYR1205           HD1      TYR1205 -32.830   1.467   1.037
  789    HD2  TYR1205           HD2      TYR1205 -30.907   3.465   4.259
  790    HE1  TYR1205           HE1      TYR1205 -33.845   3.585   0.317
  791    HE2  TYR1205           HE2      TYR1205 -31.919   5.590   3.549
  792    HH   TYR1205           HH       TYR1205 -32.847   6.600   1.513
  793    H    ARG1206           HN       ARG1206 -32.846  -1.890   3.482
  794    HA   ARG1206           HA       ARG1206 -30.907  -3.514   4.967
  795   1HB   ARG1206           HB2      ARG1206 -32.509  -5.369   4.580
  796   2HB   ARG1206           HB1      ARG1206 -33.214  -4.025   5.465
  797   1HG   ARG1206           HG2      ARG1206 -34.898  -4.367   4.000
  798   2HG   ARG1206           HG1      ARG1206 -33.912  -3.298   2.997
  799   1HD   ARG1206           HD2      ARG1206 -32.896  -5.239   1.920
  800   2HD   ARG1206           HD1      ARG1206 -33.859  -6.314   2.932
  801    HE   ARG1206           HE       ARG1206 -35.563  -4.558   1.541
  802   1HH1  ARG1206          1HH1      ARG1206 -33.476  -7.293   0.995
  803   2HH1  ARG1206          2HH1      ARG1206 -34.369  -7.866  -0.373
  804   1HH2  ARG1206          1HH2      ARG1206 -36.747  -5.304  -0.258
  805   2HH2  ARG1206          2HH2      ARG1206 -36.228  -6.735  -1.086
  806    H    LEU1207           HN       LEU1207 -29.582  -4.953   3.981
  807    HA   LEU1207           HA       LEU1207 -28.611  -4.556   1.457
  808   1HB   LEU1207           HB2      LEU1207 -27.477  -5.929   3.128
  809   2HB   LEU1207           HB1      LEU1207 -28.709  -7.166   2.974
  810    HG   LEU1207           HG       LEU1207 -28.003  -7.483   0.591
  811   1HD1  LEU1207          3HD1      LEU1207 -26.982  -5.300   0.227
  812   2HD1  LEU1207          2HD1      LEU1207 -25.726  -5.683   1.405
  813   3HD1  LEU1207          1HD1      LEU1207 -25.832  -6.598  -0.098
  814   1HD2  LEU1207          2HD2      LEU1207 -25.890  -7.892   2.701
  815   2HD2  LEU1207          1HD2      LEU1207 -27.220  -8.987   2.327
  816   3HD2  LEU1207          3HD2      LEU1207 -25.947  -8.706   1.139
  817    H    SER1208           HN       SER1208 -29.362  -4.844  -0.529
  818    HA   SER1208           HA       SER1208 -31.908  -5.850  -1.091
  819   1HB   SER1208           HB2      SER1208 -31.245  -5.689  -3.456
  820   2HB   SER1208           HB1      SER1208 -30.747  -4.259  -2.555
  821    HG   SER1208           HG       SER1208 -28.658  -5.392  -2.346
  822    H    SER1209           HN       SER1209 -28.993  -7.487  -0.521
  823    HA   SER1209           HA       SER1209 -28.510  -9.707  -0.380
  824   1HB   SER1209           HB2      SER1209 -30.843 -10.121   0.247
  825   2HB   SER1209           HB1      SER1209 -31.304 -10.146  -1.455
  826    HG   SER1209           HG       SER1209 -29.705 -11.919  -1.617
  827    H    ARG1210           HN       ARG1210 -30.403  -9.068  -3.334
  828    HA   ARG1210           HA       ARG1210 -28.951 -10.837  -4.972
  829   1HB   ARG1210           HB2      ARG1210 -30.017  -9.689  -6.846
  830   2HB   ARG1210           HB1      ARG1210 -31.181  -9.988  -5.561
  831   1HG   ARG1210           HG2      ARG1210 -30.975  -7.671  -4.825
  832   2HG   ARG1210           HG1      ARG1210 -29.801  -7.368  -6.109
  833   1HD   ARG1210           HD2      ARG1210 -32.673  -8.207  -6.493
  834   2HD   ARG1210           HD1      ARG1210 -32.027  -6.585  -6.739
  835    HE   ARG1210           HE       ARG1210 -30.560  -8.339  -8.334
  836   1HH1  ARG1210          1HH1      ARG1210 -33.815  -7.122  -8.077
  837   2HH1  ARG1210          2HH1      ARG1210 -34.143  -7.277  -9.770
  838   1HH2  ARG1210          1HH2      ARG1210 -30.983  -8.545 -10.564
  839   2HH2  ARG1210          2HH2      ARG1210 -32.534  -8.086 -11.184
  840    H    SER1211           HN       SER1211 -28.042  -7.974  -3.537
  841    HA   SER1211           HA       SER1211 -26.500  -6.656  -5.431
  842   1HB   SER1211           HB2      SER1211 -26.914  -5.615  -3.314
  843   2HB   SER1211           HB1      SER1211 -26.141  -6.940  -2.446
  844    HG   SER1211           HG       SER1211 -25.030  -4.724  -3.433
  845    H    HIS1212           HN       HIS1212 -24.663  -8.072  -2.847
  846    HA   HIS1212           HA       HIS1212 -23.467 -10.197  -4.224
  847   1HB   HIS1212           HB2      HIS1212 -22.637  -8.081  -5.509
  848   2HB   HIS1212           HB1      HIS1212 -21.569  -7.874  -4.124
  849    HD1  HIS1212           HD1      HIS1212 -21.843  -9.615  -7.296
  850    HD2  HIS1212           HD2      HIS1212 -19.811 -10.194  -3.719
  851    HE1  HIS1212           HE1      HIS1212 -20.017 -11.263  -7.819
  852    HE2  HIS1212           HE2      HIS1212 -18.750 -11.535  -5.658
  853    H    THR1213           HN       THR1213 -21.236  -8.053  -2.657
  854    HA   THR1213           HA       THR1213 -21.659  -9.307  -0.058
  855    HB   THR1213           HB       THR1213 -19.389 -10.029   0.205
  856    HG1  THR1213           HG1      THR1213 -17.902  -9.792  -1.561
  857   1HG2  THR1213          3HG2      THR1213 -20.569 -10.925  -2.420
  858   2HG2  THR1213          2HG2      THR1213 -19.208 -11.725  -1.628
  859   3HG2  THR1213          1HG2      THR1213 -20.785 -11.676  -0.838
  860    H    LEU1214           HN       LEU1214 -21.427  -7.904   1.550
  861    HA   LEU1214           HA       LEU1214 -20.525  -5.222   1.006
  862   1HB   LEU1214           HB2      LEU1214 -21.699  -6.634   3.375
  863   2HB   LEU1214           HB1      LEU1214 -20.962  -5.057   3.576
  864    HG   LEU1214           HG       LEU1214 -22.640  -3.969   2.445
  865   1HD1  LEU1214          1HD1      LEU1214 -23.307  -6.542   1.024
  866   2HD1  LEU1214          3HD1      LEU1214 -24.116  -4.992   0.786
  867   3HD1  LEU1214          2HD1      LEU1214 -22.416  -5.176   0.349
  868   1HD2  LEU1214          3HD2      LEU1214 -23.999  -6.436   3.511
  869   2HD2  LEU1214          2HD2      LEU1214 -23.598  -4.982   4.425
  870   3HD2  LEU1214          1HD2      LEU1214 -24.798  -4.909   3.134
  871    H    ARG1215           HN       ARG1215 -19.425  -7.994   2.882
  872    HA   ARG1215           HA       ARG1215 -17.011  -6.578   3.692
  873   1HB   ARG1215           HB2      ARG1215 -18.314  -8.121   5.237
  874   2HB   ARG1215           HB1      ARG1215 -17.718  -9.456   4.261
  875   1HG   ARG1215           HG2      ARG1215 -15.406  -8.755   4.784
  876   2HG   ARG1215           HG1      ARG1215 -16.062  -7.505   5.847
  877   1HD   ARG1215           HD2      ARG1215 -16.479 -10.478   6.133
  878   2HD   ARG1215           HD1      ARG1215 -15.400  -9.486   7.110
  879    HE   ARG1215           HE       ARG1215 -17.940  -8.378   7.307
  880   1HH1  ARG1215          1HH1      ARG1215 -16.326 -11.349   8.152
  881   2HH1  ARG1215          2HH1      ARG1215 -17.348 -11.667   9.514
  882   1HH2  ARG1215          1HH2      ARG1215 -19.290  -8.789   9.098
  883   2HH2  ARG1215          2HH2      ARG1215 -19.033 -10.212  10.051
  884    H    THR1216           HN       THR1216 -15.439  -6.455   2.226
  885    HA   THR1216           HA       THR1216 -14.693  -8.898   0.779
  886    HB   THR1216           HB       THR1216 -15.893  -7.730  -0.888
  887    HG1  THR1216           HG1      THR1216 -13.844  -8.443  -1.613
  888   1HG2  THR1216          2HG2      THR1216 -16.031  -5.564   0.273
  889   2HG2  THR1216          1HG2      THR1216 -14.349  -5.247  -0.152
  890   3HG2  THR1216          3HG2      THR1216 -15.568  -5.378  -1.419
  891    H    THR1217           HN       THR1217 -12.554  -8.406  -0.472
  892    HA   THR1217           HA       THR1217 -10.688  -7.280   1.496
  893    HB   THR1217           HB       THR1217 -10.336  -9.326  -0.688
  894    HG1  THR1217           HG1      THR1217 -10.827  -9.507   1.862
  895   1HG2  THR1217          1HG2      THR1217  -8.447  -7.690  -0.755
  896   2HG2  THR1217          3HG2      THR1217  -8.103  -8.090   0.929
  897   3HG2  THR1217          2HG2      THR1217  -7.956  -9.328  -0.320
  898    H    CYS1218           HN       CYS1218  -9.453  -5.555   1.035
  899    HA   CYS1218           HA       CYS1218  -9.910  -4.184  -1.465
  900   1HB   CYS1218           HB2      CYS1218  -8.061  -3.368   0.783
  901   2HB   CYS1218           HB1      CYS1218  -8.706  -2.342  -0.497
  902    H    TRP1219           HN       TRP1219  -8.531  -4.035  -3.153
  903    HA   TRP1219           HA       TRP1219  -5.755  -4.606  -2.966
  904   1HB   TRP1219           HB2      TRP1219  -7.223  -6.886  -2.916
  905   2HB   TRP1219           HB1      TRP1219  -7.023  -6.681  -4.652
  906    HD1  TRP1219           HD1      TRP1219  -4.493  -6.779  -5.609
  907    HE1  TRP1219           HE1      TRP1219  -2.393  -7.929  -4.669
  908    HE3  TRP1219           HE3      TRP1219  -6.029  -7.496  -0.785
  909    HZ2  TRP1219           HZ2      TRP1219  -1.501  -8.992  -2.231
  910    HZ3  TRP1219           HZ3      TRP1219  -4.487  -8.590   0.790
  911    HH2  TRP1219           HH2      TRP1219  -2.267  -9.323   0.081
  912    H    ASP1220           HN       ASP1220  -4.692  -3.861  -4.723
  913    HA   ASP1220           HA       ASP1220  -4.306  -2.837  -6.718
  914   1HB   ASP1220           HB2      ASP1220  -5.227  -4.980  -7.612
  915   2HB   ASP1220           HB1      ASP1220  -6.822  -4.234  -7.652
  916    H    GLY1221           HN       GLY1221  -6.561  -1.979  -4.678
  917   1HA   GLY1221           HA1      GLY1221  -7.089   0.517  -6.033
  918   2HA   GLY1221           HA2      GLY1221  -7.513   0.115  -4.378
  919    H    LYS1222           HN       LYS1222  -8.950  -2.347  -5.173
  920    HA   LYS1222           HA       LYS1222 -11.489  -1.104  -5.647
  921   1HB   LYS1222           HB2      LYS1222 -10.098  -1.752  -7.915
  922   2HB   LYS1222           HB1      LYS1222 -11.077  -3.189  -7.649
  923   1HG   LYS1222           HG2      LYS1222 -12.255  -0.435  -7.656
  924   2HG   LYS1222           HG1      LYS1222 -12.062  -1.387  -9.128
  925   1HD   LYS1222           HD2      LYS1222 -13.397  -3.192  -8.087
  926   2HD   LYS1222           HD1      LYS1222 -13.651  -2.154  -6.682
  927   1HE   LYS1222           HE2      LYS1222 -15.567  -2.075  -8.186
  928   2HE   LYS1222           HE1      LYS1222 -14.768  -0.506  -8.092
  929   1HZ   LYS1222           HZ3      LYS1222 -14.425  -2.487 -10.278
  930   2HZ   LYS1222           HZ2      LYS1222 -15.346  -1.072 -10.367
  931   3HZ   LYS1222           HZ1      LYS1222 -13.668  -0.976 -10.188
  932    H    LEU1223           HN       LEU1223 -13.165  -2.324  -4.951
  933    HA   LEU1223           HA       LEU1223 -12.845  -5.193  -4.620
  934   1HB   LEU1223           HB2      LEU1223 -13.800  -4.834  -2.192
  935   2HB   LEU1223           HB1      LEU1223 -12.077  -4.841  -2.508
  936    HG   LEU1223           HG       LEU1223 -13.501  -2.230  -2.580
  937   1HD1  LEU1223          2HD1      LEU1223 -12.755  -3.677  -0.044
  938   2HD1  LEU1223          1HD1      LEU1223 -13.227  -1.981  -0.157
  939   3HD1  LEU1223          3HD1      LEU1223 -14.385  -3.248  -0.564
  940   1HD2  LEU1223          2HD2      LEU1223 -11.105  -2.493  -3.153
  941   2HD2  LEU1223          1HD2      LEU1223 -11.402  -1.398  -1.803
  942   3HD2  LEU1223          3HD2      LEU1223 -10.817  -3.031  -1.500
  943    H    GLU1224           HN       GLU1224 -15.003  -5.859  -3.214
  944    HA   GLU1224           HA       GLU1224 -17.123  -5.425  -5.030
  945   1HB   GLU1224           HB2      GLU1224 -16.753  -7.441  -3.486
  946   2HB   GLU1224           HB1      GLU1224 -17.493  -6.463  -2.224
  947   1HG   GLU1224           HG2      GLU1224 -19.060  -8.012  -3.346
  948   2HG   GLU1224           HG1      GLU1224 -19.541  -6.318  -3.437
  949    H    TYR1225           HN       TYR1225 -19.236  -4.526  -4.550
  950    HA   TYR1225           HA       TYR1225 -19.141  -2.295  -2.618
  951   1HB   TYR1225           HB2      TYR1225 -20.074  -2.308  -5.489
  952   2HB   TYR1225           HB1      TYR1225 -20.659  -1.108  -4.344
  953    HD1  TYR1225           HD1      TYR1225 -19.655   0.925  -4.488
  954    HD2  TYR1225           HD2      TYR1225 -17.334  -2.543  -5.315
  955    HE1  TYR1225           HE1      TYR1225 -17.705   2.349  -4.976
  956    HE2  TYR1225           HE2      TYR1225 -15.381  -1.131  -5.799
  957    HH   TYR1225           HH       TYR1225 -15.247   2.158  -5.007
  958    HA   PRO1226           HA       PRO1226 -23.104  -3.921  -1.402
  959   1HB   PRO1226           HB2      PRO1226 -23.759  -2.092   0.415
  960   2HB   PRO1226           HB1      PRO1226 -22.364  -3.148   0.670
  961   1HG   PRO1226           HG2      PRO1226 -22.446  -0.311  -0.284
  962   2HG   PRO1226           HG1      PRO1226 -21.355  -1.058   0.891
  963   1HD   PRO1226           HD2      PRO1226 -20.727  -0.627  -1.758
  964   2HD   PRO1226           HD1      PRO1226 -19.963  -1.858  -0.734
  965    H    THR1227           HN       THR1227 -25.385  -3.023  -1.031
  966    HA   THR1227           HA       THR1227 -26.297  -0.636  -2.191
  967    HB   THR1227           HB       THR1227 -27.421  -2.554  -4.030
  968    HG1  THR1227           HG1      THR1227 -25.685  -3.357  -4.997
  969   1HG2  THR1227          3HG2      THR1227 -27.490  -0.124  -4.287
  970   2HG2  THR1227          2HG2      THR1227 -25.735  -0.086  -4.461
  971   3HG2  THR1227          1HG2      THR1227 -26.725  -0.885  -5.683
  972    H    CYS1228           HN       CYS1228 -27.474  -0.804  -0.236
  973    HA   CYS1228           HA       CYS1228 -29.383  -2.982   0.031
  974   1HB   CYS1228           HB2      CYS1228 -28.866  -0.661   1.901
  975   2HB   CYS1228           HB1      CYS1228 -29.772  -2.129   2.265
  976    H    ALA1229           HN       ALA1229 -31.571  -1.906   1.194
  977    HA   ALA1229           HA       ALA1229 -32.530   0.367  -0.256
  978   1HB   ALA1229           HB2      ALA1229 -33.621  -2.342  -0.971
  979   2HB   ALA1229           HB1      ALA1229 -34.267  -0.794  -1.514
  980   3HB   ALA1229           HB3      ALA1229 -32.654  -1.301  -2.019
  981    H    LYS1230           HN       LYS1230 -34.573   1.055   0.344
  982    HA   LYS1230           HA       LYS1230 -36.232   1.495   1.791
  983   1HB   LYS1230           HB2      LYS1230 -37.407  -0.338   1.000
  984   2HB   LYS1230           HB1      LYS1230 -36.245  -1.489   1.642
  985   1HG   LYS1230           HG2      LYS1230 -37.054  -1.171   3.857
  986   2HG   LYS1230           HG1      LYS1230 -38.107   0.148   3.342
  987   1HD   LYS1230           HD2      LYS1230 -39.370  -1.422   1.942
  988   2HD   LYS1230           HD1      LYS1230 -38.320  -2.737   2.476
  989   1HE   LYS1230           HE2      LYS1230 -39.052  -2.376   4.785
  990   2HE   LYS1230           HE1      LYS1230 -40.110  -1.073   4.245
  991   1HZ   LYS1230           HZ3      LYS1230 -40.323  -3.921   3.430
  992   2HZ   LYS1230           HZ2      LYS1230 -41.329  -3.132   4.537
  993   3HZ   LYS1230           HZ1      LYS1230 -41.338  -2.669   2.910
  994    H    ARG1231           HN       ARG1231 -35.200   2.614   3.351
  995    HA   ARG1231           HA       ARG1231 -33.795   1.456   5.493
  996   1HB   ARG1231           HB2      ARG1231 -34.073   3.785   6.489
  997   2HB   ARG1231           HB1      ARG1231 -33.221   3.675   4.967
  998   1HG   ARG1231           HG2      ARG1231 -35.233   4.370   3.780
  999   2HG   ARG1231           HG1      ARG1231 -36.112   4.449   5.309
 1000   1HD   ARG1231           HD2      ARG1231 -34.579   6.181   6.102
 1001   2HD   ARG1231           HD1      ARG1231 -33.699   6.102   4.577
 1002    HE   ARG1231           HE       ARG1231 -36.403   6.624   4.044
 1003   1HH1  ARG1231          1HH1      ARG1231 -33.605   8.156   5.444
 1004   2HH1  ARG1231          2HH1      ARG1231 -34.117   9.758   5.033
 1005   1HH2  ARG1231          1HH2      ARG1231 -37.085   8.730   3.498
 1006   2HH2  ARG1231          2HH2      ARG1231 -36.095  10.086   3.928

  No H/Q in entry =        1006
  Start of MODEL   19
    1    H1   GLU1103           HT2      GLU1103  39.299   7.067 -12.626
    2    H2   GLU1103           HT1      GLU1103  38.152   6.416 -13.686
    3    H3   GLU1103           HT3      GLU1103  39.428   7.350 -14.289
    4    HA   GLU1103           HA       GLU1103  38.592   9.294 -13.147
    5   1HB   GLU1103           HB2      GLU1103  37.885   8.840 -15.460
    6   2HB   GLU1103           HB1      GLU1103  36.521   7.906 -14.863
    7   1HG   GLU1103           HG2      GLU1103  35.815  10.115 -15.553
    8   2HG   GLU1103           HG1      GLU1103  35.600   9.908 -13.816
    9    H    ALA1104           HN       ALA1104  36.268   6.597 -12.952
   10    HA   ALA1104           HA       ALA1104  34.918   7.936 -10.735
   11   1HB   ALA1104           HB3      ALA1104  33.199   6.229 -10.989
   12   2HB   ALA1104           HB1      ALA1104  34.184   5.399 -12.193
   13   3HB   ALA1104           HB2      ALA1104  33.543   7.006 -12.534
   14    H    GLU1105           HN       GLU1105  35.512   4.475 -11.232
   15    HA   GLU1105           HA       GLU1105  36.270   2.839  -9.849
   16   1HB   GLU1105           HB2      GLU1105  38.343   4.277 -10.087
   17   2HB   GLU1105           HB1      GLU1105  37.930   4.990  -8.533
   18   1HG   GLU1105           HG2      GLU1105  39.599   3.259  -8.269
   19   2HG   GLU1105           HG1      GLU1105  38.092   2.796  -7.478
   20    H    PHE1106           HN       PHE1106  34.078   4.833  -8.979
   21    HA   PHE1106           HA       PHE1106  34.158   4.898  -6.136
   22   1HB   PHE1106           HB2      PHE1106  31.876   5.252  -8.085
   23   2HB   PHE1106           HB1      PHE1106  31.725   5.492  -6.349
   24    HD1  PHE1106           HD1      PHE1106  33.183   7.254  -5.253
   25    HD2  PHE1106           HD2      PHE1106  32.644   6.967  -9.465
   26    HE1  PHE1106           HE1      PHE1106  33.930   9.584  -5.504
   27    HE2  PHE1106           HE2      PHE1106  33.393   9.296  -9.723
   28    HZ   PHE1106           HZ       PHE1106  34.036  10.609  -7.741
   29    H    GLY1107           HN       GLY1107  31.928   3.988  -5.083
   30   1HA   GLY1107           HA1      GLY1107  32.321   1.215  -4.860
   31   2HA   GLY1107           HA2      GLY1107  30.936   1.515  -5.890
   32    H    LYS1108           HN       LYS1108  30.699   4.095  -4.108
   33    HA   LYS1108           HA       LYS1108  29.573   2.841  -1.723
   34   1HB   LYS1108           HB2      LYS1108  30.093   5.722  -2.450
   35   2HB   LYS1108           HB1      LYS1108  29.205   5.245  -1.010
   36   1HG   LYS1108           HG2      LYS1108  31.271   3.847  -0.431
   37   2HG   LYS1108           HG1      LYS1108  32.095   4.809  -1.661
   38   1HD   LYS1108           HD2      LYS1108  31.470   6.857  -0.475
   39   2HD   LYS1108           HD1      LYS1108  30.648   5.894   0.754
   40   1HE   LYS1108           HE2      LYS1108  33.593   5.851   0.116
   41   2HE   LYS1108           HE1      LYS1108  32.838   6.566   1.541
   42   1HZ   LYS1108           HZ3      LYS1108  32.083   4.366   2.198
   43   2HZ   LYS1108           HZ2      LYS1108  32.809   3.681   0.833
   44   3HZ   LYS1108           HZ1      LYS1108  33.767   4.393   2.031
   45    H    CYS1109           HN       CYS1109  27.506   2.406  -1.556
   46    HA   CYS1109           HA       CYS1109  25.686   2.835  -3.643
   47   1HB   CYS1109           HB2      CYS1109  24.785   2.385  -0.820
   48   2HB   CYS1109           HB1      CYS1109  24.103   1.754  -2.315
   49    H    GLY1110           HN       GLY1110  23.677   4.025  -3.551
   50   1HA   GLY1110           HA1      GLY1110  23.313   6.466  -3.732
   51   2HA   GLY1110           HA2      GLY1110  23.969   6.586  -2.104
   52    HA   PRO1111           HA       PRO1111  19.653   6.723  -0.928
   53   1HB   PRO1111           HB2      PRO1111  18.434   7.427  -3.541
   54   2HB   PRO1111           HB1      PRO1111  18.272   8.218  -1.970
   55   1HG   PRO1111           HG2      PRO1111  19.752   9.302  -3.917
   56   2HG   PRO1111           HG1      PRO1111  20.248   9.404  -2.217
   57   1HD   PRO1111           HD2      PRO1111  21.281   7.633  -4.393
   58   2HD   PRO1111           HD1      PRO1111  22.160   8.426  -3.069
   59    HA   PRO1112           HA       PRO1112  18.497   2.625  -2.305
   60   1HB   PRO1112           HB2      PRO1112  16.896   1.982  -0.256
   61   2HB   PRO1112           HB1      PRO1112  18.647   2.106  -0.055
   62   1HG   PRO1112           HG2      PRO1112  16.519   4.114   0.610
   63   2HG   PRO1112           HG1      PRO1112  17.903   3.594   1.589
   64   1HD   PRO1112           HD2      PRO1112  17.904   5.881   0.109
   65   2HD   PRO1112           HD1      PRO1112  19.375   4.946   0.449
   66    HA   PRO1113           HA       PRO1113  14.836   3.980  -4.658
   67   1HB   PRO1113           HB2      PRO1113  14.974   1.049  -5.245
   68   2HB   PRO1113           HB1      PRO1113  14.700   2.404  -6.348
   69   1HG   PRO1113           HG2      PRO1113  17.081   1.220  -6.223
   70   2HG   PRO1113           HG1      PRO1113  16.948   2.979  -6.407
   71   1HD   PRO1113           HD2      PRO1113  17.705   1.374  -4.018
   72   2HD   PRO1113           HD1      PRO1113  18.236   2.995  -4.506
   73    HA   PRO1114           HA       PRO1114  11.816   2.378  -1.757
   74   1HB   PRO1114           HB2      PRO1114   9.913   4.124  -2.220
   75   2HB   PRO1114           HB1      PRO1114  11.479   4.702  -1.629
   76   1HG   PRO1114           HG2      PRO1114  10.417   4.657  -4.441
   77   2HG   PRO1114           HG1      PRO1114  11.214   5.990  -3.582
   78   1HD   PRO1114           HD2      PRO1114  12.485   4.232  -5.304
   79   2HD   PRO1114           HD1      PRO1114  13.302   5.166  -4.033
   80    H    ILE1115           HN       ILE1115   9.496   1.724  -1.798
   81    HA   ILE1115           HA       ILE1115   8.889   0.187  -4.196
   82    HB   ILE1115           HB       ILE1115   6.895  -0.041  -2.130
   83   1HG1  ILE1115          2HG1      ILE1115   9.719  -0.653  -1.229
   84   2HG1  ILE1115          1HG1      ILE1115   8.773   0.721  -0.666
   85   1HG2  ILE1115          2HG2      ILE1115   8.923  -1.933  -3.282
   86   2HG2  ILE1115          1HG2      ILE1115   7.601  -2.413  -2.218
   87   3HG2  ILE1115          3HG2      ILE1115   7.252  -1.715  -3.799
   88   1HD1  ILE1115          3HD1      ILE1115   7.113  -0.817   0.264
   89   2HD1  ILE1115          2HD1      ILE1115   8.092  -2.182  -0.271
   90   3HD1  ILE1115          1HD1      ILE1115   8.718  -1.072   0.950
   91    H    ASP1116           HN       ASP1116   6.246   0.015  -4.332
   92    HA   ASP1116           HA       ASP1116   5.420   2.499  -5.409
   93   1HB   ASP1116           HB2      ASP1116   3.754   0.078  -4.665
   94   2HB   ASP1116           HB1      ASP1116   3.209   1.420  -5.669
   95    H    ASN1117           HN       ASN1117   5.634   4.045  -3.797
   96    HA   ASN1117           HA       ASN1117   4.829   5.445  -2.191
   97   1HB   ASN1117           HB2      ASN1117   2.586   3.429  -1.928
   98   2HB   ASN1117           HB1      ASN1117   2.630   5.002  -1.139
   99   1HD2  ASN1117          1HD2      ASN1117   2.252   3.309  -4.143
  100   2HD2  ASN1117          2HD2      ASN1117   1.638   4.644  -5.052
  101    H    GLY1118           HN       GLY1118   6.332   2.726  -1.817
  102   1HA   GLY1118           HA1      GLY1118   6.860   1.324   0.030
  103   2HA   GLY1118           HA2      GLY1118   6.006   2.441   1.086
  104    H    ASP1119           HN       ASP1119   8.591   1.419   1.622
  105    HA   ASP1119           HA       ASP1119  10.788   2.882   0.914
  106   1HB   ASP1119           HB2      ASP1119  10.934   4.615   2.732
  107   2HB   ASP1119           HB1      ASP1119   9.739   4.959   1.489
  108    H    ILE1120           HN       ILE1120  12.325   3.244   2.987
  109    HA   ILE1120           HA       ILE1120  12.687   0.645   4.046
  110    HB   ILE1120           HB       ILE1120  14.061   2.720   5.558
  111   1HG1  ILE1120          2HG1      ILE1120  14.401   2.658   2.547
  112   2HG1  ILE1120          1HG1      ILE1120  13.772   4.009   3.487
  113   1HG2  ILE1120          3HG2      ILE1120  14.963   0.485   3.754
  114   2HG2  ILE1120          2HG2      ILE1120  16.012   1.415   4.826
  115   3HG2  ILE1120          1HG2      ILE1120  14.741   0.395   5.502
  116   1HD1  ILE1120          2HD1      ILE1120  16.563   2.899   3.648
  117   2HD1  ILE1120          1HD1      ILE1120  16.075   4.387   2.836
  118   3HD1  ILE1120          3HD1      ILE1120  15.933   4.252   4.589
  119    H    THR1121           HN       THR1121  12.659  -0.006   6.264
  120    HA   THR1121           HA       THR1121  10.282   0.771   7.606
  121    HB   THR1121           HB       THR1121  10.965  -0.802   9.358
  122    HG1  THR1121           HG1      THR1121  13.434  -0.512   8.081
  123   1HG2  THR1121          1HG2      THR1121  11.474  -1.825   6.560
  124   2HG2  THR1121          3HG2      THR1121  11.100  -2.825   7.965
  125   3HG2  THR1121          2HG2      THR1121   9.901  -1.689   7.348
  126    H    SER1122           HN       SER1122  13.064   2.438   7.395
  127    HA   SER1122           HA       SER1122  12.713   3.600  10.080
  128   1HB   SER1122           HB2      SER1122  14.841   2.368   9.966
  129   2HB   SER1122           HB1      SER1122  15.319   3.323   8.563
  130    HG   SER1122           HG       SER1122  14.568   4.681  10.884
  131    H    PHE1123           HN       PHE1123  14.924   4.761   7.633
  132    HA   PHE1123           HA       PHE1123  13.132   6.778   6.629
  133   1HB   PHE1123           HB2      PHE1123  13.852   7.680   8.848
  134   2HB   PHE1123           HB1      PHE1123  15.516   7.643   8.277
  135    HD1  PHE1123           HD1      PHE1123  12.213   9.199   7.756
  136    HD2  PHE1123           HD2      PHE1123  16.378   9.348   6.890
  137    HE1  PHE1123           HE1      PHE1123  11.928  11.446   6.795
  138    HE2  PHE1123           HE2      PHE1123  16.101  11.595   5.928
  139    HZ   PHE1123           HZ       PHE1123  13.874  12.647   5.879
  140    HA   PRO1124           HA       PRO1124  15.749   6.108   3.110
  141   1HB   PRO1124           HB2      PRO1124  15.343   8.594   1.929
  142   2HB   PRO1124           HB1      PRO1124  14.315   7.176   1.710
  143   1HG   PRO1124           HG2      PRO1124  13.958   9.517   3.529
  144   2HG   PRO1124           HG1      PRO1124  12.743   8.619   2.600
  145   1HD   PRO1124           HD2      PRO1124  13.028   8.247   5.234
  146   2HD   PRO1124           HD1      PRO1124  12.658   6.889   4.149
  147    H    LEU1125           HN       LEU1125  17.861   6.412   2.678
  148    HA   LEU1125           HA       LEU1125  19.195   8.702   3.961
  149   1HB   LEU1125           HB2      LEU1125  20.449   6.021   3.334
  150   2HB   LEU1125           HB1      LEU1125  21.168   7.348   4.228
  151    HG   LEU1125           HG       LEU1125  19.232   7.001   5.906
  152   1HD1  LEU1125          1HD1      LEU1125  19.167   4.377   4.425
  153   2HD1  LEU1125          3HD1      LEU1125  18.434   4.662   6.001
  154   3HD1  LEU1125          2HD1      LEU1125  17.842   5.531   4.583
  155   1HD2  LEU1125          2HD2      LEU1125  21.570   6.510   6.384
  156   2HD2  LEU1125          1HD2      LEU1125  20.511   5.287   7.087
  157   3HD2  LEU1125          3HD2      LEU1125  21.406   4.934   5.609
  158    H    SER1126           HN       SER1126  20.822   9.773   2.820
  159    HA   SER1126           HA       SER1126  20.499   9.688  -0.047
  160   1HB   SER1126           HB2      SER1126  22.305  11.416   1.660
  161   2HB   SER1126           HB1      SER1126  21.985  11.645  -0.059
  162    HG   SER1126           HG       SER1126  20.643  12.685   1.886
  163    H    VAL1127           HN       VAL1127  23.203   9.273   2.226
  164    HA   VAL1127           HA       VAL1127  24.675   7.896   0.083
  165    HB   VAL1127           HB       VAL1127  25.860   9.849   0.984
  166   1HG1  VAL1127          2HG1      VAL1127  25.768   8.375   3.613
  167   2HG1  VAL1127          1HG1      VAL1127  26.701   9.837   3.290
  168   3HG1  VAL1127          3HG1      VAL1127  24.938   9.884   3.230
  169   1HG2  VAL1127          1HG2      VAL1127  27.155   7.966   0.149
  170   2HG2  VAL1127          3HG2      VAL1127  27.983   8.739   1.500
  171   3HG2  VAL1127          2HG2      VAL1127  27.125   7.219   1.746
  172    H    TYR1128           HN       TYR1128  24.947   5.778   0.245
  173    HA   TYR1128           HA       TYR1128  24.441   4.518   2.857
  174   1HB   TYR1128           HB2      TYR1128  23.359   4.005   0.241
  175   2HB   TYR1128           HB1      TYR1128  24.197   2.576   0.836
  176    HD1  TYR1128           HD1      TYR1128  23.585   1.774   3.213
  177    HD2  TYR1128           HD2      TYR1128  21.195   4.458   0.941
  178    HE1  TYR1128           HE1      TYR1128  21.637   1.202   4.601
  179    HE2  TYR1128           HE2      TYR1128  19.242   3.900   2.320
  180    HH   TYR1128           HH       TYR1128  18.467   2.054   3.753
  181    H    ALA1129           HN       ALA1129  25.476   2.385   3.136
  182    HA   ALA1129           HA       ALA1129  28.291   2.576   2.403
  183   1HB   ALA1129           HB3      ALA1129  27.689   2.176   4.751
  184   2HB   ALA1129           HB2      ALA1129  26.921   0.658   4.286
  185   3HB   ALA1129           HB1      ALA1129  28.662   0.864   4.085
  186    HA   PRO1130           HA       PRO1130  28.044  -0.507  -0.742
  187   1HB   PRO1130           HB2      PRO1130  30.566  -1.510  -0.665
  188   2HB   PRO1130           HB1      PRO1130  30.177   0.075  -1.340
  189   1HG   PRO1130           HG2      PRO1130  31.302  -0.622   1.341
  190   2HG   PRO1130           HG1      PRO1130  31.734   0.712   0.256
  191   1HD   PRO1130           HD2      PRO1130  30.129   1.019   2.434
  192   2HD   PRO1130           HD1      PRO1130  29.994   2.026   0.980
  193    H    ALA1131           HN       ALA1131  27.632  -2.655  -1.017
  194    HA   ALA1131           HA       ALA1131  27.140  -4.810  -0.494
  195   1HB   ALA1131           HB2      ALA1131  29.566  -4.998  -0.215
  196   2HB   ALA1131           HB3      ALA1131  28.699  -6.044   0.908
  197   3HB   ALA1131           HB1      ALA1131  29.405  -4.532   1.478
  198    H    SER1132           HN       SER1132  25.629  -2.780   0.783
  199    HA   SER1132           HA       SER1132  25.039  -4.057   3.377
  200   1HB   SER1132           HB2      SER1132  24.129  -1.926   4.134
  201   2HB   SER1132           HB1      SER1132  25.788  -1.703   3.577
  202    HG   SER1132           HG       SER1132  24.493  -0.077   2.728
  203    H    SER1133           HN       SER1133  22.740  -3.929   4.049
  204    HA   SER1133           HA       SER1133  20.804  -3.745   1.878
  205   1HB   SER1133           HB2      SER1133  20.640  -6.207   3.566
  206   2HB   SER1133           HB1      SER1133  20.082  -5.934   1.917
  207    HG   SER1133           HG       SER1133  21.960  -7.305   2.091
  208    H    VAL1134           HN       VAL1134  18.598  -3.639   2.631
  209    HA   VAL1134           HA       VAL1134  18.236  -3.346   5.516
  210    HB   VAL1134           HB       VAL1134  16.975  -1.205   5.173
  211   1HG1  VAL1134          2HG1      VAL1134  19.925  -1.177   4.560
  212   2HG1  VAL1134          1HG1      VAL1134  18.985   0.201   5.133
  213   3HG1  VAL1134          3HG1      VAL1134  19.186  -1.219   6.161
  214   1HG2  VAL1134          3HG2      VAL1134  18.355  -1.271   2.494
  215   2HG2  VAL1134          2HG2      VAL1134  16.617  -1.349   2.784
  216   3HG2  VAL1134          1HG2      VAL1134  17.510   0.120   3.173
  217    H    GLU1135           HN       GLU1135  15.895  -2.859   6.025
  218    HA   GLU1135           HA       GLU1135  14.193  -4.547   4.338
  219   1HB   GLU1135           HB2      GLU1135  13.963  -3.807   7.261
  220   2HB   GLU1135           HB1      GLU1135  12.826  -4.816   6.386
  221   1HG   GLU1135           HG2      GLU1135  14.564  -6.470   5.993
  222   2HG   GLU1135           HG1      GLU1135  15.731  -5.449   6.831
  223    H    TYR1136           HN       TYR1136  12.201  -3.837   3.666
  224    HA   TYR1136           HA       TYR1136  11.693  -0.967   4.056
  225   1HB   TYR1136           HB2      TYR1136  11.371  -2.784   1.719
  226   2HB   TYR1136           HB1      TYR1136  10.220  -1.464   1.898
  227    HD1  TYR1136           HD1      TYR1136  10.765   0.078   0.262
  228    HD2  TYR1136           HD2      TYR1136  13.875  -1.575   2.647
  229    HE1  TYR1136           HE1      TYR1136  12.367   1.635  -0.757
  230    HE2  TYR1136           HE2      TYR1136  15.486  -0.019   1.633
  231    HH   TYR1136           HH       TYR1136  15.700   1.292  -0.473
  232    H    GLN1137           HN       GLN1137   9.225  -0.602   3.342
  233    HA   GLN1137           HA       GLN1137   7.257  -2.415   4.138
  234   1HB   GLN1137           HB2      GLN1137   8.361  -2.085   6.369
  235   2HB   GLN1137           HB1      GLN1137   7.914  -0.387   6.285
  236   1HG   GLN1137           HG2      GLN1137   5.555  -1.005   6.234
  237   2HG   GLN1137           HG1      GLN1137   6.000  -2.709   6.311
  238   1HE2  GLN1137          1HE2      GLN1137   7.696  -0.216   8.062
  239   2HE2  GLN1137          2HE2      GLN1137   7.174  -0.694   9.639
  240    H    CYS1138           HN       CYS1138   5.114  -1.286   4.476
  241    HA   CYS1138           HA       CYS1138   5.036   1.091   2.763
  242   1HB   CYS1138           HB2      CYS1138   2.931  -0.934   3.522
  243   2HB   CYS1138           HB1      CYS1138   2.563   0.546   2.643
  244    H    GLN1139           HN       GLN1139   4.048   2.979   3.373
  245    HA   GLN1139           HA       GLN1139   4.107   3.719   6.060
  246   1HB   GLN1139           HB2      GLN1139   2.557   4.994   3.798
  247   2HB   GLN1139           HB1      GLN1139   2.905   5.753   5.344
  248   1HG   GLN1139           HG2      GLN1139   5.294   5.649   4.865
  249   2HG   GLN1139           HG1      GLN1139   4.951   4.876   3.318
  250   1HE2  GLN1139          1HE2      GLN1139   4.052   6.086   1.652
  251   2HE2  GLN1139          2HE2      GLN1139   4.057   7.814   1.665
  252    H    ASN1140           HN       ASN1140   2.077   4.791   7.121
  253    HA   ASN1140           HA       ASN1140   0.394   2.811   8.029
  254   1HB   ASN1140           HB2      ASN1140  -1.046   4.629   8.888
  255   2HB   ASN1140           HB1      ASN1140   0.662   4.930   9.199
  256   1HD2  ASN1140          1HD2      ASN1140  -2.134   5.878   7.372
  257   2HD2  ASN1140          2HD2      ASN1140  -1.500   7.379   6.797
  258    H    LEU1141           HN       LEU1141  -1.758   2.248   7.650
  259    HA   LEU1141           HA       LEU1141  -3.684   1.895   6.492
  260   1HB   LEU1141           HB2      LEU1141  -2.782   4.231   4.809
  261   2HB   LEU1141           HB1      LEU1141  -4.338   3.436   4.662
  262    HG   LEU1141           HG       LEU1141  -3.367   4.867   7.140
  263   1HD1  LEU1141          3HD1      LEU1141  -3.725   6.422   5.298
  264   2HD1  LEU1141          2HD1      LEU1141  -5.332   5.746   5.029
  265   3HD1  LEU1141          1HD1      LEU1141  -4.975   6.602   6.529
  266   1HD2  LEU1141          1HD2      LEU1141  -4.954   3.070   7.607
  267   2HD2  LEU1141          3HD2      LEU1141  -5.681   4.654   7.882
  268   3HD2  LEU1141          2HD2      LEU1141  -6.073   3.745   6.422
  269    H    TYR1142           HN       TYR1142  -0.677   2.221   4.728
  270    HA   TYR1142           HA       TYR1142  -1.650   0.487   2.591
  271   1HB   TYR1142           HB2      TYR1142   0.990   1.912   2.984
  272   2HB   TYR1142           HB1      TYR1142   0.626   0.877   1.608
  273    HD1  TYR1142           HD1      TYR1142  -0.663   3.901   3.375
  274    HD2  TYR1142           HD2      TYR1142  -0.272   1.815  -0.311
  275    HE1  TYR1142           HE1      TYR1142  -1.630   5.826   2.191
  276    HE2  TYR1142           HE2      TYR1142  -1.237   3.734  -1.506
  277    HH   TYR1142           HH       TYR1142  -2.684   5.662  -1.030
  278    H    GLN1143           HN       GLN1143  -0.765  -1.533   2.111
  279    HA   GLN1143           HA       GLN1143   0.785  -2.749   4.303
  280   1HB   GLN1143           HB2      GLN1143  -1.460  -3.815   2.634
  281   2HB   GLN1143           HB1      GLN1143  -0.271  -4.927   3.300
  282   1HG   GLN1143           HG2      GLN1143  -1.967  -3.003   4.876
  283   2HG   GLN1143           HG1      GLN1143  -2.234  -4.740   4.726
  284   1HE2  GLN1143          1HE2      GLN1143   0.626  -5.336   4.826
  285   2HE2  GLN1143          2HE2      GLN1143   1.095  -5.143   6.477
  286    H    LEU1144           HN       LEU1144   2.297  -4.426   3.721
  287    HA   LEU1144           HA       LEU1144   3.576  -3.837   1.158
  288   1HB   LEU1144           HB2      LEU1144   4.924  -3.656   3.192
  289   2HB   LEU1144           HB1      LEU1144   4.593  -5.335   3.572
  290    HG   LEU1144           HG       LEU1144   5.741  -5.917   1.378
  291   1HD1  LEU1144          3HD1      LEU1144   6.652  -3.055   1.618
  292   2HD1  LEU1144          2HD1      LEU1144   7.304  -4.255   0.501
  293   3HD1  LEU1144          1HD1      LEU1144   5.631  -3.722   0.343
  294   1HD2  LEU1144          1HD2      LEU1144   7.325  -4.611   3.579
  295   2HD2  LEU1144          3HD2      LEU1144   6.800  -6.293   3.514
  296   3HD2  LEU1144          2HD2      LEU1144   7.984  -5.693   2.352
  297    H    GLU1145           HN       GLU1145   4.617  -5.632  -0.012
  298    HA   GLU1145           HA       GLU1145   3.675  -8.309   0.344
  299   1HB   GLU1145           HB2      GLU1145   1.683  -7.256  -0.682
  300   2HB   GLU1145           HB1      GLU1145   2.667  -6.764  -2.054
  301   1HG   GLU1145           HG2      GLU1145   2.438  -9.642  -1.268
  302   2HG   GLU1145           HG1      GLU1145   1.211  -8.864  -2.268
  303    H    GLY1146           HN       GLY1146   5.570  -9.291   0.016
  304   1HA   GLY1146           HA1      GLY1146   7.172  -8.464  -2.326
  305   2HA   GLY1146           HA2      GLY1146   6.889 -10.156  -1.950
  306    H    ASN1147           HN       ASN1147   9.382  -8.483  -2.140
  307    HA   ASN1147           HA       ASN1147  10.483  -9.226   0.490
  308   1HB   ASN1147           HB2      ASN1147  11.316 -10.370  -1.674
  309   2HB   ASN1147           HB1      ASN1147  12.122  -8.836  -1.993
  310   1HD2  ASN1147          1HD2      ASN1147  13.929  -8.290  -0.905
  311   2HD2  ASN1147          2HD2      ASN1147  14.718  -9.334   0.225
  312    H    LYS1148           HN       LYS1148  10.124  -7.273   1.535
  313    HA   LYS1148           HA       LYS1148  10.767  -4.718   0.512
  314   1HB   LYS1148           HB2      LYS1148  10.781  -4.083   2.969
  315   2HB   LYS1148           HB1      LYS1148   9.302  -4.807   2.355
  316   1HG   LYS1148           HG2      LYS1148   9.695  -5.777   4.466
  317   2HG   LYS1148           HG1      LYS1148  10.129  -7.002   3.274
  318   1HD   LYS1148           HD2      LYS1148  12.493  -6.414   3.533
  319   2HD   LYS1148           HD1      LYS1148  12.060  -5.194   4.733
  320   1HE   LYS1148           HE2      LYS1148  11.571  -8.162   4.966
  321   2HE   LYS1148           HE1      LYS1148  12.836  -7.256   5.793
  322   1HZ   LYS1148           HZ3      LYS1148  11.130  -5.986   6.939
  323   2HZ   LYS1148           HZ2      LYS1148   9.915  -6.857   6.148
  324   3HZ   LYS1148           HZ1      LYS1148  10.944  -7.642   7.237
  325    H    ARG1149           HN       ARG1149  12.810  -7.233   1.090
  326    HA   ARG1149           HA       ARG1149  14.976  -5.645   2.223
  327   1HB   ARG1149           HB2      ARG1149  14.658  -7.940   3.026
  328   2HB   ARG1149           HB1      ARG1149  14.906  -8.552   1.397
  329   1HG   ARG1149           HG2      ARG1149  16.963  -8.888   2.389
  330   2HG   ARG1149           HG1      ARG1149  17.189  -7.356   1.546
  331   1HD   ARG1149           HD2      ARG1149  16.827  -6.125   3.588
  332   2HD   ARG1149           HD1      ARG1149  16.450  -7.612   4.456
  333    HE   ARG1149           HE       ARG1149  19.042  -7.706   3.281
  334   1HH1  ARG1149          1HH1      ARG1149  17.245  -6.433   5.981
  335   2HH1  ARG1149          2HH1      ARG1149  18.622  -6.357   7.029
  336   1HH2  ARG1149          1HH2      ARG1149  20.861  -7.610   4.654
  337   2HH2  ARG1149          2HH2      ARG1149  20.677  -7.026   6.275
  338    H    ILE1150           HN       ILE1150  16.578  -4.786   1.097
  339    HA   ILE1150           HA       ILE1150  17.052  -5.687  -1.654
  340    HB   ILE1150           HB       ILE1150  17.275  -3.366  -2.421
  341   1HG1  ILE1150          2HG1      ILE1150  16.029  -2.598   0.226
  342   2HG1  ILE1150          1HG1      ILE1150  17.735  -2.389  -0.158
  343   1HG2  ILE1150          2HG2      ILE1150  14.590  -4.033  -1.227
  344   2HG2  ILE1150          1HG2      ILE1150  14.876  -2.841  -2.496
  345   3HG2  ILE1150          3HG2      ILE1150  15.195  -4.549  -2.801
  346   1HD1  ILE1150          2HD1      ILE1150  17.141  -0.875  -1.973
  347   2HD1  ILE1150          1HD1      ILE1150  15.433  -1.084  -1.588
  348   3HD1  ILE1150          3HD1      ILE1150  16.511  -0.313  -0.425
  349    H    THR1151           HN       THR1151  19.178  -5.124  -2.452
  350    HA   THR1151           HA       THR1151  21.114  -4.306  -0.412
  351    HB   THR1151           HB       THR1151  21.474  -6.767  -2.131
  352    HG1  THR1151           HG1      THR1151  20.156  -6.475   0.161
  353   1HG2  THR1151          1HG2      THR1151  23.569  -5.608  -1.629
  354   2HG2  THR1151          3HG2      THR1151  23.172  -5.623   0.090
  355   3HG2  THR1151          2HG2      THR1151  23.470  -7.140  -0.759
  356    H    CYS1152           HN       CYS1152  22.351  -2.740  -1.207
  357    HA   CYS1152           HA       CYS1152  22.378  -2.105  -3.984
  358   1HB   CYS1152           HB2      CYS1152  23.894  -0.289  -3.344
  359   2HB   CYS1152           HB1      CYS1152  22.493  -0.355  -2.284
  360    H    ARG1153           HN       ARG1153  23.620  -2.948  -5.481
  361    HA   ARG1153           HA       ARG1153  25.936  -4.529  -4.787
  362   1HB   ARG1153           HB2      ARG1153  26.091  -4.870  -7.273
  363   2HB   ARG1153           HB1      ARG1153  24.588  -5.419  -6.545
  364   1HG   ARG1153           HG2      ARG1153  24.723  -2.678  -7.707
  365   2HG   ARG1153           HG1      ARG1153  24.571  -4.069  -8.780
  366   1HD   ARG1153           HD2      ARG1153  22.721  -3.463  -6.474
  367   2HD   ARG1153           HD1      ARG1153  22.395  -3.055  -8.157
  368    HE   ARG1153           HE       ARG1153  22.764  -5.642  -8.414
  369   1HH1  ARG1153          1HH1      ARG1153  21.064  -3.942  -5.896
  370   2HH1  ARG1153          2HH1      ARG1153  19.965  -5.243  -5.584
  371   1HH2  ARG1153          1HH2      ARG1153  21.320  -7.358  -8.014
  372   2HH2  ARG1153          2HH2      ARG1153  20.107  -7.185  -6.789
  373    H    ASN1154           HN       ASN1154  27.741  -3.483  -4.312
  374    HA   ASN1154           HA       ASN1154  29.478  -2.025  -4.382
  375   1HB   ASN1154           HB2      ASN1154  28.645  -1.731  -7.275
  376   2HB   ASN1154           HB1      ASN1154  30.171  -1.171  -6.597
  377   1HD2  ASN1154          1HD2      ASN1154  28.290  -3.934  -7.534
  378   2HD2  ASN1154          2HD2      ASN1154  29.581  -5.081  -7.493
  379    H    GLY1155           HN       GLY1155  27.899  -0.148  -6.851
  380   1HA   GLY1155           HA1      GLY1155  27.984   2.293  -6.358
  381   2HA   GLY1155           HA2      GLY1155  27.255   1.873  -4.823
  382    H    GLN1156           HN       GLN1156  25.288   0.044  -5.701
  383    HA   GLN1156           HA       GLN1156  23.267   1.860  -6.552
  384   1HB   GLN1156           HB2      GLN1156  24.326   1.479  -8.735
  385   2HB   GLN1156           HB1      GLN1156  24.113  -0.256  -8.540
  386   1HG   GLN1156           HG2      GLN1156  22.431   0.650 -10.019
  387   2HG   GLN1156           HG1      GLN1156  21.690   0.040  -8.541
  388   1HE2  GLN1156          1HE2      GLN1156  22.491   2.866 -10.394
  389   2HE2  GLN1156          2HE2      GLN1156  21.493   3.972  -9.518
  390    H    TRP1157           HN       TRP1157  21.320   1.149  -5.850
  391    HA   TRP1157           HA       TRP1157  21.197  -1.422  -4.528
  392   1HB   TRP1157           HB2      TRP1157  19.280   0.887  -4.745
  393   2HB   TRP1157           HB1      TRP1157  18.858  -0.620  -3.942
  394    HD1  TRP1157           HD1      TRP1157  21.054   2.461  -3.544
  395    HE1  TRP1157           HE1      TRP1157  21.785   2.621  -1.081
  396    HE3  TRP1157           HE3      TRP1157  19.330  -2.048  -1.914
  397    HZ2  TRP1157           HZ2      TRP1157  21.667   1.008   1.249
  398    HZ3  TRP1157           HZ3      TRP1157  19.682  -2.676   0.436
  399    HH2  TRP1157           HH2      TRP1157  20.825  -1.184   1.981
  400    H    SER1158           HN       SER1158  18.670  -2.147  -4.637
  401    HA   SER1158           HA       SER1158  18.188  -2.944  -7.428
  402   1HB   SER1158           HB2      SER1158  16.981  -4.881  -6.466
  403   2HB   SER1158           HB1      SER1158  18.664  -4.833  -5.941
  404    HG   SER1158           HG       SER1158  17.088  -5.240  -4.250
  405    H    GLU1159           HN       GLU1159  15.549  -3.960  -6.680
  406    HA   GLU1159           HA       GLU1159  14.117  -1.420  -6.275
  407   1HB   GLU1159           HB2      GLU1159  14.202  -2.325  -8.655
  408   2HB   GLU1159           HB1      GLU1159  13.184  -3.636  -8.084
  409   1HG   GLU1159           HG2      GLU1159  11.468  -2.031  -7.429
  410   2HG   GLU1159           HG1      GLU1159  12.487  -0.708  -7.994
  411    HA   PRO1160           HA       PRO1160  12.338  -3.667  -2.802
  412   1HB   PRO1160           HB2      PRO1160  10.286  -1.531  -3.237
  413   2HB   PRO1160           HB1      PRO1160  11.030  -2.085  -1.730
  414   1HG   PRO1160           HG2      PRO1160  11.837   0.174  -2.821
  415   2HG   PRO1160           HG1      PRO1160  13.029  -0.967  -2.165
  416   1HD   PRO1160           HD2      PRO1160  12.274  -0.426  -5.015
  417   2HD   PRO1160           HD1      PRO1160  13.875  -0.753  -4.315
  418    HA   PRO1161           HA       PRO1161   9.080  -6.129  -4.462
  419   1HB   PRO1161           HB2      PRO1161   7.301  -6.420  -2.457
  420   2HB   PRO1161           HB1      PRO1161   8.918  -7.132  -2.396
  421   1HG   PRO1161           HG2      PRO1161   7.913  -4.604  -1.138
  422   2HG   PRO1161           HG1      PRO1161   8.931  -5.874  -0.433
  423   1HD   PRO1161           HD2      PRO1161   9.939  -3.547  -1.400
  424   2HD   PRO1161           HD1      PRO1161  10.840  -5.075  -1.439
  425    H    LYS1162           HN       LYS1162   6.326  -5.499  -2.917
  426    HA   LYS1162           HA       LYS1162   5.477  -3.282  -4.618
  427   1HB   LYS1162           HB2      LYS1162   4.455  -6.087  -4.623
  428   2HB   LYS1162           HB1      LYS1162   3.338  -4.772  -4.925
  429   1HG   LYS1162           HG2      LYS1162   4.713  -4.026  -6.803
  430   2HG   LYS1162           HG1      LYS1162   5.844  -5.344  -6.488
  431   1HD   LYS1162           HD2      LYS1162   4.387  -5.983  -8.294
  432   2HD   LYS1162           HD1      LYS1162   3.997  -6.955  -6.874
  433   1HE   LYS1162           HE2      LYS1162   2.113  -5.473  -6.379
  434   2HE   LYS1162           HE1      LYS1162   2.501  -4.506  -7.801
  435   1HZ   LYS1162           HZ1      LYS1162   2.079  -6.444  -9.185
  436   2HZ   LYS1162           HZ3      LYS1162   1.695  -7.364  -7.818
  437   3HZ   LYS1162           HZ2      LYS1162   0.717  -6.058  -8.261
  438    H    CYS1163           HN       CYS1163   3.488  -2.290  -3.940
  439    HA   CYS1163           HA       CYS1163   2.803  -2.841  -1.129
  440   1HB   CYS1163           HB2      CYS1163   4.086  -0.674  -1.660
  441   2HB   CYS1163           HB1      CYS1163   2.589  -0.126  -2.411
  442    H    LEU1164           HN       LEU1164   0.641  -2.640  -0.523
  443    HA   LEU1164           HA       LEU1164  -1.265  -2.587  -2.764
  444   1HB   LEU1164           HB2      LEU1164  -1.220  -4.143  -0.203
  445   2HB   LEU1164           HB1      LEU1164  -2.740  -3.826  -1.012
  446    HG   LEU1164           HG       LEU1164  -1.874  -6.038  -1.578
  447   1HD1  LEU1164          2HD1      LEU1164  -1.771  -4.106  -3.890
  448   2HD1  LEU1164          1HD1      LEU1164  -1.989  -5.852  -4.014
  449   3HD1  LEU1164          3HD1      LEU1164  -3.220  -4.863  -3.227
  450   1HD2  LEU1164          2HD2      LEU1164   0.505  -5.591  -1.313
  451   2HD2  LEU1164          1HD2      LEU1164   0.164  -6.287  -2.897
  452   3HD2  LEU1164          3HD2      LEU1164   0.479  -4.559  -2.743
  453    H    HIS1165           HN       HIS1165  -2.407  -0.791  -2.863
  454    HA   HIS1165           HA       HIS1165  -2.535   1.183  -0.903
  455   1HB   HIS1165           HB2      HIS1165  -4.541   0.665  -3.108
  456   2HB   HIS1165           HB1      HIS1165  -4.317   2.182  -2.246
  457    HD1  HIS1165           HD1      HIS1165  -2.924   0.133  -5.003
  458    HD2  HIS1165           HD2      HIS1165  -1.978   3.623  -2.957
  459    HE1  HIS1165           HE1      HIS1165  -1.163   1.270  -6.392
  460    HE2  HIS1165           HE2      HIS1165  -0.544   3.336  -5.089
  461    HA   PRO1166           HA       PRO1166  -5.413  -0.265   2.115
  462   1HB   PRO1166           HB2      PRO1166  -6.600   2.144   2.757
  463   2HB   PRO1166           HB1      PRO1166  -5.061   1.573   3.405
  464   1HG   PRO1166           HG2      PRO1166  -5.589   3.484   1.171
  465   2HG   PRO1166           HG1      PRO1166  -4.347   3.551   2.433
  466   1HD   PRO1166           HD2      PRO1166  -3.774   2.766  -0.068
  467   2HD   PRO1166           HD1      PRO1166  -2.980   2.034   1.341
  468    H    CYS1167           HN       CYS1167  -7.901   0.761   2.731
  469    HA   CYS1167           HA       CYS1167  -9.485  -0.319   0.593
  470   1HB   CYS1167           HB2      CYS1167  -9.873   0.364   3.397
  471   2HB   CYS1167           HB1      CYS1167 -11.245   0.836   2.400
  472    H    VAL1168           HN       VAL1168  -8.076   2.074  -0.114
  473    HA   VAL1168           HA       VAL1168  -9.689   4.372  -0.041
  474    HB   VAL1168           HB       VAL1168  -7.651   3.578  -2.128
  475   1HG1  VAL1168          3HG1      VAL1168  -8.877   6.268  -1.526
  476   2HG1  VAL1168          2HG1      VAL1168  -7.546   5.977  -2.647
  477   3HG1  VAL1168          1HG1      VAL1168  -9.142   5.301  -2.976
  478   1HG2  VAL1168          2HG2      VAL1168  -6.715   3.685   0.117
  479   2HG2  VAL1168          1HG2      VAL1168  -6.133   5.028  -0.867
  480   3HG2  VAL1168          3HG2      VAL1168  -7.394   5.298   0.336
  481    H    ILE1169           HN       ILE1169 -11.826   3.787  -0.499
  482    HA   ILE1169           HA       ILE1169 -12.350   2.909  -3.259
  483    HB   ILE1169           HB       ILE1169 -13.269   1.723  -1.080
  484   1HG1  ILE1169          2HG1      ILE1169 -14.914   2.216  -3.566
  485   2HG1  ILE1169          1HG1      ILE1169 -13.696   0.961  -3.349
  486   1HG2  ILE1169          2HG2      ILE1169 -14.342   3.795  -0.254
  487   2HG2  ILE1169          1HG2      ILE1169 -15.449   3.718  -1.624
  488   3HG2  ILE1169          3HG2      ILE1169 -15.448   2.431  -0.419
  489   1HD1  ILE1169          3HD1      ILE1169 -15.075  -0.048  -1.591
  490   2HD1  ILE1169          2HD1      ILE1169 -16.303   1.187  -1.865
  491   3HD1  ILE1169          1HD1      ILE1169 -15.914   0.031  -3.142
  492    H    SER1170           HN       SER1170 -14.937   3.748  -3.591
  493    HA   SER1170           HA       SER1170 -14.534   6.617  -3.915
  494   1HB   SER1170           HB2      SER1170 -15.247   5.321  -5.872
  495   2HB   SER1170           HB1      SER1170 -16.698   4.807  -5.011
  496    HG   SER1170           HG       SER1170 -16.063   7.284  -6.120
  497    H    ARG1171           HN       ARG1171 -15.482   8.109  -2.713
  498    HA   ARG1171           HA       ARG1171 -17.528   7.310  -0.768
  499   1HB   ARG1171           HB2      ARG1171 -17.018   9.454   0.320
  500   2HB   ARG1171           HB1      ARG1171 -15.570   8.481   0.106
  501   1HG   ARG1171           HG2      ARG1171 -14.937   9.818  -1.826
  502   2HG   ARG1171           HG1      ARG1171 -16.403  10.783  -1.647
  503   1HD   ARG1171           HD2      ARG1171 -15.650  11.506   0.569
  504   2HD   ARG1171           HD1      ARG1171 -14.180  10.551   0.377
  505    HE   ARG1171           HE       ARG1171 -14.258  12.233  -1.797
  506   1HH1  ARG1171          1HH1      ARG1171 -14.206  12.595   1.669
  507   2HH1  ARG1171          2HH1      ARG1171 -13.375  14.114   1.627
  508   1HH2  ARG1171          1HH2      ARG1171 -13.162  14.232  -1.861
  509   2HH2  ARG1171          2HH2      ARG1171 -12.782  15.044  -0.379
  510    H    GLU1172           HN       GLU1172 -16.923   9.628  -3.370
  511    HA   GLU1172           HA       GLU1172 -19.422  10.964  -3.143
  512   1HB   GLU1172           HB2      GLU1172 -17.345  11.860  -4.270
  513   2HB   GLU1172           HB1      GLU1172 -17.685  10.773  -5.608
  514   1HG   GLU1172           HG2      GLU1172 -18.477  12.985  -6.123
  515   2HG   GLU1172           HG1      GLU1172 -19.845  11.887  -5.947
  516    H    ILE1173           HN       ILE1173 -18.983   7.864  -3.742
  517    HA   ILE1173           HA       ILE1173 -21.277   7.711  -5.572
  518    HB   ILE1173           HB       ILE1173 -18.772   6.043  -5.599
  519   1HG1  ILE1173          2HG1      ILE1173 -18.851   8.139  -6.929
  520   2HG1  ILE1173          1HG1      ILE1173 -18.673   6.701  -7.930
  521   1HG2  ILE1173          3HG2      ILE1173 -21.407   5.430  -6.922
  522   2HG2  ILE1173          2HG2      ILE1173 -19.888   4.596  -7.250
  523   3HG2  ILE1173          1HG2      ILE1173 -20.624   4.493  -5.650
  524   1HD1  ILE1173          2HD1      ILE1173 -21.232   8.215  -7.461
  525   2HD1  ILE1173          1HD1      ILE1173 -20.228   8.293  -8.910
  526   3HD1  ILE1173          3HD1      ILE1173 -21.044   6.789  -8.482
  527    H    MET1174           HN       MET1174 -19.416   6.090  -3.022
  528    HA   MET1174           HA       MET1174 -21.408   4.138  -2.482
  529   1HB   MET1174           HB2      MET1174 -19.276   3.500  -1.797
  530   2HB   MET1174           HB1      MET1174 -18.916   5.073  -1.106
  531   1HG   MET1174           HG2      MET1174 -21.060   3.415   0.119
  532   2HG   MET1174           HG1      MET1174 -19.373   3.000   0.412
  533   1HE   MET1174           HE1      MET1174 -19.956   3.298   3.008
  534   2HE   MET1174           HE3      MET1174 -20.500   4.813   3.727
  535   3HE   MET1174           HE2      MET1174 -21.586   3.888   2.691
  536    H    GLU1175           HN       GLU1175 -20.349   7.047  -0.724
  537    HA   GLU1175           HA       GLU1175 -22.683   6.966   0.967
  538   1HB   GLU1175           HB2      GLU1175 -21.636   8.560   2.248
  539   2HB   GLU1175           HB1      GLU1175 -20.228   7.868   1.447
  540   1HG   GLU1175           HG2      GLU1175 -20.267   9.681  -0.189
  541   2HG   GLU1175           HG1      GLU1175 -21.672  10.378   0.616
  542    H    ASN1176           HN       ASN1176 -22.528   7.511  -2.113
  543    HA   ASN1176           HA       ASN1176 -24.142   9.962  -2.168
  544   1HB   ASN1176           HB2      ASN1176 -22.054   9.759  -3.587
  545   2HB   ASN1176           HB1      ASN1176 -22.933   8.550  -4.513
  546   1HD2  ASN1176          1HD2      ASN1176 -24.605   9.166  -5.845
  547   2HD2  ASN1176          2HD2      ASN1176 -24.903  10.816  -6.261
  548    H    TYR1177           HN       TYR1177 -23.998   6.844  -3.926
  549    HA   TYR1177           HA       TYR1177 -26.535   6.911  -5.016
  550   1HB   TYR1177           HB2      TYR1177 -24.914   4.540  -4.078
  551   2HB   TYR1177           HB1      TYR1177 -26.392   4.401  -5.023
  552    HD1  TYR1177           HD1      TYR1177 -25.212   7.203  -6.425
  553    HD2  TYR1177           HD2      TYR1177 -24.069   3.123  -6.049
  554    HE1  TYR1177           HE1      TYR1177 -23.905   7.384  -8.496
  555    HE2  TYR1177           HE2      TYR1177 -22.756   3.291  -8.116
  556    HH   TYR1177           HH       TYR1177 -22.690   4.679 -10.148
  557    H    ASN1178           HN       ASN1178 -25.692   4.846  -2.280
  558    HA   ASN1178           HA       ASN1178 -27.488   5.717  -0.414
  559   1HB   ASN1178           HB2      ASN1178 -29.253   3.819  -0.747
  560   2HB   ASN1178           HB1      ASN1178 -29.403   5.307  -1.677
  561   1HD2  ASN1178          1HD2      ASN1178 -28.208   2.003  -1.801
  562   2HD2  ASN1178          2HD2      ASN1178 -28.389   1.805  -3.506
  563    H    ILE1179           HN       ILE1179 -24.943   4.074  -1.101
  564    HA   ILE1179           HA       ILE1179 -25.525   1.769   0.606
  565    HB   ILE1179           HB       ILE1179 -23.209   0.994  -0.065
  566   1HG1  ILE1179          2HG1      ILE1179 -23.591   3.022  -2.270
  567   2HG1  ILE1179          1HG1      ILE1179 -22.490   3.245  -0.913
  568   1HG2  ILE1179          2HG2      ILE1179 -25.355   1.267  -2.164
  569   2HG2  ILE1179          1HG2      ILE1179 -24.019   0.117  -2.212
  570   3HG2  ILE1179          3HG2      ILE1179 -25.235   0.002  -0.941
  571   1HD1  ILE1179          1HD1      ILE1179 -22.348   0.989  -2.892
  572   2HD1  ILE1179          3HD1      ILE1179 -21.361   2.450  -2.941
  573   3HD1  ILE1179          2HD1      ILE1179 -21.208   1.326  -1.590
  574    H    ALA1180           HN       ALA1180 -24.947   1.695   2.622
  575    HA   ALA1180           HA       ALA1180 -23.260   3.802   3.731
  576   1HB   ALA1180           HB1      ALA1180 -25.407   3.440   4.792
  577   2HB   ALA1180           HB3      ALA1180 -25.016   1.739   5.067
  578   3HB   ALA1180           HB2      ALA1180 -24.111   3.003   5.906
  579    H    LEU1181           HN       LEU1181 -22.166   2.786   5.913
  580    HA   LEU1181           HA       LEU1181 -20.360   0.678   4.927
  581   1HB   LEU1181           HB2      LEU1181 -19.797   3.212   5.955
  582   2HB   LEU1181           HB1      LEU1181 -19.441   2.120   7.278
  583    HG   LEU1181           HG       LEU1181 -17.432   2.559   6.001
  584   1HD1  LEU1181          3HD1      LEU1181 -17.684   0.337   6.976
  585   2HD1  LEU1181          2HD1      LEU1181 -18.446  -0.232   5.491
  586   3HD1  LEU1181          1HD1      LEU1181 -16.758   0.279   5.478
  587   1HD2  LEU1181          2HD2      LEU1181 -18.934   1.457   3.634
  588   2HD2  LEU1181          1HD2      LEU1181 -18.447   3.135   3.869
  589   3HD2  LEU1181          3HD2      LEU1181 -17.223   1.882   3.662
  590    H    ARG1182           HN       ARG1182 -19.499  -0.800   6.631
  591    HA   ARG1182           HA       ARG1182 -21.599  -1.994   8.067
  592   1HB   ARG1182           HB2      ARG1182 -19.719  -3.320   9.162
  593   2HB   ARG1182           HB1      ARG1182 -19.856  -3.426   7.414
  594   1HG   ARG1182           HG2      ARG1182 -18.055  -1.775   7.186
  595   2HG   ARG1182           HG1      ARG1182 -17.901  -1.726   8.943
  596   1HD   ARG1182           HD2      ARG1182 -17.540  -4.186   7.237
  597   2HD   ARG1182           HD1      ARG1182 -16.229  -3.195   7.874
  598    HE   ARG1182           HE       ARG1182 -17.900  -4.027   9.983
  599   1HH1  ARG1182          1HH1      ARG1182 -15.533  -5.273   7.751
  600   2HH1  ARG1182          2HH1      ARG1182 -15.012  -6.540   8.810
  601   1HH2  ARG1182          1HH2      ARG1182 -17.221  -5.691  11.385
  602   2HH2  ARG1182          2HH2      ARG1182 -15.971  -6.778  10.876
  603    H    TRP1183           HN       TRP1183 -20.044   0.810   8.771
  604    HA   TRP1183           HA       TRP1183 -20.488   0.480  11.667
  605   1HB   TRP1183           HB2      TRP1183 -18.752   2.659  10.561
  606   2HB   TRP1183           HB1      TRP1183 -18.693   1.878  12.139
  607    HD1  TRP1183           HD1      TRP1183 -17.621   1.331   8.496
  608    HE1  TRP1183           HE1      TRP1183 -15.753  -0.438   8.453
  609    HE3  TRP1183           HE3      TRP1183 -17.695  -0.060  13.418
  610    HZ2  TRP1183           HZ2      TRP1183 -14.480  -2.179  10.250
  611    HZ3  TRP1183           HZ3      TRP1183 -16.114  -1.788  14.175
  612    HH2  TRP1183           HH2      TRP1183 -14.539  -2.826  12.623
  613    H    THR1184           HN       THR1184 -21.480   1.991   8.827
  614    HA   THR1184           HA       THR1184 -22.857   3.727   8.315
  615    HB   THR1184           HB       THR1184 -24.833   4.000   9.753
  616    HG1  THR1184           HG1      THR1184 -24.350   2.054  11.539
  617   1HG2  THR1184          2HG2      THR1184 -23.987   1.123   9.398
  618   2HG2  THR1184          1HG2      THR1184 -25.640   1.684   9.647
  619   3HG2  THR1184          3HG2      THR1184 -24.767   2.133   8.182
  620    H    ALA1185           HN       ALA1185 -21.142   5.286   8.449
  621    HA   ALA1185           HA       ALA1185 -21.696   7.321  10.455
  622   1HB   ALA1185           HB1      ALA1185 -19.358   7.595  11.077
  623   2HB   ALA1185           HB2      ALA1185 -18.912   6.237  10.044
  624   3HB   ALA1185           HB3      ALA1185 -19.922   5.971  11.465
  625    H    LYS1186           HN       LYS1186 -21.791   6.806   7.428
  626    HA   LYS1186           HA       LYS1186 -21.694   8.092   5.573
  627   1HB   LYS1186           HB2      LYS1186 -20.765  10.188   7.528
  628   2HB   LYS1186           HB1      LYS1186 -21.078  10.511   5.829
  629   1HG   LYS1186           HG2      LYS1186 -23.079   9.567   7.875
  630   2HG   LYS1186           HG1      LYS1186 -22.965  11.186   7.181
  631   1HD   LYS1186           HD2      LYS1186 -23.442  10.251   4.958
  632   2HD   LYS1186           HD1      LYS1186 -23.589   8.645   5.675
  633   1HE   LYS1186           HE2      LYS1186 -25.312  11.038   6.313
  634   2HE   LYS1186           HE1      LYS1186 -25.781   9.662   5.315
  635   1HZ   LYS1186           HZ3      LYS1186 -25.074   9.544   8.198
  636   2HZ   LYS1186           HZ2      LYS1186 -26.640   9.457   7.561
  637   3HZ   LYS1186           HZ1      LYS1186 -25.527   8.223   7.240
  638    H    GLN1187           HN       GLN1187 -20.268   7.308   4.242
  639    HA   GLN1187           HA       GLN1187 -18.350   7.183   3.010
  640   1HB   GLN1187           HB2      GLN1187 -17.883   9.530   3.559
  641   2HB   GLN1187           HB1      GLN1187 -17.174   9.039   5.089
  642   1HG   GLN1187           HG2      GLN1187 -15.480   7.740   3.779
  643   2HG   GLN1187           HG1      GLN1187 -16.125   8.503   2.327
  644   1HE2  GLN1187          1HE2      GLN1187 -14.330   8.970   5.258
  645   2HE2  GLN1187          2HE2      GLN1187 -13.713  10.538   4.874
  646    H    LYS1188           HN       LYS1188 -16.479   7.618   5.915
  647    HA   LYS1188           HA       LYS1188 -14.940   6.192   6.857
  648   1HB   LYS1188           HB2      LYS1188 -17.236   5.904   7.997
  649   2HB   LYS1188           HB1      LYS1188 -17.296   4.351   7.172
  650   1HG   LYS1188           HG2      LYS1188 -15.327   3.600   8.310
  651   2HG   LYS1188           HG1      LYS1188 -15.062   5.201   9.005
  652   1HD   LYS1188           HD2      LYS1188 -17.283   4.961  10.151
  653   2HD   LYS1188           HD1      LYS1188 -17.302   3.280   9.610
  654   1HE   LYS1188           HE2      LYS1188 -15.254   4.581  11.400
  655   2HE   LYS1188           HE1      LYS1188 -16.472   3.398  11.876
  656   1HZ   LYS1188           HZ1      LYS1188 -14.249   2.900   9.970
  657   2HZ   LYS1188           HZ3      LYS1188 -14.293   2.385  11.582
  658   3HZ   LYS1188           HZ2      LYS1188 -15.402   1.766  10.465
  659    H    LEU1189           HN       LEU1189 -15.078   5.833   4.008
  660    HA   LEU1189           HA       LEU1189 -14.894   2.956   3.573
  661   1HB   LEU1189           HB2      LEU1189 -14.237   3.944   1.205
  662   2HB   LEU1189           HB1      LEU1189 -15.897   3.743   1.727
  663    HG   LEU1189           HG       LEU1189 -14.946   6.324   2.546
  664   1HD1  LEU1189          3HD1      LEU1189 -14.679   5.708  -0.395
  665   2HD1  LEU1189          2HD1      LEU1189 -14.610   7.312   0.334
  666   3HD1  LEU1189          1HD1      LEU1189 -13.361   6.122   0.702
  667   1HD2  LEU1189          2HD2      LEU1189 -17.282   5.508   2.210
  668   2HD2  LEU1189          1HD2      LEU1189 -16.922   7.050   1.430
  669   3HD2  LEU1189          3HD2      LEU1189 -16.991   5.571   0.472
  670    H    TYR1190           HN       TYR1190 -12.910   4.404   5.236
  671    HA   TYR1190           HA       TYR1190 -10.514   3.855   3.612
  672   1HB   TYR1190           HB2      TYR1190 -11.018   5.909   5.749
  673   2HB   TYR1190           HB1      TYR1190  -9.383   5.403   5.339
  674    HD1  TYR1190           HD1      TYR1190 -12.213   5.832   2.956
  675    HD2  TYR1190           HD2      TYR1190  -8.528   7.392   4.423
  676    HE1  TYR1190           HE1      TYR1190 -12.167   7.456   1.112
  677    HE2  TYR1190           HE2      TYR1190  -8.477   9.016   2.580
  678    HH   TYR1190           HH       TYR1190 -11.161   9.637   0.599
  679    H    SER1191           HN       SER1191  -9.472   2.091   4.166
  680    HA   SER1191           HA       SER1191  -9.246   1.363   7.000
  681   1HB   SER1191           HB2      SER1191 -10.123  -0.463   4.757
  682   2HB   SER1191           HB1      SER1191  -9.536  -1.059   6.309
  683    HG   SER1191           HG       SER1191 -11.373   0.786   6.804
  684    H    ARG1192           HN       ARG1192  -7.731  -0.756   6.994
  685    HA   ARG1192           HA       ARG1192  -5.332   0.033   5.496
  686   1HB   ARG1192           HB2      ARG1192  -5.105   0.027   7.952
  687   2HB   ARG1192           HB1      ARG1192  -5.597  -1.661   7.992
  688   1HG   ARG1192           HG2      ARG1192  -3.609  -2.272   6.707
  689   2HG   ARG1192           HG1      ARG1192  -3.114  -0.579   6.675
  690   1HD   ARG1192           HD2      ARG1192  -1.921  -1.797   8.412
  691   2HD   ARG1192           HD1      ARG1192  -2.975  -0.570   9.114
  692    HE   ARG1192           HE       ARG1192  -4.399  -2.961   9.042
  693   1HH1  ARG1192          1HH1      ARG1192  -1.575  -1.644  10.602
  694   2HH1  ARG1192          2HH1      ARG1192  -1.733  -2.637  12.012
  695   1HH2  ARG1192          1HH2      ARG1192  -4.615  -4.272  10.895
  696   2HH2  ARG1192          2HH2      ARG1192  -3.460  -4.132  12.178
  697    H    THR1193           HN       THR1193  -4.725  -1.228   3.865
  698    HA   THR1193           HA       THR1193  -6.079  -3.241   2.737
  699    HB   THR1193           HB       THR1193  -3.058  -3.153   2.884
  700    HG1  THR1193           HG1      THR1193  -4.974  -1.801   1.312
  701   1HG2  THR1193          2HG2      THR1193  -3.949  -5.289   2.020
  702   2HG2  THR1193          1HG2      THR1193  -4.853  -4.396   0.799
  703   3HG2  THR1193          3HG2      THR1193  -3.089  -4.370   0.785
  704    H    GLY1194           HN       GLY1194  -6.448  -5.385   2.997
  705   1HA   GLY1194           HA1      GLY1194  -4.971  -6.768   5.134
  706   2HA   GLY1194           HA2      GLY1194  -5.766  -7.567   3.785
  707    H    GLU1195           HN       GLU1195  -7.244  -4.967   5.592
  708    HA   GLU1195           HA       GLU1195  -8.783  -6.786   7.244
  709   1HB   GLU1195           HB2      GLU1195  -8.917  -3.778   6.989
  710   2HB   GLU1195           HB1      GLU1195  -9.776  -4.739   8.186
  711   1HG   GLU1195           HG2      GLU1195  -6.787  -4.511   7.926
  712   2HG   GLU1195           HG1      GLU1195  -7.789  -3.695   9.126
  713    H    SER1196           HN       SER1196 -11.013  -7.045   7.188
  714    HA   SER1196           HA       SER1196 -12.169  -6.796   4.548
  715   1HB   SER1196           HB2      SER1196 -14.050  -8.084   5.506
  716   2HB   SER1196           HB1      SER1196 -12.499  -8.872   5.795
  717    HG   SER1196           HG       SER1196 -12.756  -7.417   7.866
  718    H    VAL1197           HN       VAL1197 -13.830  -5.487   3.948
  719    HA   VAL1197           HA       VAL1197 -15.098  -3.784   5.957
  720    HB   VAL1197           HB       VAL1197 -13.767  -2.661   3.486
  721   1HG1  VAL1197          3HG1      VAL1197 -15.822  -1.488   4.055
  722   2HG1  VAL1197          2HG1      VAL1197 -15.265  -1.290   5.716
  723   3HG1  VAL1197          1HG1      VAL1197 -14.416  -0.481   4.399
  724   1HG2  VAL1197          1HG2      VAL1197 -12.133  -3.270   5.190
  725   2HG2  VAL1197          3HG2      VAL1197 -12.265  -1.518   5.040
  726   3HG2  VAL1197          2HG2      VAL1197 -13.033  -2.347   6.394
  727    H    GLU1198           HN       GLU1198 -17.168  -4.349   5.653
  728    HA   GLU1198           HA       GLU1198 -18.186  -4.821   2.971
  729   1HB   GLU1198           HB2      GLU1198 -19.828  -6.029   3.953
  730   2HB   GLU1198           HB1      GLU1198 -18.755  -6.004   5.345
  731   1HG   GLU1198           HG2      GLU1198 -19.970  -3.955   6.124
  732   2HG   GLU1198           HG1      GLU1198 -21.130  -4.241   4.827
  733    H    PHE1199           HN       PHE1199 -19.877  -3.627   2.020
  734    HA   PHE1199           HA       PHE1199 -20.213  -0.938   3.170
  735   1HB   PHE1199           HB2      PHE1199 -20.214  -1.826   0.282
  736   2HB   PHE1199           HB1      PHE1199 -20.692  -0.215   0.809
  737    HD1  PHE1199           HD1      PHE1199 -19.104   1.455   0.939
  738    HD2  PHE1199           HD2      PHE1199 -17.867  -2.615   1.033
  739    HE1  PHE1199           HE1      PHE1199 -16.748   2.176   0.857
  740    HE2  PHE1199           HE2      PHE1199 -15.520  -1.911   0.956
  741    HZ   PHE1199           HZ       PHE1199 -14.951   0.487   0.870
  742    H    VAL1200           HN       VAL1200 -22.087  -1.127   4.302
  743    HA   VAL1200           HA       VAL1200 -24.358  -2.584   3.528
  744    HB   VAL1200           HB       VAL1200 -24.431  -0.070   5.190
  745   1HG1  VAL1200          2HG1      VAL1200 -26.031  -2.588   5.069
  746   2HG1  VAL1200          1HG1      VAL1200 -26.041  -1.556   6.499
  747   3HG1  VAL1200          3HG1      VAL1200 -26.572  -0.913   4.947
  748   1HG2  VAL1200          1HG2      VAL1200 -22.506  -1.356   5.953
  749   2HG2  VAL1200          3HG2      VAL1200 -23.807  -1.417   7.144
  750   3HG2  VAL1200          2HG2      VAL1200 -23.510  -2.799   6.089
  751    H    CYS1201           HN       CYS1201 -26.528  -0.909   3.492
  752    HA   CYS1201           HA       CYS1201 -26.022   1.176   1.574
  753   1HB   CYS1201           HB2      CYS1201 -27.858   0.284   0.063
  754   2HB   CYS1201           HB1      CYS1201 -26.309  -0.545   0.018
  755    H    LYS1202           HN       LYS1202 -26.753   2.732   2.783
  756    HA   LYS1202           HA       LYS1202 -28.217   4.096   3.860
  757   1HB   LYS1202           HB2      LYS1202 -29.661   2.949   1.809
  758   2HB   LYS1202           HB1      LYS1202 -30.665   2.656   3.219
  759   1HG   LYS1202           HG2      LYS1202 -31.471   4.679   2.563
  760   2HG   LYS1202           HG1      LYS1202 -30.201   5.202   3.673
  761   1HD   LYS1202           HD2      LYS1202 -28.671   5.459   1.761
  762   2HD   LYS1202           HD1      LYS1202 -29.982   4.999   0.670
  763   1HE   LYS1202           HE2      LYS1202 -31.281   6.932   1.422
  764   2HE   LYS1202           HE1      LYS1202 -29.971   7.392   2.510
  765   1HZ   LYS1202           HZ3      LYS1202 -29.788   7.246  -0.452
  766   2HZ   LYS1202           HZ2      LYS1202 -29.907   8.665   0.461
  767   3HZ   LYS1202           HZ1      LYS1202 -28.533   7.689   0.592
  768    H    ARG1203           HN       ARG1203 -30.790   2.162   4.378
  769    HA   ARG1203           HA       ARG1203 -29.931   0.755   6.699
  770   1HB   ARG1203           HB2      ARG1203 -31.121   2.024   8.302
  771   2HB   ARG1203           HB1      ARG1203 -30.213   3.178   7.337
  772   1HG   ARG1203           HG2      ARG1203 -32.180   3.759   6.080
  773   2HG   ARG1203           HG1      ARG1203 -33.123   2.548   6.953
  774   1HD   ARG1203           HD2      ARG1203 -31.790   4.965   8.169
  775   2HD   ARG1203           HD1      ARG1203 -33.513   4.796   7.836
  776    HE   ARG1203           HE       ARG1203 -32.730   2.663   9.460
  777   1HH1  ARG1203          1HH1      ARG1203 -33.049   6.130   9.627
  778   2HH1  ARG1203          2HH1      ARG1203 -33.369   6.147  11.329
  779   1HH2  ARG1203          1HH2      ARG1203 -33.149   2.677  11.701
  780   2HH2  ARG1203          2HH2      ARG1203 -33.425   4.185  12.508
  781    H    GLY1204           HN       GLY1204 -31.321   0.429   4.102
  782   1HA   GLY1204           HA1      GLY1204 -34.068  -0.035   4.415
  783   2HA   GLY1204           HA2      GLY1204 -33.217  -1.510   4.849
  784    H    TYR1205           HN       TYR1205 -31.944   0.669   2.446
  785    HA   TYR1205           HA       TYR1205 -33.072  -0.165   0.102
  786   1HB   TYR1205           HB2      TYR1205 -30.374   0.811   0.862
  787   2HB   TYR1205           HB1      TYR1205 -30.517   0.062  -0.719
  788    HD1  TYR1205           HD1      TYR1205 -31.281   1.304  -2.536
  789    HD2  TYR1205           HD2      TYR1205 -31.972   2.748   1.399
  790    HE1  TYR1205           HE1      TYR1205 -32.100   3.426  -3.467
  791    HE2  TYR1205           HE2      TYR1205 -32.799   4.874   0.482
  792    HH   TYR1205           HH       TYR1205 -33.558   5.290  -2.796
  793    H    ARG1206           HN       ARG1206 -33.147  -2.012  -1.056
  794    HA   ARG1206           HA       ARG1206 -31.675  -4.311  -0.009
  795   1HB   ARG1206           HB2      ARG1206 -33.237  -5.668  -1.351
  796   2HB   ARG1206           HB1      ARG1206 -34.068  -4.608  -0.223
  797   1HG   ARG1206           HG2      ARG1206 -35.349  -4.207  -2.032
  798   2HG   ARG1206           HG1      ARG1206 -34.085  -3.024  -2.369
  799   1HD   ARG1206           HD2      ARG1206 -32.954  -4.641  -3.811
  800   2HD   ARG1206           HD1      ARG1206 -34.209  -5.831  -3.467
  801    HE   ARG1206           HE       ARG1206 -35.360  -3.463  -4.497
  802   1HH1  ARG1206          1HH1      ARG1206 -33.501  -6.246  -5.468
  803   2HH1  ARG1206          2HH1      ARG1206 -34.085  -6.228  -7.098
  804   1HH2  ARG1206          1HH2      ARG1206 -36.134  -3.431  -6.642
  805   2HH2  ARG1206          2HH2      ARG1206 -35.581  -4.627  -7.765
  806    H    LEU1207           HN       LEU1207 -30.095  -5.324  -1.068
  807    HA   LEU1207           HA       LEU1207 -28.683  -4.179  -3.144
  808   1HB   LEU1207           HB2      LEU1207 -27.888  -5.994  -1.611
  809   2HB   LEU1207           HB1      LEU1207 -28.820  -7.137  -2.556
  810    HG   LEU1207           HG       LEU1207 -27.399  -6.252  -4.559
  811   1HD1  LEU1207          2HD1      LEU1207 -25.659  -5.502  -2.211
  812   2HD1  LEU1207          1HD1      LEU1207 -25.140  -5.557  -3.896
  813   3HD1  LEU1207          3HD1      LEU1207 -26.362  -4.390  -3.387
  814   1HD2  LEU1207          3HD2      LEU1207 -26.219  -8.002  -2.407
  815   2HD2  LEU1207          2HD2      LEU1207 -27.302  -8.524  -3.697
  816   3HD2  LEU1207          1HD2      LEU1207 -25.686  -7.934  -4.087
  817    H    SER1208           HN       SER1208 -28.992  -4.000  -5.266
  818    HA   SER1208           HA       SER1208 -31.329  -5.052  -6.504
  819   1HB   SER1208           HB2      SER1208 -30.392  -2.883  -7.163
  820   2HB   SER1208           HB1      SER1208 -28.928  -3.681  -7.738
  821    HG   SER1208           HG       SER1208 -31.255  -3.309  -9.016
  822    H    SER1209           HN       SER1209 -28.584  -6.591  -5.683
  823    HA   SER1209           HA       SER1209 -27.770  -8.659  -6.182
  824   1HB   SER1209           HB2      SER1209 -30.058  -9.358  -6.717
  825   2HB   SER1209           HB1      SER1209 -29.890  -8.700  -8.344
  826    HG   SER1209           HG       SER1209 -28.223 -10.732  -7.282
  827    H    ARG1210           HN       ARG1210 -28.674  -7.232  -9.333
  828    HA   ARG1210           HA       ARG1210 -26.367  -8.041 -10.687
  829   1HB   ARG1210           HB2      ARG1210 -28.024  -5.577 -11.258
  830   2HB   ARG1210           HB1      ARG1210 -26.991  -6.434 -12.394
  831   1HG   ARG1210           HG2      ARG1210 -28.449  -8.391 -12.246
  832   2HG   ARG1210           HG1      ARG1210 -29.488  -7.525 -11.111
  833   1HD   ARG1210           HD2      ARG1210 -28.915  -6.718 -13.961
  834   2HD   ARG1210           HD1      ARG1210 -30.402  -7.465 -13.376
  835    HE   ARG1210           HE       ARG1210 -29.996  -5.167 -11.872
  836   1HH1  ARG1210          1HH1      ARG1210 -30.589  -6.018 -15.199
  837   2HH1  ARG1210          2HH1      ARG1210 -31.410  -4.538 -15.566
  838   1HH2  ARG1210          1HH2      ARG1210 -31.075  -3.216 -12.347
  839   2HH2  ARG1210          2HH2      ARG1210 -31.686  -2.945 -13.944
  840    H    SER1211           HN       SER1211 -26.744  -5.763  -8.254
  841    HA   SER1211           HA       SER1211 -24.837  -3.810  -8.970
  842   1HB   SER1211           HB2      SER1211 -25.636  -4.701  -6.189
  843   2HB   SER1211           HB1      SER1211 -24.904  -3.157  -6.628
  844    HG   SER1211           HG       SER1211 -26.905  -2.529  -6.792
  845    H    HIS1212           HN       HIS1212 -23.207  -3.797  -6.625
  846    HA   HIS1212           HA       HIS1212 -21.261  -5.828  -7.421
  847   1HB   HIS1212           HB2      HIS1212 -20.926  -3.379  -5.676
  848   2HB   HIS1212           HB1      HIS1212 -19.632  -4.451  -6.200
  849    HD1  HIS1212           HD1      HIS1212 -21.447  -1.455  -7.170
  850    HD2  HIS1212           HD2      HIS1212 -19.238  -4.395  -9.104
  851    HE1  HIS1212           HE1      HIS1212 -20.867  -0.490  -9.419
  852    HE2  HIS1212           HE2      HIS1212 -19.610  -2.323 -10.606
  853    H    THR1213           HN       THR1213 -19.748  -5.831  -5.052
  854    HA   THR1213           HA       THR1213 -21.484  -7.451  -3.330
  855    HB   THR1213           HB       THR1213 -19.361  -8.448  -2.472
  856    HG1  THR1213           HG1      THR1213 -17.661  -7.257  -2.946
  857   1HG2  THR1213          3HG2      THR1213 -19.822  -8.638  -5.449
  858   2HG2  THR1213          2HG2      THR1213 -18.902  -9.793  -4.484
  859   3HG2  THR1213          1HG2      THR1213 -20.630  -9.588  -4.201
  860    H    LEU1214           HN       LEU1214 -21.595  -7.124  -1.146
  861    HA   LEU1214           HA       LEU1214 -20.879  -4.500  -0.213
  862   1HB   LEU1214           HB2      LEU1214 -22.127  -6.813   1.272
  863   2HB   LEU1214           HB1      LEU1214 -21.994  -5.172   1.872
  864    HG   LEU1214           HG       LEU1214 -24.196  -5.270   1.155
  865   1HD1  LEU1214          1HD1      LEU1214 -22.686  -3.484  -0.007
  866   2HD1  LEU1214          3HD1      LEU1214 -23.060  -4.405  -1.463
  867   3HD1  LEU1214          2HD1      LEU1214 -24.363  -3.696  -0.511
  868   1HD2  LEU1214          3HD2      LEU1214 -24.080  -7.474   0.125
  869   2HD2  LEU1214          2HD2      LEU1214 -24.939  -6.337  -0.912
  870   3HD2  LEU1214          1HD2      LEU1214 -23.274  -6.784  -1.283
  871    H    ARG1215           HN       ARG1215 -20.252  -7.747   1.124
  872    HA   ARG1215           HA       ARG1215 -18.112  -6.774   2.758
  873   1HB   ARG1215           HB2      ARG1215 -19.671  -8.815   3.155
  874   2HB   ARG1215           HB1      ARG1215 -18.536  -9.672   2.122
  875   1HG   ARG1215           HG2      ARG1215 -16.717  -9.148   3.639
  876   2HG   ARG1215           HG1      ARG1215 -17.825  -8.239   4.669
  877   1HD   ARG1215           HD2      ARG1215 -17.423 -10.470   5.568
  878   2HD   ARG1215           HD1      ARG1215 -19.110 -10.267   5.095
  879    HE   ARG1215           HE       ARG1215 -17.680 -11.396   2.956
  880   1HH1  ARG1215          1HH1      ARG1215 -18.837 -12.206   6.142
  881   2HH1  ARG1215          2HH1      ARG1215 -18.984 -13.898   5.799
  882   1HH2  ARG1215          1HH2      ARG1215 -17.872 -13.622   2.496
  883   2HH2  ARG1215          2HH2      ARG1215 -18.435 -14.702   3.727
  884    H    THR1216           HN       THR1216 -15.945  -6.931   2.471
  885    HA   THR1216           HA       THR1216 -14.715  -8.473   0.419
  886    HB   THR1216           HB       THR1216 -15.539  -6.836  -1.108
  887    HG1  THR1216           HG1      THR1216 -13.653  -6.436  -2.025
  888   1HG2  THR1216          2HG2      THR1216 -14.447  -4.758   0.787
  889   2HG2  THR1216          1HG2      THR1216 -15.094  -4.419  -0.819
  890   3HG2  THR1216          3HG2      THR1216 -16.146  -5.076   0.434
  891    H    THR1217           HN       THR1217 -12.345  -7.359   0.067
  892    HA   THR1217           HA       THR1217 -11.384  -6.603   2.745
  893    HB   THR1217           HB       THR1217 -10.872  -9.043   1.675
  894    HG1  THR1217           HG1      THR1217  -8.860  -7.693   3.145
  895   1HG2  THR1217          1HG2      THR1217  -8.552  -7.278   0.863
  896   2HG2  THR1217          3HG2      THR1217  -8.533  -9.042   0.872
  897   3HG2  THR1217          2HG2      THR1217  -9.612  -8.177  -0.223
  898    H    CYS1218           HN       CYS1218  -9.663  -5.142   2.820
  899    HA   CYS1218           HA       CYS1218  -9.489  -3.351   0.627
  900   1HB   CYS1218           HB2      CYS1218  -7.555  -3.468   2.938
  901   2HB   CYS1218           HB1      CYS1218  -7.989  -2.072   1.958
  902    H    TRP1219           HN       TRP1219  -8.455  -3.776  -1.183
  903    HA   TRP1219           HA       TRP1219  -5.746  -4.799  -1.088
  904   1HB   TRP1219           HB2      TRP1219  -7.474  -6.739  -1.250
  905   2HB   TRP1219           HB1      TRP1219  -7.664  -6.205  -2.918
  906    HD1  TRP1219           HD1      TRP1219  -5.422  -6.353  -4.490
  907    HE1  TRP1219           HE1      TRP1219  -3.450  -8.001  -4.382
  908    HE3  TRP1219           HE3      TRP1219  -6.064  -8.103   0.272
  909    HZ2  TRP1219           HZ2      TRP1219  -2.316  -9.796  -2.547
  910    HZ3  TRP1219           HZ3      TRP1219  -4.488  -9.790   1.128
  911    HH2  TRP1219           HH2      TRP1219  -2.652 -10.619  -0.254
  912    H    ASP1220           HN       ASP1220  -4.745  -3.253  -2.177
  913    HA   ASP1220           HA       ASP1220  -4.037  -1.997  -3.938
  914   1HB   ASP1220           HB2      ASP1220  -4.594  -3.912  -5.381
  915   2HB   ASP1220           HB1      ASP1220  -6.257  -3.343  -5.493
  916    H    GLY1221           HN       GLY1221  -7.199  -1.908  -2.704
  917   1HA   GLY1221           HA1      GLY1221  -7.481   0.868  -3.666
  918   2HA   GLY1221           HA2      GLY1221  -8.020   0.309  -2.091
  919    H    LYS1222           HN       LYS1222  -8.734  -2.062  -4.319
  920    HA   LYS1222           HA       LYS1222 -11.304  -0.894  -5.055
  921   1HB   LYS1222           HB2      LYS1222  -9.841  -3.353  -5.999
  922   2HB   LYS1222           HB1      LYS1222 -11.467  -2.936  -6.499
  923   1HG   LYS1222           HG2      LYS1222  -9.038  -1.218  -6.935
  924   2HG   LYS1222           HG1      LYS1222  -9.766  -2.277  -8.144
  925   1HD   LYS1222           HD2      LYS1222 -11.185   0.013  -6.787
  926   2HD   LYS1222           HD1      LYS1222 -10.442   0.095  -8.386
  927   1HE   LYS1222           HE2      LYS1222 -12.687  -1.745  -7.566
  928   2HE   LYS1222           HE1      LYS1222 -12.850  -0.285  -8.542
  929   1HZ   LYS1222           HZ3      LYS1222 -11.292  -2.699  -9.295
  930   2HZ   LYS1222           HZ2      LYS1222 -12.805  -2.270  -9.916
  931   3HZ   LYS1222           HZ1      LYS1222 -11.456  -1.300 -10.232
  932    H    LEU1223           HN       LEU1223 -12.888  -1.204  -3.658
  933    HA   LEU1223           HA       LEU1223 -13.086  -3.801  -2.281
  934   1HB   LEU1223           HB2      LEU1223 -14.347  -1.212  -1.401
  935   2HB   LEU1223           HB1      LEU1223 -14.238  -2.704  -0.491
  936    HG   LEU1223           HG       LEU1223 -12.634  -1.308   0.481
  937   1HD1  LEU1223          3HD1      LEU1223 -11.755  -3.525   0.011
  938   2HD1  LEU1223          2HD1      LEU1223 -11.166  -2.968  -1.556
  939   3HD1  LEU1223          1HD1      LEU1223 -10.481  -2.308  -0.072
  940   1HD2  LEU1223          3HD2      LEU1223 -11.744  -0.567  -2.300
  941   2HD2  LEU1223          2HD2      LEU1223 -12.625   0.458  -1.168
  942   3HD2  LEU1223          1HD2      LEU1223 -10.972  -0.035  -0.805
  943    H    GLU1224           HN       GLU1224 -14.354  -2.056  -4.755
  944    HA   GLU1224           HA       GLU1224 -16.225  -2.203  -6.029
  945   1HB   GLU1224           HB2      GLU1224 -15.649  -4.719  -5.314
  946   2HB   GLU1224           HB1      GLU1224 -17.239  -4.581  -4.572
  947   1HG   GLU1224           HG2      GLU1224 -18.206  -3.979  -6.717
  948   2HG   GLU1224           HG1      GLU1224 -16.615  -4.068  -7.472
  949    H    TYR1225           HN       TYR1225 -17.505  -0.516  -5.548
  950    HA   TYR1225           HA       TYR1225 -19.152  -0.608  -3.129
  951   1HB   TYR1225           HB2      TYR1225 -19.711   1.813  -3.989
  952   2HB   TYR1225           HB1      TYR1225 -18.185   1.488  -3.168
  953    HD1  TYR1225           HD1      TYR1225 -19.769   2.469  -6.271
  954    HD2  TYR1225           HD2      TYR1225 -16.102   1.296  -4.479
  955    HE1  TYR1225           HE1      TYR1225 -18.544   3.348  -8.213
  956    HE2  TYR1225           HE2      TYR1225 -14.863   2.169  -6.407
  957    HH   TYR1225           HH       TYR1225 -16.286   4.166  -8.755
  958    HA   PRO1226           HA       PRO1226 -22.404  -1.976  -5.961
  959   1HB   PRO1226           HB2      PRO1226 -23.825  -2.479  -3.436
  960   2HB   PRO1226           HB1      PRO1226 -23.399  -3.608  -4.725
  961   1HG   PRO1226           HG2      PRO1226 -22.171  -3.680  -2.342
  962   2HG   PRO1226           HG1      PRO1226 -21.298  -4.027  -3.846
  963   1HD   PRO1226           HD2      PRO1226 -21.353  -1.498  -2.231
  964   2HD   PRO1226           HD1      PRO1226 -19.966  -2.330  -2.969
  965    H    THR1227           HN       THR1227 -25.047  -1.749  -4.884
  966    HA   THR1227           HA       THR1227 -25.666   0.831  -3.946
  967    HB   THR1227           HB       THR1227 -24.928   1.767  -5.989
  968    HG1  THR1227           HG1      THR1227 -27.667   1.455  -6.579
  969   1HG2  THR1227          3HG2      THR1227 -24.763  -0.282  -7.309
  970   2HG2  THR1227          2HG2      THR1227 -26.520  -0.359  -7.427
  971   3HG2  THR1227          1HG2      THR1227 -25.642   0.964  -8.194
  972    H    CYS1228           HN       CYS1228 -27.139  -0.388  -2.720
  973    HA   CYS1228           HA       CYS1228 -28.983  -2.237  -3.730
  974   1HB   CYS1228           HB2      CYS1228 -29.075  -0.469  -1.287
  975   2HB   CYS1228           HB1      CYS1228 -30.313  -1.666  -1.640
  976    H    ALA1229           HN       ALA1229 -31.518  -1.499  -3.017
  977    HA   ALA1229           HA       ALA1229 -32.148   0.976  -4.403
  978   1HB   ALA1229           HB3      ALA1229 -33.250  -1.664  -5.348
  979   2HB   ALA1229           HB2      ALA1229 -33.681  -0.070  -5.966
  980   3HB   ALA1229           HB1      ALA1229 -32.046  -0.691  -6.195
  981    H    LYS1230           HN       LYS1230 -33.904   1.937  -3.738
  982    HA   LYS1230           HA       LYS1230 -35.445   2.551  -2.192
  983   1HB   LYS1230           HB2      LYS1230 -37.529   1.271  -2.362
  984   2HB   LYS1230           HB1      LYS1230 -36.825   1.631  -3.932
  985   1HG   LYS1230           HG2      LYS1230 -35.778  -0.726  -3.734
  986   2HG   LYS1230           HG1      LYS1230 -37.015  -0.986  -2.504
  987   1HD   LYS1230           HD2      LYS1230 -38.764  -0.536  -4.077
  988   2HD   LYS1230           HD1      LYS1230 -37.596  -0.040  -5.304
  989   1HE   LYS1230           HE2      LYS1230 -38.316  -2.266  -5.816
  990   2HE   LYS1230           HE1      LYS1230 -36.649  -2.339  -5.243
  991   1HZ   LYS1230           HZ2      LYS1230 -37.462  -3.013  -3.070
  992   2HZ   LYS1230           HZ1      LYS1230 -39.060  -2.942  -3.617
  993   3HZ   LYS1230           HZ3      LYS1230 -37.995  -4.086  -4.264
  994    H    ARG1231           HN       ARG1231 -34.908   2.612  -0.175
  995    HA   ARG1231           HA       ARG1231 -34.266   0.432   1.459
  996   1HB   ARG1231           HB2      ARG1231 -33.375   2.365   2.279
  997   2HB   ARG1231           HB1      ARG1231 -34.760   3.337   1.825
  998   1HG   ARG1231           HG2      ARG1231 -36.017   2.338   3.708
  999   2HG   ARG1231           HG1      ARG1231 -34.546   1.493   4.193
 1000   1HD   ARG1231           HD2      ARG1231 -34.842   3.530   5.494
 1001   2HD   ARG1231           HD1      ARG1231 -33.407   3.637   4.475
 1002    HE   ARG1231           HE       ARG1231 -35.515   4.762   3.056
 1003   1HH1  ARG1231          1HH1      ARG1231 -33.726   5.373   5.983
 1004   2HH1  ARG1231          2HH1      ARG1231 -33.957   7.089   5.918
 1005   1HH2  ARG1231          1HH2      ARG1231 -35.823   7.020   2.963
 1006   2HH2  ARG1231          2HH2      ARG1231 -35.149   8.024   4.202

  No H/Q in entry =        1006
  Start of MODEL   20
    1    H1   GLU1103           HT1      GLU1103  36.341 -11.013  -3.155
    2    H2   GLU1103           HT3      GLU1103  35.307 -12.341  -2.979
    3    H3   GLU1103           HT2      GLU1103  34.831 -11.016  -3.917
    4    HA   GLU1103           HA       GLU1103  33.707 -10.984  -1.802
    5   1HB   GLU1103           HB2      GLU1103  36.508 -10.833  -0.668
    6   2HB   GLU1103           HB1      GLU1103  35.025 -10.651   0.259
    7   1HG   GLU1103           HG2      GLU1103  34.393 -12.942  -0.298
    8   2HG   GLU1103           HG1      GLU1103  35.880 -13.125  -1.227
    9    H    ALA1104           HN       ALA1104  32.871  -9.026  -1.412
   10    HA   ALA1104           HA       ALA1104  34.405  -6.696  -2.322
   11   1HB   ALA1104           HB3      ALA1104  31.441  -6.968  -1.831
   12   2HB   ALA1104           HB2      ALA1104  32.259  -5.555  -2.498
   13   3HB   ALA1104           HB1      ALA1104  32.239  -7.070  -3.399
   14    H    GLU1105           HN       GLU1105  35.140  -5.233  -0.925
   15    HA   GLU1105           HA       GLU1105  34.122  -5.318   1.839
   16   1HB   GLU1105           HB2      GLU1105  36.856  -4.494   0.842
   17   2HB   GLU1105           HB1      GLU1105  36.330  -4.442   2.520
   18   1HG   GLU1105           HG2      GLU1105  36.572  -6.917   0.824
   19   2HG   GLU1105           HG1      GLU1105  37.706  -6.397   2.069
   20    H    PHE1106           HN       PHE1106  35.727  -3.052  -0.407
   21    HA   PHE1106           HA       PHE1106  34.332  -0.831   0.878
   22   1HB   PHE1106           HB2      PHE1106  36.755  -0.620   0.475
   23   2HB   PHE1106           HB1      PHE1106  36.481  -0.815  -1.253
   24    HD1  PHE1106           HD1      PHE1106  35.876   1.402   1.633
   25    HD2  PHE1106           HD2      PHE1106  35.822   1.000  -2.603
   26    HE1  PHE1106           HE1      PHE1106  35.571   3.833   1.411
   27    HE2  PHE1106           HE2      PHE1106  35.517   3.431  -2.834
   28    HZ   PHE1106           HZ       PHE1106  35.391   4.851  -0.825
   29    H    GLY1107           HN       GLY1107  32.455  -0.154   0.093
   30   1HA   GLY1107           HA1      GLY1107  31.257  -1.090  -2.237
   31   2HA   GLY1107           HA2      GLY1107  32.018   0.443  -2.621
   32    H    LYS1108           HN       LYS1108  31.588   1.790  -0.186
   33    HA   LYS1108           HA       LYS1108  29.072   1.718   0.909
   34   1HB   LYS1108           HB2      LYS1108  30.757   4.143   0.261
   35   2HB   LYS1108           HB1      LYS1108  29.334   4.176   1.294
   36   1HG   LYS1108           HG2      LYS1108  30.441   2.560   2.802
   37   2HG   LYS1108           HG1      LYS1108  31.886   2.660   1.793
   38   1HD   LYS1108           HD2      LYS1108  32.082   5.030   2.260
   39   2HD   LYS1108           HD1      LYS1108  30.590   4.990   3.200
   40   1HE   LYS1108           HE2      LYS1108  32.534   4.965   4.663
   41   2HE   LYS1108           HE1      LYS1108  31.630   3.456   4.792
   42   1HZ   LYS1108           HZ1      LYS1108  34.104   3.857   3.197
   43   2HZ   LYS1108           HZ3      LYS1108  34.007   3.053   4.684
   44   3HZ   LYS1108           HZ2      LYS1108  33.238   2.409   3.322
   45    H    CYS1109           HN       CYS1109  27.087   2.170   0.292
   46    HA   CYS1109           HA       CYS1109  26.682   2.951  -2.487
   47   1HB   CYS1109           HB2      CYS1109  24.550   2.029  -0.579
   48   2HB   CYS1109           HB1      CYS1109  24.565   1.936  -2.338
   49    H    GLY1110           HN       GLY1110  24.195   3.931  -2.474
   50   1HA   GLY1110           HA1      GLY1110  23.998   6.446  -2.543
   51   2HA   GLY1110           HA2      GLY1110  24.330   6.369  -0.818
   52    HA   PRO1111           HA       PRO1111  19.876   6.597  -0.433
   53   1HB   PRO1111           HB2      PRO1111  19.266   7.586  -3.176
   54   2HB   PRO1111           HB1      PRO1111  18.734   8.205  -1.609
   55   1HG   PRO1111           HG2      PRO1111  20.628   9.462  -3.011
   56   2HG   PRO1111           HG1      PRO1111  20.713   9.355  -1.243
   57   1HD   PRO1111           HD2      PRO1111  22.249   7.853  -3.312
   58   2HD   PRO1111           HD1      PRO1111  22.764   8.417  -1.709
   59    HA   PRO1112           HA       PRO1112  19.201   2.601  -2.389
   60   1HB   PRO1112           HB2      PRO1112  17.291   1.745  -0.671
   61   2HB   PRO1112           HB1      PRO1112  19.013   1.743  -0.272
   62   1HG   PRO1112           HG2      PRO1112  16.900   3.737   0.465
   63   2HG   PRO1112           HG1      PRO1112  18.169   3.028   1.481
   64   1HD   PRO1112           HD2      PRO1112  18.394   5.493   0.395
   65   2HD   PRO1112           HD1      PRO1112  19.798   4.435   0.647
   66    HA   PRO1113           HA       PRO1113  15.874   4.172  -5.126
   67   1HB   PRO1113           HB2      PRO1113  16.210   1.295  -5.889
   68   2HB   PRO1113           HB1      PRO1113  15.996   2.711  -6.925
   69   1HG   PRO1113           HG2      PRO1113  18.409   1.607  -6.552
   70   2HG   PRO1113           HG1      PRO1113  18.204   3.358  -6.725
   71   1HD   PRO1113           HD2      PRO1113  18.879   1.775  -4.330
   72   2HD   PRO1113           HD1      PRO1113  19.189   3.485  -4.674
   73    HA   PRO1114           HA       PRO1114  12.859   2.252  -2.340
   74   1HB   PRO1114           HB2      PRO1114  11.036   4.185  -2.409
   75   2HB   PRO1114           HB1      PRO1114  12.575   4.426  -1.568
   76   1HG   PRO1114           HG2      PRO1114  11.779   5.281  -4.335
   77   2HG   PRO1114           HG1      PRO1114  12.542   6.248  -3.056
   78   1HD   PRO1114           HD2      PRO1114  13.952   5.093  -5.078
   79   2HD   PRO1114           HD1      PRO1114  14.631   5.345  -3.457
   80    H    ILE1115           HN       ILE1115  10.293   2.311  -2.573
   81    HA   ILE1115           HA       ILE1115   9.721   1.041  -5.150
   82    HB   ILE1115           HB       ILE1115   7.514   0.605  -3.582
   83   1HG1  ILE1115          2HG1      ILE1115   9.950   0.454  -1.788
   84   2HG1  ILE1115          1HG1      ILE1115   8.673   1.657  -1.652
   85   1HG2  ILE1115          1HG2      ILE1115  10.010  -1.043  -3.890
   86   2HG2  ILE1115          3HG2      ILE1115   8.491  -1.657  -3.238
   87   3HG2  ILE1115          2HG2      ILE1115   8.568  -1.080  -4.905
   88   1HD1  ILE1115          2HD1      ILE1115   8.315  -1.308  -1.308
   89   2HD1  ILE1115          1HD1      ILE1115   8.433  -0.122  -0.005
   90   3HD1  ILE1115          3HD1      ILE1115   7.066  -0.077  -1.120
   91    H    ASP1116           HN       ASP1116   7.308   1.251  -5.776
   92    HA   ASP1116           HA       ASP1116   6.800   3.945  -6.430
   93   1HB   ASP1116           HB2      ASP1116   4.964   1.537  -6.495
   94   2HB   ASP1116           HB1      ASP1116   4.597   3.094  -7.229
   95    H    ASN1117           HN       ASN1117   6.408   5.401  -4.875
   96    HA   ASN1117           HA       ASN1117   5.336   6.514  -3.202
   97   1HB   ASN1117           HB2      ASN1117   3.280   4.309  -3.504
   98   2HB   ASN1117           HB1      ASN1117   3.062   5.764  -2.532
   99   1HD2  ASN1117          1HD2      ASN1117   3.270   4.461  -5.742
  100   2HD2  ASN1117          2HD2      ASN1117   2.660   5.852  -6.566
  101    H    GLY1118           HN       GLY1118   7.132   4.063  -2.845
  102   1HA   GLY1118           HA1      GLY1118   7.451   2.422  -1.113
  103   2HA   GLY1118           HA2      GLY1118   6.378   3.358  -0.088
  104    H    ASP1119           HN       ASP1119   8.864   2.452   0.762
  105    HA   ASP1119           HA       ASP1119  11.101   3.956   0.602
  106   1HB   ASP1119           HB2      ASP1119  10.906   5.708   2.331
  107   2HB   ASP1119           HB1      ASP1119   9.798   5.997   0.994
  108    H    ILE1120           HN       ILE1120  12.493   3.840   2.584
  109    HA   ILE1120           HA       ILE1120  12.336   1.324   3.759
  110    HB   ILE1120           HB       ILE1120  13.725   3.186   5.498
  111   1HG1  ILE1120          2HG1      ILE1120  14.434   3.210   2.555
  112   2HG1  ILE1120          1HG1      ILE1120  13.884   4.587   3.503
  113   1HG2  ILE1120          2HG2      ILE1120  14.622   0.927   3.720
  114   2HG2  ILE1120          1HG2      ILE1120  15.602   1.692   4.971
  115   3HG2  ILE1120          3HG2      ILE1120  14.145   0.800   5.414
  116   1HD1  ILE1120          2HD1      ILE1120  15.912   4.472   4.850
  117   2HD1  ILE1120          1HD1      ILE1120  16.465   3.095   3.897
  118   3HD1  ILE1120          3HD1      ILE1120  16.277   4.675   3.137
  119    H    THR1121           HN       THR1121  11.763   0.606   5.813
  120    HA   THR1121           HA       THR1121   9.386   1.645   6.866
  121    HB   THR1121           HB       THR1121   9.676   0.047   8.701
  122    HG1  THR1121           HG1      THR1121  11.608  -0.647   9.226
  123   1HG2  THR1121          3HG2      THR1121  10.489  -1.037   5.999
  124   2HG2  THR1121          2HG2      THR1121   9.863  -2.002   7.336
  125   3HG2  THR1121          1HG2      THR1121   8.840  -0.787   6.572
  126    H    SER1122           HN       SER1122  12.466   2.874   7.187
  127    HA   SER1122           HA       SER1122  11.788   4.156   9.754
  128   1HB   SER1122           HB2      SER1122  13.803   2.752   9.906
  129   2HB   SER1122           HB1      SER1122  14.537   3.659   8.586
  130    HG   SER1122           HG       SER1122  14.118   5.551  10.049
  131    H    PHE1123           HN       PHE1123  14.399   5.144   7.651
  132    HA   PHE1123           HA       PHE1123  12.924   7.294   6.430
  133   1HB   PHE1123           HB2      PHE1123  13.380   8.148   8.727
  134   2HB   PHE1123           HB1      PHE1123  15.102   7.961   8.419
  135    HD1  PHE1123           HD1      PHE1123  12.069   9.789   7.373
  136    HD2  PHE1123           HD2      PHE1123  16.317   9.588   7.229
  137    HE1  PHE1123           HE1      PHE1123  12.139  12.046   6.398
  138    HE2  PHE1123           HE2      PHE1123  16.395  11.845   6.253
  139    HZ   PHE1123           HZ       PHE1123  14.304  13.077   5.837
  140    HA   PRO1124           HA       PRO1124  15.911   6.343   3.273
  141   1HB   PRO1124           HB2      PRO1124  15.437   9.199   2.552
  142   2HB   PRO1124           HB1      PRO1124  15.390   7.757   1.531
  143   1HG   PRO1124           HG2      PRO1124  13.135   8.923   2.323
  144   2HG   PRO1124           HG1      PRO1124  13.267   7.155   2.255
  145   1HD   PRO1124           HD2      PRO1124  13.319   8.973   4.622
  146   2HD   PRO1124           HD1      PRO1124  12.632   7.345   4.464
  147    H    LEU1125           HN       LEU1125  18.079   6.511   3.089
  148    HA   LEU1125           HA       LEU1125  19.405   8.729   4.503
  149   1HB   LEU1125           HB2      LEU1125  20.483   5.923   4.157
  150   2HB   LEU1125           HB1      LEU1125  21.234   7.235   5.048
  151    HG   LEU1125           HG       LEU1125  19.077   7.173   6.501
  152   1HD1  LEU1125          1HD1      LEU1125  19.021   4.429   5.254
  153   2HD1  LEU1125          3HD1      LEU1125  18.083   4.934   6.656
  154   3HD1  LEU1125          2HD1      LEU1125  17.785   5.677   5.083
  155   1HD2  LEU1125          1HD2      LEU1125  21.305   6.582   7.296
  156   2HD2  LEU1125          3HD2      LEU1125  20.089   5.484   7.949
  157   3HD2  LEU1125          2HD2      LEU1125  21.125   4.962   6.621
  158    H    SER1126           HN       SER1126  21.281   9.598   3.574
  159    HA   SER1126           HA       SER1126  21.347   9.410   0.692
  160   1HB   SER1126           HB2      SER1126  22.997  11.239   0.835
  161   2HB   SER1126           HB1      SER1126  21.537  11.605   1.752
  162    HG   SER1126           HG       SER1126  22.623  11.452   3.585
  163    H    VAL1127           HN       VAL1127  23.649   8.875   3.351
  164    HA   VAL1127           HA       VAL1127  25.342   7.357   1.484
  165    HB   VAL1127           HB       VAL1127  26.059   8.416   4.225
  166   1HG1  VAL1127          1HG1      VAL1127  27.290   6.394   3.636
  167   2HG1  VAL1127          3HG1      VAL1127  27.761   7.115   2.097
  168   3HG1  VAL1127          2HG1      VAL1127  28.352   7.801   3.611
  169   1HG2  VAL1127          3HG2      VAL1127  26.815   9.424   1.484
  170   2HG2  VAL1127          2HG2      VAL1127  25.749  10.230   2.635
  171   3HG2  VAL1127          1HG2      VAL1127  27.461  10.025   3.011
  172    H    TYR1128           HN       TYR1128  25.241   5.225   1.577
  173    HA   TYR1128           HA       TYR1128  24.275   3.979   4.064
  174   1HB   TYR1128           HB2      TYR1128  23.429   3.683   1.328
  175   2HB   TYR1128           HB1      TYR1128  23.995   2.139   1.956
  176    HD1  TYR1128           HD1      TYR1128  23.053   1.472   4.313
  177    HD2  TYR1128           HD2      TYR1128  21.244   4.317   1.718
  178    HE1  TYR1128           HE1      TYR1128  20.901   1.137   5.456
  179    HE2  TYR1128           HE2      TYR1128  19.088   3.993   2.852
  180    HH   TYR1128           HH       TYR1128  17.961   2.275   4.207
  181    H    ALA1129           HN       ALA1129  24.942   1.632   4.226
  182    HA   ALA1129           HA       ALA1129  27.839   1.488   3.798
  183   1HB   ALA1129           HB2      ALA1129  27.034   1.206   6.094
  184   2HB   ALA1129           HB1      ALA1129  26.071  -0.180   5.585
  185   3HB   ALA1129           HB3      ALA1129  27.831  -0.253   5.506
  186    HA   PRO1130           HA       PRO1130  27.327  -1.498   0.571
  187   1HB   PRO1130           HB2      PRO1130  29.779  -2.700   0.724
  188   2HB   PRO1130           HB1      PRO1130  29.489  -1.148  -0.064
  189   1HG   PRO1130           HG2      PRO1130  30.611  -1.732   2.640
  190   2HG   PRO1130           HG1      PRO1130  31.064  -0.464   1.487
  191   1HD   PRO1130           HD2      PRO1130  29.522  -0.004   3.681
  192   2HD   PRO1130           HD1      PRO1130  29.396   0.943   2.186
  193    H    ALA1131           HN       ALA1131  26.974  -3.696   0.248
  194    HA   ALA1131           HA       ALA1131  26.374  -5.821   0.783
  195   1HB   ALA1131           HB1      ALA1131  28.735  -6.058   1.383
  196   2HB   ALA1131           HB2      ALA1131  27.700  -7.029   2.431
  197   3HB   ALA1131           HB3      ALA1131  28.374  -5.509   3.020
  198    H    SER1132           HN       SER1132  25.488  -3.241   2.476
  199    HA   SER1132           HA       SER1132  24.248  -4.609   4.726
  200   1HB   SER1132           HB2      SER1132  24.178  -1.708   3.870
  201   2HB   SER1132           HB1      SER1132  23.415  -2.343   5.328
  202    HG   SER1132           HG       SER1132  26.170  -2.678   4.784
  203    H    SER1133           HN       SER1133  21.936  -4.363   5.159
  204    HA   SER1133           HA       SER1133  20.273  -3.997   2.773
  205   1HB   SER1133           HB2      SER1133  19.769  -6.341   4.591
  206   2HB   SER1133           HB1      SER1133  19.203  -6.073   2.944
  207    HG   SER1133           HG       SER1133  20.859  -7.564   2.878
  208    H    VAL1134           HN       VAL1134  18.006  -3.660   3.258
  209    HA   VAL1134           HA       VAL1134  17.354  -3.121   6.053
  210    HB   VAL1134           HB       VAL1134  16.373  -0.897   5.459
  211   1HG1  VAL1134          1HG1      VAL1134  19.357  -1.192   5.174
  212   2HG1  VAL1134          3HG1      VAL1134  18.509   0.307   5.557
  213   3HG1  VAL1134          2HG1      VAL1134  18.453  -1.051   6.681
  214   1HG2  VAL1134          1HG2      VAL1134  16.265  -1.189   3.046
  215   2HG2  VAL1134          3HG2      VAL1134  17.197   0.248   3.467
  216   3HG2  VAL1134          2HG2      VAL1134  18.026  -1.225   2.960
  217    H    GLU1135           HN       GLU1135  15.029  -2.417   6.260
  218    HA   GLU1135           HA       GLU1135  13.392  -4.048   4.455
  219   1HB   GLU1135           HB2      GLU1135  12.974  -3.140   7.304
  220   2HB   GLU1135           HB1      GLU1135  11.732  -3.931   6.353
  221   1HG   GLU1135           HG2      GLU1135  12.753  -5.566   7.744
  222   2HG   GLU1135           HG1      GLU1135  13.252  -5.875   6.083
  223    H    TYR1136           HN       TYR1136  11.716  -3.168   3.339
  224    HA   TYR1136           HA       TYR1136  11.378  -0.260   3.593
  225   1HB   TYR1136           HB2      TYR1136  11.407  -2.112   1.295
  226   2HB   TYR1136           HB1      TYR1136  10.194  -0.837   1.227
  227    HD1  TYR1136           HD1      TYR1136  10.808   1.103   0.167
  228    HD2  TYR1136           HD2      TYR1136  13.812  -1.190   2.117
  229    HE1  TYR1136           HE1      TYR1136  12.510   2.709  -0.580
  230    HE2  TYR1136           HE2      TYR1136  15.524   0.410   1.374
  231    HH   TYR1136           HH       TYR1136  15.813   2.081  -0.446
  232    H    GLN1137           HN       GLN1137   9.104   0.370   2.581
  233    HA   GLN1137           HA       GLN1137   6.910  -1.328   3.207
  234   1HB   GLN1137           HB2      GLN1137   7.834  -0.544   5.488
  235   2HB   GLN1137           HB1      GLN1137   7.187   1.032   5.056
  236   1HG   GLN1137           HG2      GLN1137   5.563  -0.008   6.401
  237   2HG   GLN1137           HG1      GLN1137   4.958  -0.090   4.746
  238   1HE2  GLN1137          1HE2      GLN1137   6.295  -1.885   7.406
  239   2HE2  GLN1137          2HE2      GLN1137   5.881  -3.455   6.820
  240    H    CYS1138           HN       CYS1138   4.811   0.045   3.260
  241    HA   CYS1138           HA       CYS1138   5.086   2.295   1.380
  242   1HB   CYS1138           HB2      CYS1138   4.049  -0.131   0.707
  243   2HB   CYS1138           HB1      CYS1138   2.599   0.716   1.235
  244    H    GLN1139           HN       GLN1139   4.260   4.128   2.145
  245    HA   GLN1139           HA       GLN1139   2.347   3.981   4.371
  246   1HB   GLN1139           HB2      GLN1139   3.060   6.333   4.830
  247   2HB   GLN1139           HB1      GLN1139   4.343   5.143   4.991
  248   1HG   GLN1139           HG2      GLN1139   5.424   6.796   3.848
  249   2HG   GLN1139           HG1      GLN1139   4.857   5.790   2.516
  250   1HE2  GLN1139          1HE2      GLN1139   4.843   7.448   1.036
  251   2HE2  GLN1139          2HE2      GLN1139   3.699   8.742   1.089
  252    H    ASN1140           HN       ASN1140   1.392   6.566   4.302
  253    HA   ASN1140           HA       ASN1140  -0.381   7.736   3.510
  254   1HB   ASN1140           HB2      ASN1140   1.528   8.245   1.877
  255   2HB   ASN1140           HB1      ASN1140   0.680   7.183   0.760
  256   1HD2  ASN1140          1HD2      ASN1140  -1.028   9.131   3.043
  257   2HD2  ASN1140          2HD2      ASN1140  -1.695  10.249   1.909
  258    H    LEU1141           HN       LEU1141  -1.104   5.190   4.082
  259    HA   LEU1141           HA       LEU1141  -2.899   3.809   3.829
  260   1HB   LEU1141           HB2      LEU1141  -3.566   5.378   1.342
  261   2HB   LEU1141           HB1      LEU1141  -4.636   4.314   2.234
  262    HG   LEU1141           HG       LEU1141  -3.464   6.814   3.440
  263   1HD1  LEU1141          1HD1      LEU1141  -6.104   6.478   2.023
  264   2HD1  LEU1141          3HD1      LEU1141  -5.607   7.895   2.947
  265   3HD1  LEU1141          2HD1      LEU1141  -4.741   7.454   1.476
  266   1HD2  LEU1141          2HD2      LEU1141  -4.287   5.152   5.018
  267   2HD2  LEU1141          1HD2      LEU1141  -5.327   6.575   5.004
  268   3HD2  LEU1141          3HD2      LEU1141  -5.836   5.103   4.176
  269    H    TYR1142           HN       TYR1142  -0.701   4.368   1.212
  270    HA   TYR1142           HA       TYR1142  -1.435   2.227  -0.463
  271   1HB   TYR1142           HB2      TYR1142   1.250   3.562  -0.062
  272   2HB   TYR1142           HB1      TYR1142   0.892   2.418  -1.351
  273    HD1  TYR1142           HD1      TYR1142   0.677   5.842  -0.266
  274    HD2  TYR1142           HD2      TYR1142  -0.850   3.027  -3.066
  275    HE1  TYR1142           HE1      TYR1142  -0.133   7.689  -1.672
  276    HE2  TYR1142           HE2      TYR1142  -1.666   4.866  -4.479
  277    HH   TYR1142           HH       TYR1142  -0.722   8.093  -4.024
  278    H    GLN1143           HN       GLN1143  -0.872   0.109  -0.517
  279    HA   GLN1143           HA       GLN1143   0.431  -0.947   1.890
  280   1HB   GLN1143           HB2      GLN1143  -1.816  -1.802   1.410
  281   2HB   GLN1143           HB1      GLN1143  -1.286  -2.333  -0.180
  282   1HG   GLN1143           HG2      GLN1143  -1.355  -4.240   1.219
  283   2HG   GLN1143           HG1      GLN1143   0.343  -3.845   0.954
  284   1HE2  GLN1143          1HE2      GLN1143  -0.903  -5.378   3.093
  285   2HE2  GLN1143          2HE2      GLN1143  -0.460  -4.594   4.567
  286    H    LEU1144           HN       LEU1144   1.836  -2.870   1.596
  287    HA   LEU1144           HA       LEU1144   3.464  -2.575  -0.838
  288   1HB   LEU1144           HB2      LEU1144   4.619  -1.952   1.225
  289   2HB   LEU1144           HB1      LEU1144   4.271  -3.526   1.910
  290    HG   LEU1144           HG       LEU1144   5.778  -3.487  -0.650
  291   1HD1  LEU1144          1HD1      LEU1144   6.819  -1.660   0.599
  292   2HD1  LEU1144          3HD1      LEU1144   7.018  -2.725   1.991
  293   3HD1  LEU1144          2HD1      LEU1144   7.887  -3.059   0.493
  294   1HD2  LEU1144          2HD2      LEU1144   6.016  -5.062   1.913
  295   2HD2  LEU1144          1HD2      LEU1144   5.203  -5.587   0.438
  296   3HD2  LEU1144          3HD2      LEU1144   6.951  -5.341   0.443
  297    H    GLU1145           HN       GLU1145   4.442  -4.467  -1.719
  298    HA   GLU1145           HA       GLU1145   3.335  -7.042  -0.914
  299   1HB   GLU1145           HB2      GLU1145   1.746  -6.221  -2.574
  300   2HB   GLU1145           HB1      GLU1145   3.056  -5.910  -3.705
  301   1HG   GLU1145           HG2      GLU1145   3.539  -8.291  -3.823
  302   2HG   GLU1145           HG1      GLU1145   2.253  -8.617  -2.660
  303    H    GLY1146           HN       GLY1146   4.993  -8.383  -0.742
  304   1HA   GLY1146           HA1      GLY1146   7.209  -8.134  -2.679
  305   2HA   GLY1146           HA2      GLY1146   6.708  -9.648  -1.938
  306    H    ASN1147           HN       ASN1147   9.252  -9.331  -1.703
  307    HA   ASN1147           HA       ASN1147   9.690  -8.968   1.096
  308   1HB   ASN1147           HB2      ASN1147  12.103  -9.450   0.467
  309   2HB   ASN1147           HB1      ASN1147  10.936 -10.701   0.054
  310   1HD2  ASN1147          1HD2      ASN1147  13.135  -8.330  -1.143
  311   2HD2  ASN1147          2HD2      ASN1147  13.047  -8.783  -2.809
  312    H    LYS1148           HN       LYS1148   9.287  -6.828   1.582
  313    HA   LYS1148           HA       LYS1148  10.235  -4.583   0.233
  314   1HB   LYS1148           HB2      LYS1148  10.000  -3.479   2.546
  315   2HB   LYS1148           HB1      LYS1148   8.568  -4.170   1.797
  316   1HG   LYS1148           HG2      LYS1148   8.483  -4.807   4.054
  317   2HG   LYS1148           HG1      LYS1148   9.005  -6.244   3.173
  318   1HD   LYS1148           HD2      LYS1148  11.323  -5.791   3.792
  319   2HD   LYS1148           HD1      LYS1148  10.816  -4.339   4.658
  320   1HE   LYS1148           HE2      LYS1148  11.168  -6.197   6.196
  321   2HE   LYS1148           HE1      LYS1148   9.474  -5.707   6.172
  322   1HZ   LYS1148           HZ3      LYS1148   8.997  -7.559   4.693
  323   2HZ   LYS1148           HZ2      LYS1148  10.621  -8.031   4.721
  324   3HZ   LYS1148           HZ1      LYS1148   9.695  -8.108   6.135
  325    H    ARG1149           HN       ARG1149  11.940  -6.828   2.183
  326    HA   ARG1149           HA       ARG1149  14.081  -5.034   2.886
  327   1HB   ARG1149           HB2      ARG1149  13.581  -6.878   4.370
  328   2HB   ARG1149           HB1      ARG1149  13.835  -8.039   3.075
  329   1HG   ARG1149           HG2      ARG1149  16.195  -7.432   2.984
  330   2HG   ARG1149           HG1      ARG1149  15.943  -6.252   4.272
  331   1HD   ARG1149           HD2      ARG1149  15.253  -8.052   5.781
  332   2HD   ARG1149           HD1      ARG1149  15.513  -9.229   4.494
  333    HE   ARG1149           HE       ARG1149  17.873  -7.753   4.898
  334   1HH1  ARG1149          1HH1      ARG1149  15.907 -10.172   6.456
  335   2HH1  ARG1149          2HH1      ARG1149  17.233 -10.882   7.314
  336   1HH2  ARG1149          1HH2      ARG1149  19.625  -8.683   6.022
  337   2HH2  ARG1149          2HH2      ARG1149  19.346 -10.036   7.069
  338    H    ILE1150           HN       ILE1150  15.476  -4.320   1.409
  339    HA   ILE1150           HA       ILE1150  16.289  -6.182  -0.724
  340    HB   ILE1150           HB       ILE1150  16.494  -4.472  -2.262
  341   1HG1  ILE1150          2HG1      ILE1150  17.881  -2.981  -0.855
  342   2HG1  ILE1150          1HG1      ILE1150  16.657  -2.099  -1.761
  343   1HG2  ILE1150          3HG2      ILE1150  14.160  -4.847  -1.745
  344   2HG2  ILE1150          2HG2      ILE1150  14.219  -3.615  -0.484
  345   3HG2  ILE1150          1HG2      ILE1150  14.427  -3.156  -2.174
  346   1HD1  ILE1150          1HD1      ILE1150  15.271  -1.991   0.257
  347   2HD1  ILE1150          3HD1      ILE1150  16.543  -2.820   1.155
  348   3HD1  ILE1150          2HD1      ILE1150  16.844  -1.222   0.468
  349    H    THR1151           HN       THR1151  18.508  -5.138  -1.700
  350    HA   THR1151           HA       THR1151  20.355  -4.449   0.422
  351    HB   THR1151           HB       THR1151  20.772  -6.993  -1.160
  352    HG1  THR1151           HG1      THR1151  19.436  -7.717   0.342
  353   1HG2  THR1151          1HG2      THR1151  22.848  -5.843  -0.570
  354   2HG2  THR1151          3HG2      THR1151  22.339  -5.773   1.117
  355   3HG2  THR1151          2HG2      THR1151  22.669  -7.331   0.360
  356    H    CYS1152           HN       CYS1152  22.125  -3.372  -0.326
  357    HA   CYS1152           HA       CYS1152  22.075  -2.537  -3.076
  358   1HB   CYS1152           HB2      CYS1152  22.595  -0.820  -1.551
  359   2HB   CYS1152           HB1      CYS1152  23.778  -1.813  -0.706
  360    H    ARG1153           HN       ARG1153  23.738  -2.722  -4.569
  361    HA   ARG1153           HA       ARG1153  25.836  -4.683  -3.988
  362   1HB   ARG1153           HB2      ARG1153  25.492  -5.626  -6.296
  363   2HB   ARG1153           HB1      ARG1153  24.238  -6.011  -5.128
  364   1HG   ARG1153           HG2      ARG1153  23.956  -3.710  -7.028
  365   2HG   ARG1153           HG1      ARG1153  23.515  -5.356  -7.486
  366   1HD   ARG1153           HD2      ARG1153  22.377  -3.749  -5.200
  367   2HD   ARG1153           HD1      ARG1153  21.558  -4.173  -6.704
  368    HE   ARG1153           HE       ARG1153  22.265  -6.051  -4.553
  369   1HH1  ARG1153          1HH1      ARG1153  20.472  -5.257  -7.432
  370   2HH1  ARG1153          2HH1      ARG1153  19.448  -6.649  -7.333
  371   1HH2  ARG1153          1HH2      ARG1153  20.922  -7.888  -4.415
  372   2HH2  ARG1153          2HH2      ARG1153  19.703  -8.145  -5.619
  373    H    ASN1154           HN       ASN1154  27.637  -3.555  -4.166
  374    HA   ASN1154           HA       ASN1154  29.295  -2.250  -5.002
  375   1HB   ASN1154           HB2      ASN1154  27.812  -2.630  -7.613
  376   2HB   ASN1154           HB1      ASN1154  29.445  -1.990  -7.455
  377   1HD2  ASN1154          1HD2      ASN1154  27.437  -4.812  -7.234
  378   2HD2  ASN1154          2HD2      ASN1154  28.718  -5.970  -7.205
  379    H    GLY1155           HN       GLY1155  27.735  -0.754  -3.621
  380   1HA   GLY1155           HA1      GLY1155  27.958   1.820  -4.657
  381   2HA   GLY1155           HA2      GLY1155  26.968   1.376  -3.277
  382    H    GLN1156           HN       GLN1156  25.348  -0.468  -5.005
  383    HA   GLN1156           HA       GLN1156  23.499   1.557  -5.964
  384   1HB   GLN1156           HB2      GLN1156  24.681  -0.555  -7.771
  385   2HB   GLN1156           HB1      GLN1156  23.213   0.334  -8.151
  386   1HG   GLN1156           HG2      GLN1156  25.930   1.550  -7.712
  387   2HG   GLN1156           HG1      GLN1156  25.172   1.259  -9.277
  388   1HE2  GLN1156          1HE2      GLN1156  22.518   1.986  -8.290
  389   2HE2  GLN1156          2HE2      GLN1156  22.516   3.709  -8.159
  390    H    TRP1157           HN       TRP1157  21.884   0.959  -4.609
  391    HA   TRP1157           HA       TRP1157  21.255  -1.667  -3.839
  392   1HB   TRP1157           HB2      TRP1157  19.504   0.784  -3.942
  393   2HB   TRP1157           HB1      TRP1157  19.048  -0.724  -3.173
  394    HD1  TRP1157           HD1      TRP1157  21.491   2.196  -2.763
  395    HE1  TRP1157           HE1      TRP1157  22.181   2.303  -0.292
  396    HE3  TRP1157           HE3      TRP1157  19.271  -2.095  -1.158
  397    HZ2  TRP1157           HZ2      TRP1157  21.846   0.711   2.051
  398    HZ3  TRP1157           HZ3      TRP1157  19.499  -2.749   1.198
  399    HH2  TRP1157           HH2      TRP1157  20.756  -1.381   2.764
  400    H    SER1158           HN       SER1158  18.650  -2.039  -4.112
  401    HA   SER1158           HA       SER1158  17.972  -2.100  -6.955
  402   1HB   SER1158           HB2      SER1158  17.158  -4.471  -6.623
  403   2HB   SER1158           HB1      SER1158  18.911  -4.278  -6.639
  404    HG   SER1158           HG       SER1158  17.611  -4.119  -4.177
  405    H    GLU1159           HN       GLU1159  16.047  -1.198  -7.155
  406    HA   GLU1159           HA       GLU1159  14.354  -0.305  -5.237
  407   1HB   GLU1159           HB2      GLU1159  14.039   0.331  -7.528
  408   2HB   GLU1159           HB1      GLU1159  13.682  -1.325  -7.997
  409   1HG   GLU1159           HG2      GLU1159  11.618  -1.257  -6.707
  410   2HG   GLU1159           HG1      GLU1159  11.979   0.394  -6.206
  411    HA   PRO1160           HA       PRO1160  12.632  -3.888  -3.264
  412   1HB   PRO1160           HB2      PRO1160  10.361  -2.154  -2.541
  413   2HB   PRO1160           HB1      PRO1160  11.501  -3.003  -1.495
  414   1HG   PRO1160           HG2      PRO1160  11.565  -0.334  -1.785
  415   2HG   PRO1160           HG1      PRO1160  13.041  -1.290  -1.555
  416   1HD   PRO1160           HD2      PRO1160  11.920  -0.100  -4.061
  417   2HD   PRO1160           HD1      PRO1160  13.605  -0.216  -3.517
  418    HA   PRO1161           HA       PRO1161   9.510  -5.911  -5.623
  419   1HB   PRO1161           HB2      PRO1161   7.614  -5.620  -3.331
  420   2HB   PRO1161           HB1      PRO1161   7.993  -7.047  -4.304
  421   1HG   PRO1161           HG2      PRO1161   9.040  -6.764  -1.882
  422   2HG   PRO1161           HG1      PRO1161  10.017  -7.408  -3.216
  423   1HD   PRO1161           HD2      PRO1161  10.088  -4.718  -1.938
  424   2HD   PRO1161           HD1      PRO1161  11.409  -5.671  -2.641
  425    H    LYS1162           HN       LYS1162   6.779  -4.563  -3.986
  426    HA   LYS1162           HA       LYS1162   6.528  -2.257  -5.690
  427   1HB   LYS1162           HB2      LYS1162   5.582  -4.802  -6.597
  428   2HB   LYS1162           HB1      LYS1162   4.211  -3.745  -6.316
  429   1HG   LYS1162           HG2      LYS1162   6.598  -3.008  -7.994
  430   2HG   LYS1162           HG1      LYS1162   5.101  -3.688  -8.637
  431   1HD   LYS1162           HD2      LYS1162   5.236  -1.143  -7.028
  432   2HD   LYS1162           HD1      LYS1162   5.267  -1.196  -8.791
  433   1HE   LYS1162           HE2      LYS1162   3.089  -2.318  -8.791
  434   2HE   LYS1162           HE1      LYS1162   3.057  -2.247  -7.029
  435   1HZ   LYS1162           HZ1      LYS1162   3.112   0.097  -8.852
  436   2HZ   LYS1162           HZ3      LYS1162   1.758  -0.465  -8.007
  437   3HZ   LYS1162           HZ2      LYS1162   3.081   0.166  -7.162
  438    H    CYS1163           HN       CYS1163   4.148  -1.432  -5.576
  439    HA   CYS1163           HA       CYS1163   3.080  -1.879  -2.869
  440   1HB   CYS1163           HB2      CYS1163   3.762   0.681  -4.259
  441   2HB   CYS1163           HB1      CYS1163   2.405   0.654  -3.138
  442    H    LEU1164           HN       LEU1164   0.899  -2.034  -2.686
  443    HA   LEU1164           HA       LEU1164  -0.644  -1.910  -5.185
  444   1HB   LEU1164           HB2      LEU1164  -0.876  -3.542  -2.695
  445   2HB   LEU1164           HB1      LEU1164  -2.322  -3.217  -3.630
  446    HG   LEU1164           HG       LEU1164  -1.311  -5.396  -4.176
  447   1HD1  LEU1164          3HD1      LEU1164  -1.193  -3.381  -6.415
  448   2HD1  LEU1164          2HD1      LEU1164  -1.312  -5.130  -6.607
  449   3HD1  LEU1164          1HD1      LEU1164  -2.632  -4.234  -5.854
  450   1HD2  LEU1164          3HD2      LEU1164   1.026  -4.831  -3.771
  451   2HD2  LEU1164          2HD2      LEU1164   0.802  -5.497  -5.389
  452   3HD2  LEU1164          1HD2      LEU1164   1.016  -3.759  -5.171
  453    H    HIS1165           HN       HIS1165  -1.947  -0.235  -5.453
  454    HA   HIS1165           HA       HIS1165  -2.390   1.797  -3.637
  455   1HB   HIS1165           HB2      HIS1165  -4.198   0.920  -5.900
  456   2HB   HIS1165           HB1      HIS1165  -4.275   2.479  -5.087
  457    HD1  HIS1165           HD1      HIS1165  -2.684   4.276  -5.860
  458    HD2  HIS1165           HD2      HIS1165  -1.849   0.555  -7.512
  459    HE1  HIS1165           HE1      HIS1165  -0.952   4.701  -7.635
  460    HE2  HIS1165           HE2      HIS1165  -0.396   2.423  -8.557
  461    HA   PRO1166           HA       PRO1166  -5.104   0.012  -0.619
  462   1HB   PRO1166           HB2      PRO1166  -6.237   2.354   0.275
  463   2HB   PRO1166           HB1      PRO1166  -4.659   1.755   0.794
  464   1HG   PRO1166           HG2      PRO1166  -5.321   3.804  -1.285
  465   2HG   PRO1166           HG1      PRO1166  -4.039   3.826  -0.059
  466   1HD   PRO1166           HD2      PRO1166  -3.516   3.204  -2.613
  467   2HD   PRO1166           HD1      PRO1166  -2.686   2.386  -1.276
  468    H    CYS1167           HN       CYS1167  -7.448   0.067  -0.021
  469    HA   CYS1167           HA       CYS1167  -9.014  -0.123  -2.402
  470   1HB   CYS1167           HB2      CYS1167 -10.852  -0.555  -0.619
  471   2HB   CYS1167           HB1      CYS1167  -9.585  -1.751  -0.863
  472    H    VAL1168           HN       VAL1168  -8.599   2.245  -2.863
  473    HA   VAL1168           HA       VAL1168 -10.153   4.147  -1.365
  474    HB   VAL1168           HB       VAL1168  -8.821   4.453  -4.063
  475   1HG1  VAL1168          3HG1      VAL1168 -10.607   6.091  -3.640
  476   2HG1  VAL1168          2HG1      VAL1168  -9.803   6.558  -2.141
  477   3HG1  VAL1168          1HG1      VAL1168  -9.010   6.841  -3.690
  478   1HG2  VAL1168          3HG2      VAL1168  -7.842   5.174  -1.303
  479   2HG2  VAL1168          2HG2      VAL1168  -7.205   3.898  -2.339
  480   3HG2  VAL1168          1HG2      VAL1168  -7.033   5.587  -2.815
  481    H    ILE1169           HN       ILE1169 -12.273   3.244  -1.475
  482    HA   ILE1169           HA       ILE1169 -13.499   2.841  -4.057
  483    HB   ILE1169           HB       ILE1169 -14.084   2.020  -1.423
  484   1HG1  ILE1169          2HG1      ILE1169 -15.536   1.611  -4.044
  485   2HG1  ILE1169          1HG1      ILE1169 -14.250   0.607  -3.382
  486   1HG2  ILE1169          3HG2      ILE1169 -15.451   4.037  -1.178
  487   2HG2  ILE1169          2HG2      ILE1169 -16.379   3.575  -2.605
  488   3HG2  ILE1169          1HG2      ILE1169 -16.432   2.571  -1.156
  489   1HD1  ILE1169          2HD1      ILE1169 -16.992   0.954  -2.192
  490   2HD1  ILE1169          1HD1      ILE1169 -16.427  -0.439  -3.114
  491   3HD1  ILE1169          3HD1      ILE1169 -15.703  -0.063  -1.550
  492    H    SER1170           HN       SER1170 -15.490   3.957  -4.694
  493    HA   SER1170           HA       SER1170 -15.128   6.804  -4.506
  494   1HB   SER1170           HB2      SER1170 -17.287   5.186  -5.879
  495   2HB   SER1170           HB1      SER1170 -17.035   6.921  -6.071
  496    HG   SER1170           HG       SER1170 -14.993   5.041  -6.601
  497    H    ARG1171           HN       ARG1171 -15.911   8.033  -2.952
  498    HA   ARG1171           HA       ARG1171 -17.678   7.161  -0.944
  499   1HB   ARG1171           HB2      ARG1171 -17.728   9.529  -0.252
  500   2HB   ARG1171           HB1      ARG1171 -16.094   8.965  -0.567
  501   1HG   ARG1171           HG2      ARG1171 -16.226  10.019  -2.814
  502   2HG   ARG1171           HG1      ARG1171 -17.792  10.690  -2.354
  503   1HD   ARG1171           HD2      ARG1171 -16.138  12.373  -1.995
  504   2HD   ARG1171           HD1      ARG1171 -16.672  11.791  -0.419
  505    HE   ARG1171           HE       ARG1171 -14.511  10.271  -0.867
  506   1HH1  ARG1171          1HH1      ARG1171 -15.028  13.707  -1.142
  507   2HH1  ARG1171          2HH1      ARG1171 -13.390  14.114  -0.759
  508   1HH2  ARG1171          1HH2      ARG1171 -12.352  10.799  -0.360
  509   2HH2  ARG1171          2HH2      ARG1171 -11.868  12.462  -0.314
  510    H    GLU1172           HN       GLU1172 -18.228   9.280  -3.752
  511    HA   GLU1172           HA       GLU1172 -20.977   9.707  -3.201
  512   1HB   GLU1172           HB2      GLU1172 -19.546  11.174  -4.640
  513   2HB   GLU1172           HB1      GLU1172 -19.568   9.918  -5.869
  514   1HG   GLU1172           HG2      GLU1172 -21.995  10.126  -6.042
  515   2HG   GLU1172           HG1      GLU1172 -21.973  11.385  -4.808
  516    H    ILE1173           HN       ILE1173 -19.425   6.941  -4.057
  517    HA   ILE1173           HA       ILE1173 -21.767   5.888  -5.498
  518    HB   ILE1173           HB       ILE1173 -18.934   4.841  -5.530
  519   1HG1  ILE1173          2HG1      ILE1173 -19.447   7.044  -6.691
  520   2HG1  ILE1173          1HG1      ILE1173 -18.726   5.784  -7.693
  521   1HG2  ILE1173          2HG2      ILE1173 -20.579   3.058  -5.786
  522   2HG2  ILE1173          1HG2      ILE1173 -21.364   3.958  -7.084
  523   3HG2  ILE1173          3HG2      ILE1173 -19.723   3.347  -7.301
  524   1HD1  ILE1173          1HD1      ILE1173 -21.640   6.533  -7.602
  525   2HD1  ILE1173          3HD1      ILE1173 -20.495   6.950  -8.875
  526   3HD1  ILE1173          2HD1      ILE1173 -20.935   5.264  -8.603
  527    H    MET1174           HN       MET1174 -20.014   5.817  -2.614
  528    HA   MET1174           HA       MET1174 -21.331   3.323  -1.812
  529   1HB   MET1174           HB2      MET1174 -18.723   3.719  -1.694
  530   2HB   MET1174           HB1      MET1174 -19.143   4.569  -0.213
  531   1HG   MET1174           HG2      MET1174 -19.869   1.723  -0.838
  532   2HG   MET1174           HG1      MET1174 -18.516   2.232   0.167
  533   1HE   MET1174           HE3      MET1174 -19.870   4.783   1.578
  534   2HE   MET1174           HE2      MET1174 -20.474   4.082   3.078
  535   3HE   MET1174           HE1      MET1174 -18.875   3.641   2.481
  536    H    GLU1175           HN       GLU1175 -20.047   6.128  -0.040
  537    HA   GLU1175           HA       GLU1175 -22.014   6.094   1.941
  538   1HB   GLU1175           HB2      GLU1175 -21.034   8.024   2.774
  539   2HB   GLU1175           HB1      GLU1175 -19.715   7.319   1.848
  540   1HG   GLU1175           HG2      GLU1175 -20.074   8.841   0.044
  541   2HG   GLU1175           HG1      GLU1175 -21.548   9.457   0.791
  542    H    ASN1176           HN       ASN1176 -22.336   6.939  -1.288
  543    HA   ASN1176           HA       ASN1176 -24.626   8.696  -0.750
  544   1HB   ASN1176           HB2      ASN1176 -22.768   9.519  -2.238
  545   2HB   ASN1176           HB1      ASN1176 -23.254   8.279  -3.383
  546   1HD2  ASN1176          1HD2      ASN1176 -23.798   9.775  -4.952
  547   2HD2  ASN1176          2HD2      ASN1176 -25.216  10.756  -4.837
  548    H    TYR1177           HN       TYR1177 -23.646   5.696  -2.256
  549    HA   TYR1177           HA       TYR1177 -26.125   5.211  -3.600
  550   1HB   TYR1177           HB2      TYR1177 -23.653   3.643  -3.039
  551   2HB   TYR1177           HB1      TYR1177 -25.109   2.762  -3.484
  552    HD1  TYR1177           HD1      TYR1177 -24.599   6.087  -4.892
  553    HD2  TYR1177           HD2      TYR1177 -23.960   1.922  -5.470
  554    HE1  TYR1177           HE1      TYR1177 -24.106   6.497  -7.265
  555    HE2  TYR1177           HE2      TYR1177 -23.464   2.316  -7.839
  556    HH   TYR1177           HH       TYR1177 -23.946   4.010  -9.566
  557    H    ASN1178           HN       ASN1178 -26.427   5.858  -0.777
  558    HA   ASN1178           HA       ASN1178 -27.669   5.224   0.993
  559   1HB   ASN1178           HB2      ASN1178 -28.700   2.758  -0.298
  560   2HB   ASN1178           HB1      ASN1178 -29.566   4.018   0.574
  561   1HD2  ASN1178          1HD2      ASN1178 -30.022   2.676  -2.031
  562   2HD2  ASN1178          2HD2      ASN1178 -30.196   3.958  -3.172
  563    H    ILE1179           HN       ILE1179 -24.946   3.968   0.406
  564    HA   ILE1179           HA       ILE1179 -25.240   1.799   2.376
  565    HB   ILE1179           HB       ILE1179 -23.222   0.727   1.259
  566   1HG1  ILE1179          2HG1      ILE1179 -24.101   2.452  -1.069
  567   2HG1  ILE1179          1HG1      ILE1179 -22.643   2.731  -0.123
  568   1HG2  ILE1179          2HG2      ILE1179 -25.839   0.851  -0.236
  569   2HG2  ILE1179          1HG2      ILE1179 -24.617  -0.408  -0.417
  570   3HG2  ILE1179          3HG2      ILE1179 -25.457  -0.208   1.121
  571   1HD1  ILE1179          2HD1      ILE1179 -23.212   0.243  -1.715
  572   2HD1  ILE1179          1HD1      ILE1179 -22.201   1.585  -2.249
  573   3HD1  ILE1179          3HD1      ILE1179 -21.724   0.624  -0.849
  574    H    ALA1180           HN       ALA1180 -23.570   1.560   3.887
  575    HA   ALA1180           HA       ALA1180 -21.592   3.739   3.955
  576   1HB   ALA1180           HB1      ALA1180 -23.412   4.293   5.481
  577   2HB   ALA1180           HB3      ALA1180 -23.207   2.745   6.301
  578   3HB   ALA1180           HB2      ALA1180 -21.926   3.955   6.368
  579    H    LEU1181           HN       LEU1181 -20.561   2.853   6.523
  580    HA   LEU1181           HA       LEU1181 -19.172   0.416   5.627
  581   1HB   LEU1181           HB2      LEU1181 -18.292   2.877   6.982
  582   2HB   LEU1181           HB1      LEU1181 -17.620   1.398   7.637
  583    HG   LEU1181           HG       LEU1181 -16.103   2.320   6.005
  584   1HD1  LEU1181          2HD1      LEU1181 -17.522  -0.107   4.925
  585   2HD1  LEU1181          1HD1      LEU1181 -15.897   0.417   4.486
  586   3HD1  LEU1181          3HD1      LEU1181 -16.240  -0.102   6.136
  587   1HD2  LEU1181          1HD2      LEU1181 -18.452   2.225   4.126
  588   2HD2  LEU1181          3HD2      LEU1181 -17.569   3.654   4.668
  589   3HD2  LEU1181          2HD2      LEU1181 -16.782   2.475   3.617
  590    H    ARG1182           HN       ARG1182 -18.307  -0.945   7.483
  591    HA   ARG1182           HA       ARG1182 -20.462  -1.876   9.035
  592   1HB   ARG1182           HB2      ARG1182 -18.927  -3.433   9.997
  593   2HB   ARG1182           HB1      ARG1182 -18.468  -3.229   8.312
  594   1HG   ARG1182           HG2      ARG1182 -16.633  -1.814   8.917
  595   2HG   ARG1182           HG1      ARG1182 -17.148  -1.796  10.604
  596   1HD   ARG1182           HD2      ARG1182 -15.338  -3.331  10.430
  597   2HD   ARG1182           HD1      ARG1182 -16.812  -4.274  10.645
  598    HE   ARG1182           HE       ARG1182 -16.324  -4.011   7.904
  599   1HH1  ARG1182          1HH1      ARG1182 -14.940  -5.542  10.710
  600   2HH1  ARG1182          2HH1      ARG1182 -14.231  -6.841   9.811
  601   1HH2  ARG1182          1HH2      ARG1182 -15.392  -5.718   6.711
  602   2HH2  ARG1182          2HH2      ARG1182 -14.488  -6.942   7.539
  603    H    TRP1183           HN       TRP1183 -18.394   0.733   9.471
  604    HA   TRP1183           HA       TRP1183 -18.719   0.781  12.381
  605   1HB   TRP1183           HB2      TRP1183 -17.214   2.864  10.831
  606   2HB   TRP1183           HB1      TRP1183 -16.930   2.271  12.466
  607    HD1  TRP1183           HD1      TRP1183 -16.498   1.106   8.804
  608    HE1  TRP1183           HE1      TRP1183 -14.543  -0.564   8.719
  609    HE3  TRP1183           HE3      TRP1183 -15.455   0.810  13.803
  610    HZ2  TRP1183           HZ2      TRP1183 -12.786  -1.820  10.515
  611    HZ3  TRP1183           HZ3      TRP1183 -13.614  -0.649  14.535
  612    HH2  TRP1183           HH2      TRP1183 -12.306  -1.937  12.923
  613    H    THR1184           HN       THR1184 -20.092   1.993   9.544
  614    HA   THR1184           HA       THR1184 -21.555   3.675   9.049
  615    HB   THR1184           HB       THR1184 -23.405   3.964  10.645
  616    HG1  THR1184           HG1      THR1184 -22.624   2.132  12.476
  617   1HG2  THR1184          2HG2      THR1184 -22.479   1.101  10.383
  618   2HG2  THR1184          1HG2      THR1184 -24.126   1.621  10.745
  619   3HG2  THR1184          3HG2      THR1184 -23.402   2.007   9.183
  620    H    ALA1185           HN       ALA1185 -19.850   5.274   8.965
  621    HA   ALA1185           HA       ALA1185 -20.275   7.375  10.957
  622   1HB   ALA1185           HB1      ALA1185 -17.534   6.441  10.118
  623   2HB   ALA1185           HB2      ALA1185 -18.281   6.159  11.690
  624   3HB   ALA1185           HB3      ALA1185 -17.890   7.801  11.182
  625    H    LYS1186           HN       LYS1186 -20.501   6.581   7.872
  626    HA   LYS1186           HA       LYS1186 -20.746   7.771   5.960
  627   1HB   LYS1186           HB2      LYS1186 -21.702   9.546   7.382
  628   2HB   LYS1186           HB1      LYS1186 -20.088  10.181   7.665
  629   1HG   LYS1186           HG2      LYS1186 -19.857  10.696   5.299
  630   2HG   LYS1186           HG1      LYS1186 -21.458  10.021   4.987
  631   1HD   LYS1186           HD2      LYS1186 -22.445  11.717   6.468
  632   2HD   LYS1186           HD1      LYS1186 -20.840  12.402   6.736
  633   1HE   LYS1186           HE2      LYS1186 -20.649  12.897   4.351
  634   2HE   LYS1186           HE1      LYS1186 -22.247  12.204   4.076
  635   1HZ   LYS1186           HZ1      LYS1186 -21.660  14.578   5.761
  636   2HZ   LYS1186           HZ3      LYS1186 -22.340  14.612   4.212
  637   3HZ   LYS1186           HZ2      LYS1186 -23.192  13.915   5.496
  638    H    GLN1187           HN       GLN1187 -19.211   7.133   4.651
  639    HA   GLN1187           HA       GLN1187 -17.289   7.097   3.452
  640   1HB   GLN1187           HB2      GLN1187 -17.537   9.500   3.246
  641   2HB   GLN1187           HB1      GLN1187 -16.778   9.743   4.814
  642   1HG   GLN1187           HG2      GLN1187 -14.677   8.975   4.002
  643   2HG   GLN1187           HG1      GLN1187 -15.398   8.440   2.484
  644   1HE2  GLN1187          1HE2      GLN1187 -16.267  11.437   4.039
  645   2HE2  GLN1187          2HE2      GLN1187 -15.537  12.484   2.876
  646    H    LYS1188           HN       LYS1188 -16.511   5.291   4.460
  647    HA   LYS1188           HA       LYS1188 -14.074   5.689   5.991
  648   1HB   LYS1188           HB2      LYS1188 -15.938   5.406   7.663
  649   2HB   LYS1188           HB1      LYS1188 -16.237   3.815   6.981
  650   1HG   LYS1188           HG2      LYS1188 -14.949   3.435   8.897
  651   2HG   LYS1188           HG1      LYS1188 -13.821   3.278   7.550
  652   1HD   LYS1188           HD2      LYS1188 -14.144   5.921   8.906
  653   2HD   LYS1188           HD1      LYS1188 -13.162   4.666   9.663
  654   1HE   LYS1188           HE2      LYS1188 -12.778   5.792   6.891
  655   2HE   LYS1188           HE1      LYS1188 -11.790   6.157   8.306
  656   1HZ   LYS1188           HZ2      LYS1188 -12.082   3.479   7.054
  657   2HZ   LYS1188           HZ1      LYS1188 -10.743   4.501   6.894
  658   3HZ   LYS1188           HZ3      LYS1188 -11.128   3.839   8.403
  659    H    LEU1189           HN       LEU1189 -14.909   4.883   3.340
  660    HA   LEU1189           HA       LEU1189 -14.382   2.034   3.153
  661   1HB   LEU1189           HB2      LEU1189 -14.634   2.728   0.618
  662   2HB   LEU1189           HB1      LEU1189 -16.019   2.474   1.657
  663    HG   LEU1189           HG       LEU1189 -16.097   4.508   0.155
  664   1HD1  LEU1189          3HD1      LEU1189 -17.565   4.213   2.092
  665   2HD1  LEU1189          2HD1      LEU1189 -16.370   5.026   3.102
  666   3HD1  LEU1189          1HD1      LEU1189 -17.167   5.906   1.798
  667   1HD2  LEU1189          2HD2      LEU1189 -14.075   5.557   2.117
  668   2HD2  LEU1189          1HD2      LEU1189 -13.808   5.252   0.402
  669   3HD2  LEU1189          3HD2      LEU1189 -14.932   6.512   0.908
  670    H    TYR1190           HN       TYR1190 -12.228   3.868   4.005
  671    HA   TYR1190           HA       TYR1190 -10.366   3.361   1.780
  672   1HB   TYR1190           HB2      TYR1190 -10.481   5.648   3.729
  673   2HB   TYR1190           HB1      TYR1190  -9.000   5.251   2.865
  674    HD1  TYR1190           HD1      TYR1190 -11.528   4.388   0.656
  675    HD2  TYR1190           HD2      TYR1190  -9.684   7.833   2.364
  676    HE1  TYR1190           HE1      TYR1190 -12.272   5.741  -1.259
  677    HE2  TYR1190           HE2      TYR1190 -10.431   9.186   0.454
  678    HH   TYR1190           HH       TYR1190 -11.093   8.854  -1.891
  679    H    SER1191           HN       SER1191  -9.433   1.485   2.324
  680    HA   SER1191           HA       SER1191  -8.038   1.385   4.918
  681   1HB   SER1191           HB2      SER1191  -9.612  -0.737   3.532
  682   2HB   SER1191           HB1      SER1191  -8.292  -1.186   4.602
  683    HG   SER1191           HG       SER1191 -10.622   0.308   5.237
  684    H    ARG1192           HN       ARG1192  -6.242  -0.312   4.873
  685    HA   ARG1192           HA       ARG1192  -4.584   0.236   2.567
  686   1HB   ARG1192           HB2      ARG1192  -4.118  -1.042   5.254
  687   2HB   ARG1192           HB1      ARG1192  -2.911  -1.109   3.985
  688   1HG   ARG1192           HG2      ARG1192  -2.840   1.336   3.923
  689   2HG   ARG1192           HG1      ARG1192  -4.048   1.393   5.208
  690   1HD   ARG1192           HD2      ARG1192  -2.515   0.208   6.701
  691   2HD   ARG1192           HD1      ARG1192  -1.308   0.151   5.417
  692    HE   ARG1192           HE       ARG1192  -2.061   2.821   5.854
  693   1HH1  ARG1192          1HH1      ARG1192  -0.324   0.235   7.413
  694   2HH1  ARG1192          2HH1      ARG1192   0.715   1.297   8.303
  695   1HH2  ARG1192          1HH2      ARG1192  -0.696   4.227   7.019
  696   2HH2  ARG1192          2HH2      ARG1192   0.504   3.565   8.079
  697    H    THR1193           HN       THR1193  -4.465  -1.110   0.892
  698    HA   THR1193           HA       THR1193  -5.951  -3.275   0.380
  699    HB   THR1193           HB       THR1193  -3.064  -2.930  -0.462
  700    HG1  THR1193           HG1      THR1193  -5.406  -1.738  -1.175
  701   1HG2  THR1193          3HG2      THR1193  -3.798  -5.252  -0.773
  702   2HG2  THR1193          2HG2      THR1193  -5.209  -4.685  -1.666
  703   3HG2  THR1193          1HG2      THR1193  -3.590  -4.431  -2.320
  704    H    GLY1194           HN       GLY1194  -6.253  -5.205   1.236
  705   1HA   GLY1194           HA1      GLY1194  -4.078  -6.364   2.862
  706   2HA   GLY1194           HA2      GLY1194  -5.084  -7.347   1.805
  707    H    GLU1195           HN       GLU1195  -6.390  -4.685   3.609
  708    HA   GLU1195           HA       GLU1195  -7.423  -6.429   5.700
  709   1HB   GLU1195           HB2      GLU1195  -7.635  -3.435   5.311
  710   2HB   GLU1195           HB1      GLU1195  -8.271  -4.316   6.695
  711   1HG   GLU1195           HG2      GLU1195  -5.372  -4.170   5.895
  712   2HG   GLU1195           HG1      GLU1195  -6.133  -3.235   7.182
  713    H    SER1196           HN       SER1196  -9.636  -6.688   6.125
  714    HA   SER1196           HA       SER1196 -11.291  -6.620   3.750
  715   1HB   SER1196           HB2      SER1196 -11.898  -7.630   6.540
  716   2HB   SER1196           HB1      SER1196 -12.916  -7.867   5.119
  717    HG   SER1196           HG       SER1196 -10.279  -8.841   5.501
  718    H    VAL1197           HN       VAL1197 -12.953  -5.278   3.351
  719    HA   VAL1197           HA       VAL1197 -13.668  -3.332   5.445
  720    HB   VAL1197           HB       VAL1197 -13.381  -2.850   2.477
  721   1HG1  VAL1197          2HG1      VAL1197 -14.435  -0.992   4.608
  722   2HG1  VAL1197          1HG1      VAL1197 -14.093  -0.549   2.936
  723   3HG1  VAL1197          3HG1      VAL1197 -15.370  -1.710   3.297
  724   1HG2  VAL1197          2HG2      VAL1197 -11.285  -2.805   3.712
  725   2HG2  VAL1197          1HG2      VAL1197 -11.726  -1.184   3.173
  726   3HG2  VAL1197          3HG2      VAL1197 -11.970  -1.651   4.857
  727    H    GLU1198           HN       GLU1198 -15.610  -3.929   6.148
  728    HA   GLU1198           HA       GLU1198 -17.576  -5.006   4.286
  729   1HB   GLU1198           HB2      GLU1198 -17.760  -6.319   6.132
  730   2HB   GLU1198           HB1      GLU1198 -17.177  -5.063   7.215
  731   1HG   GLU1198           HG2      GLU1198 -19.330  -3.999   7.234
  732   2HG   GLU1198           HG1      GLU1198 -19.936  -5.126   6.013
  733    H    PHE1199           HN       PHE1199 -19.244  -3.887   3.516
  734    HA   PHE1199           HA       PHE1199 -19.673  -1.174   4.553
  735   1HB   PHE1199           HB2      PHE1199 -20.521  -2.387   1.912
  736   2HB   PHE1199           HB1      PHE1199 -20.757  -0.713   2.396
  737    HD1  PHE1199           HD1      PHE1199 -19.163   0.880   1.887
  738    HD2  PHE1199           HD2      PHE1199 -18.093  -3.232   1.792
  739    HE1  PHE1199           HE1      PHE1199 -16.993   1.484   0.889
  740    HE2  PHE1199           HE2      PHE1199 -15.922  -2.649   0.809
  741    HZ   PHE1199           HZ       PHE1199 -15.362  -0.293   0.357
  742    H    VAL1200           HN       VAL1200 -21.723  -0.469   5.120
  743    HA   VAL1200           HA       VAL1200 -23.737  -2.590   5.470
  744    HB   VAL1200           HB       VAL1200 -24.689  -1.258   7.263
  745   1HG1  VAL1200          1HG1      VAL1200 -22.908  -2.814   7.838
  746   2HG1  VAL1200          3HG1      VAL1200 -21.702  -1.558   7.559
  747   3HG1  VAL1200          2HG1      VAL1200 -22.856  -1.394   8.883
  748   1HG2  VAL1200          1HG2      VAL1200 -24.208   0.961   6.379
  749   2HG2  VAL1200          3HG2      VAL1200 -23.626   0.804   8.035
  750   3HG2  VAL1200          2HG2      VAL1200 -22.489   0.724   6.690
  751    H    CYS1201           HN       CYS1201 -25.913  -0.830   5.981
  752    HA   CYS1201           HA       CYS1201 -26.163   0.534   3.397
  753   1HB   CYS1201           HB2      CYS1201 -27.450  -1.331   2.933
  754   2HB   CYS1201           HB1      CYS1201 -28.039  -1.480   4.582
  755    H    LYS1202           HN       LYS1202 -26.836   2.510   3.483
  756    HA   LYS1202           HA       LYS1202 -27.062   4.111   5.625
  757   1HB   LYS1202           HB2      LYS1202 -27.134   4.707   3.152
  758   2HB   LYS1202           HB1      LYS1202 -28.865   4.424   3.231
  759   1HG   LYS1202           HG2      LYS1202 -29.113   6.199   4.859
  760   2HG   LYS1202           HG1      LYS1202 -27.366   6.458   4.864
  761   1HD   LYS1202           HD2      LYS1202 -29.155   6.751   2.451
  762   2HD   LYS1202           HD1      LYS1202 -28.571   8.086   3.441
  763   1HE   LYS1202           HE2      LYS1202 -26.268   7.514   2.891
  764   2HE   LYS1202           HE1      LYS1202 -26.834   6.162   1.910
  765   1HZ   LYS1202           HZ2      LYS1202 -27.967   7.735   0.466
  766   2HZ   LYS1202           HZ1      LYS1202 -27.422   9.030   1.406
  767   3HZ   LYS1202           HZ3      LYS1202 -26.314   8.083   0.546
  768    H    ARG1203           HN       ARG1203 -28.157   3.670   7.401
  769    HA   ARG1203           HA       ARG1203 -30.073   2.308   8.311
  770   1HB   ARG1203           HB2      ARG1203 -31.077   4.234   9.545
  771   2HB   ARG1203           HB1      ARG1203 -29.331   4.142   9.612
  772   1HG   ARG1203           HG2      ARG1203 -29.106   5.894   7.996
  773   2HG   ARG1203           HG1      ARG1203 -30.850   5.923   7.736
  774   1HD   ARG1203           HD2      ARG1203 -30.156   7.759   9.179
  775   2HD   ARG1203           HD1      ARG1203 -31.188   6.627  10.052
  776    HE   ARG1203           HE       ARG1203 -28.562   5.854  10.509
  777   1HH1  ARG1203          1HH1      ARG1203 -30.601   8.606  11.150
  778   2HH1  ARG1203          2HH1      ARG1203 -29.761   9.053  12.598
  779   1HH2  ARG1203          1HH2      ARG1203 -27.452   6.435  12.413
  780   2HH2  ARG1203          2HH2      ARG1203 -27.971   7.819  13.316
  781    H    GLY1204           HN       GLY1204 -31.926   1.468   7.685
  782   1HA   GLY1204           HA1      GLY1204 -33.858   3.203   6.304
  783   2HA   GLY1204           HA2      GLY1204 -34.277   1.801   7.273
  784    H    TYR1205           HN       TYR1205 -32.372   2.621   4.367
  785    HA   TYR1205           HA       TYR1205 -33.812   1.140   2.558
  786   1HB   TYR1205           HB2      TYR1205 -30.822   1.491   2.491
  787   2HB   TYR1205           HB1      TYR1205 -31.851   1.134   1.121
  788    HD1  TYR1205           HD1      TYR1205 -30.423   3.705   3.189
  789    HD2  TYR1205           HD2      TYR1205 -33.450   2.910   0.317
  790    HE1  TYR1205           HE1      TYR1205 -30.596   6.110   2.717
  791    HE2  TYR1205           HE2      TYR1205 -33.640   5.313  -0.161
  792    HH   TYR1205           HH       TYR1205 -33.155   7.455   0.944
  793    H    ARG1206           HN       ARG1206 -33.175  -0.882   1.424
  794    HA   ARG1206           HA       ARG1206 -32.114  -2.866   3.315
  795   1HB   ARG1206           HB2      ARG1206 -33.849  -4.409   2.795
  796   2HB   ARG1206           HB1      ARG1206 -34.624  -2.877   3.175
  797   1HG   ARG1206           HG2      ARG1206 -35.017  -2.430   0.854
  798   2HG   ARG1206           HG1      ARG1206 -34.095  -3.859   0.383
  799   1HD   ARG1206           HD2      ARG1206 -36.479  -4.306   0.260
  800   2HD   ARG1206           HD1      ARG1206 -35.728  -5.282   1.522
  801    HE   ARG1206           HE       ARG1206 -36.676  -2.954   2.717
  802   1HH1  ARG1206          1HH1      ARG1206 -37.946  -5.756   1.081
  803   2HH1  ARG1206          2HH1      ARG1206 -39.450  -5.735   1.940
  804   1HH2  ARG1206          1HH2      ARG1206 -38.653  -2.918   3.853
  805   2HH2  ARG1206          2HH2      ARG1206 -39.852  -4.122   3.515
  806    H    LEU1207           HN       LEU1207 -30.633  -4.182   2.541
  807    HA   LEU1207           HA       LEU1207 -29.326  -3.896   0.148
  808   1HB   LEU1207           HB2      LEU1207 -28.951  -5.435   2.326
  809   2HB   LEU1207           HB1      LEU1207 -29.502  -6.662   1.205
  810    HG   LEU1207           HG       LEU1207 -27.054  -6.531   1.304
  811   1HD1  LEU1207          2HD1      LEU1207 -28.148  -7.272  -0.754
  812   2HD1  LEU1207          1HD1      LEU1207 -28.152  -5.609  -1.343
  813   3HD1  LEU1207          3HD1      LEU1207 -26.621  -6.446  -1.075
  814   1HD2  LEU1207          2HD2      LEU1207 -26.939  -4.101   1.805
  815   2HD2  LEU1207          1HD2      LEU1207 -25.836  -4.629   0.531
  816   3HD2  LEU1207          3HD2      LEU1207 -27.328  -3.781   0.114
  817    H    SER1208           HN       SER1208 -30.081  -4.056  -1.858
  818    HA   SER1208           HA       SER1208 -32.483  -5.370  -2.546
  819   1HB   SER1208           HB2      SER1208 -31.670  -3.456  -3.814
  820   2HB   SER1208           HB1      SER1208 -30.246  -4.365  -4.317
  821    HG   SER1208           HG       SER1208 -31.448  -4.921  -5.945
  822    H    SER1209           HN       SER1209 -29.666  -6.775  -1.721
  823    HA   SER1209           HA       SER1209 -28.943  -8.931  -1.811
  824   1HB   SER1209           HB2      SER1209 -31.276  -9.660  -1.929
  825   2HB   SER1209           HB1      SER1209 -31.287  -9.384  -3.672
  826    HG   SER1209           HG       SER1209 -29.626 -10.985  -3.823
  827    H    ARG1210           HN       ARG1210 -30.050  -7.858  -5.026
  828    HA   ARG1210           HA       ARG1210 -27.945  -9.160  -6.417
  829   1HB   ARG1210           HB2      ARG1210 -28.719  -7.912  -8.362
  830   2HB   ARG1210           HB1      ARG1210 -30.086  -8.581  -7.481
  831   1HG   ARG1210           HG2      ARG1210 -30.503  -6.404  -6.459
  832   2HG   ARG1210           HG1      ARG1210 -29.131  -5.729  -7.344
  833   1HD   ARG1210           HD2      ARG1210 -31.612  -6.931  -8.569
  834   2HD   ARG1210           HD1      ARG1210 -31.250  -5.210  -8.448
  835    HE   ARG1210           HE       ARG1210 -29.138  -6.471  -9.785
  836   1HH1  ARG1210          1HH1      ARG1210 -32.502  -5.698 -10.260
  837   2HH1  ARG1210          2HH1      ARG1210 -32.368  -5.596 -11.984
  838   1HH2  ARG1210          1HH2      ARG1210 -28.952  -6.338 -12.054
  839   2HH2  ARG1210          2HH2      ARG1210 -30.351  -5.961 -13.004
  840    H    SER1211           HN       SER1211 -27.874  -6.604  -4.365
  841    HA   SER1211           HA       SER1211 -26.295  -4.664  -5.583
  842   1HB   SER1211           HB2      SER1211 -26.454  -5.580  -2.708
  843   2HB   SER1211           HB1      SER1211 -25.528  -4.168  -3.216
  844    HG   SER1211           HG       SER1211 -28.148  -4.292  -4.106
  845    H    HIS1212           HN       HIS1212 -23.965  -4.201  -4.856
  846    HA   HIS1212           HA       HIS1212 -22.353  -6.442  -5.703
  847   1HB   HIS1212           HB2      HIS1212 -21.560  -3.625  -4.932
  848   2HB   HIS1212           HB1      HIS1212 -20.491  -4.821  -5.659
  849    HD1  HIS1212           HD1      HIS1212 -22.989  -2.262  -6.486
  850    HD2  HIS1212           HD2      HIS1212 -21.158  -5.470  -8.389
  851    HE1  HIS1212           HE1      HIS1212 -23.431  -1.930  -8.940
  852    HE2  HIS1212           HE2      HIS1212 -22.237  -3.834 -10.076
  853    H    THR1213           HN       THR1213 -23.409  -7.271  -3.438
  854    HA   THR1213           HA       THR1213 -23.036  -8.049  -1.340
  855    HB   THR1213           HB       THR1213 -20.683  -8.656  -0.782
  856    HG1  THR1213           HG1      THR1213 -19.083  -7.841  -1.907
  857   1HG2  THR1213          1HG2      THR1213 -21.624  -9.409  -3.549
  858   2HG2  THR1213          3HG2      THR1213 -20.424 -10.286  -2.598
  859   3HG2  THR1213          2HG2      THR1213 -22.093 -10.191  -2.038
  860    H    LEU1214           HN       LEU1214 -21.706  -7.695   0.753
  861    HA   LEU1214           HA       LEU1214 -21.627  -4.797   1.243
  862   1HB   LEU1214           HB2      LEU1214 -22.149  -7.140   3.061
  863   2HB   LEU1214           HB1      LEU1214 -21.809  -5.535   3.678
  864    HG   LEU1214           HG       LEU1214 -24.183  -5.878   3.695
  865   1HD1  LEU1214          3HD1      LEU1214 -23.312  -4.062   1.455
  866   2HD1  LEU1214          2HD1      LEU1214 -24.919  -4.052   2.183
  867   3HD1  LEU1214          1HD1      LEU1214 -23.506  -3.640   3.156
  868   1HD2  LEU1214          3HD2      LEU1214 -24.288  -7.659   2.025
  869   2HD2  LEU1214          2HD2      LEU1214 -25.451  -6.379   1.680
  870   3HD2  LEU1214          1HD2      LEU1214 -23.955  -6.484   0.752
  871    H    ARG1215           HN       ARG1215 -20.151  -7.653   2.734
  872    HA   ARG1215           HA       ARG1215 -17.750  -6.173   3.343
  873   1HB   ARG1215           HB2      ARG1215 -18.618  -7.826   4.926
  874   2HB   ARG1215           HB1      ARG1215 -18.408  -9.098   3.732
  875   1HG   ARG1215           HG2      ARG1215 -15.985  -8.707   3.764
  876   2HG   ARG1215           HG1      ARG1215 -16.216  -7.465   4.996
  877   1HD   ARG1215           HD2      ARG1215 -15.537  -9.574   6.006
  878   2HD   ARG1215           HD1      ARG1215 -17.169  -9.131   6.506
  879    HE   ARG1215           HE       ARG1215 -17.396 -10.785   4.281
  880   1HH1  ARG1215          1HH1      ARG1215 -16.252 -10.975   7.565
  881   2HH1  ARG1215          2HH1      ARG1215 -16.614 -12.661   7.731
  882   1HH2  ARG1215          1HH2      ARG1215 -17.876 -13.005   4.488
  883   2HH2  ARG1215          2HH2      ARG1215 -17.536 -13.814   5.982
  884    H    THR1216           HN       THR1216 -15.941  -6.083   2.188
  885    HA   THR1216           HA       THR1216 -15.432  -8.142   0.160
  886    HB   THR1216           HB       THR1216 -16.446  -6.263  -1.030
  887    HG1  THR1216           HG1      THR1216 -14.623  -7.467  -1.948
  888   1HG2  THR1216          1HG2      THR1216 -15.856  -4.465   0.516
  889   2HG2  THR1216          3HG2      THR1216 -14.159  -4.631   0.067
  890   3HG2  THR1216          2HG2      THR1216 -15.337  -4.085  -1.126
  891    H    THR1217           HN       THR1217 -13.130  -7.270  -0.911
  892    HA   THR1217           HA       THR1217 -11.318  -6.978   1.396
  893    HB   THR1217           HB       THR1217 -11.083  -8.758  -1.018
  894    HG1  THR1217           HG1      THR1217 -10.623  -9.286   1.741
  895   1HG2  THR1217          2HG2      THR1217  -8.971  -7.467  -0.768
  896   2HG2  THR1217          1HG2      THR1217  -8.837  -8.074   0.883
  897   3HG2  THR1217          3HG2      THR1217  -8.768  -9.195  -0.477
  898    H    CYS1218           HN       CYS1218  -9.542  -5.677   1.189
  899    HA   CYS1218           HA       CYS1218  -9.626  -3.679  -0.891
  900   1HB   CYS1218           HB2      CYS1218  -7.722  -4.096   1.425
  901   2HB   CYS1218           HB1      CYS1218  -7.685  -2.710   0.341
  902    H    TRP1219           HN       TRP1219  -8.741  -4.085  -2.842
  903    HA   TRP1219           HA       TRP1219  -6.033  -5.071  -2.963
  904   1HB   TRP1219           HB2      TRP1219  -7.923  -7.016  -2.960
  905   2HB   TRP1219           HB1      TRP1219  -7.801  -6.688  -4.686
  906    HD1  TRP1219           HD1      TRP1219  -5.253  -6.949  -5.756
  907    HE1  TRP1219           HE1      TRP1219  -3.403  -8.619  -5.119
  908    HE3  TRP1219           HE3      TRP1219  -6.932  -8.323  -1.124
  909    HZ2  TRP1219           HZ2      TRP1219  -2.739 -10.289  -2.965
  910    HZ3  TRP1219           HZ3      TRP1219  -5.627  -9.967   0.160
  911    HH2  TRP1219           HH2      TRP1219  -3.572 -10.930  -0.743
  912    H    ASP1220           HN       ASP1220  -4.995  -4.086  -4.537
  913    HA   ASP1220           HA       ASP1220  -4.549  -2.813  -6.368
  914   1HB   ASP1220           HB2      ASP1220  -5.325  -4.942  -7.457
  915   2HB   ASP1220           HB1      ASP1220  -6.924  -4.219  -7.603
  916    H    GLY1221           HN       GLY1221  -6.632  -1.953  -4.358
  917   1HA   GLY1221           HA1      GLY1221  -7.295   0.520  -5.551
  918   2HA   GLY1221           HA2      GLY1221  -7.918  -0.081  -4.022
  919    H    LYS1222           HN       LYS1222  -9.237  -2.376  -4.913
  920    HA   LYS1222           HA       LYS1222 -11.501  -1.140  -6.304
  921   1HB   LYS1222           HB2      LYS1222  -9.796  -2.957  -7.552
  922   2HB   LYS1222           HB1      LYS1222 -11.180  -3.923  -7.057
  923   1HG   LYS1222           HG2      LYS1222 -11.348  -1.392  -8.672
  924   2HG   LYS1222           HG1      LYS1222 -11.387  -3.026  -9.338
  925   1HD   LYS1222           HD2      LYS1222 -13.405  -3.505  -8.031
  926   2HD   LYS1222           HD1      LYS1222 -13.367  -1.866  -7.377
  927   1HE   LYS1222           HE2      LYS1222 -14.967  -2.040  -9.207
  928   2HE   LYS1222           HE1      LYS1222 -13.641  -0.955  -9.624
  929   1HZ   LYS1222           HZ1      LYS1222 -13.893  -3.785 -10.489
  930   2HZ   LYS1222           HZ3      LYS1222 -14.187  -2.428 -11.456
  931   3HZ   LYS1222           HZ2      LYS1222 -12.624  -2.742 -10.892
  932    H    LEU1223           HN       LEU1223 -13.462  -1.730  -5.538
  933    HA   LEU1223           HA       LEU1223 -13.684  -4.080  -3.822
  934   1HB   LEU1223           HB2      LEU1223 -14.679  -1.405  -2.886
  935   2HB   LEU1223           HB1      LEU1223 -14.667  -2.915  -1.999
  936    HG   LEU1223           HG       LEU1223 -12.048  -2.696  -2.367
  937   1HD1  LEU1223          1HD1      LEU1223 -12.296  -0.632  -3.712
  938   2HD1  LEU1223          3HD1      LEU1223 -12.967   0.173  -2.293
  939   3HD1  LEU1223          2HD1      LEU1223 -11.304  -0.412  -2.272
  940   1HD2  LEU1223          1HD2      LEU1223 -13.278  -2.869  -0.243
  941   2HD2  LEU1223          3HD2      LEU1223 -11.927  -1.740  -0.154
  942   3HD2  LEU1223          2HD2      LEU1223 -13.576  -1.131  -0.295
  943    H    GLU1224           HN       GLU1224 -16.076  -4.196  -3.020
  944    HA   GLU1224           HA       GLU1224 -17.810  -3.606  -5.327
  945   1HB   GLU1224           HB2      GLU1224 -17.860  -5.911  -3.376
  946   2HB   GLU1224           HB1      GLU1224 -19.170  -5.572  -4.497
  947   1HG   GLU1224           HG2      GLU1224 -17.770  -7.305  -5.386
  948   2HG   GLU1224           HG1      GLU1224 -17.610  -5.854  -6.375
  949    H    TYR1225           HN       TYR1225 -18.761  -1.698  -4.699
  950    HA   TYR1225           HA       TYR1225 -19.757  -1.373  -2.007
  951   1HB   TYR1225           HB2      TYR1225 -20.827   0.747  -3.255
  952   2HB   TYR1225           HB1      TYR1225 -19.155   0.714  -2.704
  953    HD1  TYR1225           HD1      TYR1225 -17.534   1.374  -4.181
  954    HD2  TYR1225           HD2      TYR1225 -21.169  -0.210  -5.706
  955    HE1  TYR1225           HE1      TYR1225 -16.765   1.845  -6.463
  956    HE2  TYR1225           HE2      TYR1225 -20.411   0.245  -8.004
  957    HH   TYR1225           HH       TYR1225 -17.200   1.049  -8.754
  958    HA   PRO1226           HA       PRO1226 -23.636  -3.421  -2.830
  959   1HB   PRO1226           HB2      PRO1226 -24.845  -2.423  -0.541
  960   2HB   PRO1226           HB1      PRO1226 -23.869  -3.894  -0.616
  961   1HG   PRO1226           HG2      PRO1226 -23.090  -1.139   0.248
  962   2HG   PRO1226           HG1      PRO1226 -22.631  -2.705   0.942
  963   1HD   PRO1226           HD2      PRO1226 -20.949  -1.322  -0.605
  964   2HD   PRO1226           HD1      PRO1226 -21.030  -3.094  -0.691
  965    H    THR1227           HN       THR1227 -26.034  -2.369  -1.965
  966    HA   THR1227           HA       THR1227 -26.261   0.305  -3.118
  967    HB   THR1227           HB       THR1227 -28.019  -1.971  -4.043
  968    HG1  THR1227           HG1      THR1227 -26.823  -1.351  -6.105
  969   1HG2  THR1227          2HG2      THR1227 -29.110   0.221  -4.050
  970   2HG2  THR1227          1HG2      THR1227 -27.773   0.887  -4.989
  971   3HG2  THR1227          3HG2      THR1227 -28.817  -0.346  -5.694
  972    H    CYS1228           HN       CYS1228 -28.636  -2.182  -2.346
  973    HA   CYS1228           HA       CYS1228 -30.322  -2.310  -0.827
  974   1HB   CYS1228           HB2      CYS1228 -29.741  -1.891   1.350
  975   2HB   CYS1228           HB1      CYS1228 -28.153  -1.663   0.629
  976    H    ALA1229           HN       ALA1229 -32.266  -1.177  -0.162
  977    HA   ALA1229           HA       ALA1229 -32.519   1.633  -0.686
  978   1HB   ALA1229           HB2      ALA1229 -33.851  -0.301  -2.567
  979   2HB   ALA1229           HB3      ALA1229 -32.508   0.770  -2.962
  980   3HB   ALA1229           HB1      ALA1229 -34.083   1.448  -2.546
  981    H    LYS1230           HN       LYS1230 -34.593   2.481  -0.229
  982    HA   LYS1230           HA       LYS1230 -36.726   2.543   0.582
  983   1HB   LYS1230           HB2      LYS1230 -36.339  -0.349   1.302
  984   2HB   LYS1230           HB1      LYS1230 -37.828   0.555   1.540
  985   1HG   LYS1230           HG2      LYS1230 -37.981   0.908  -0.880
  986   2HG   LYS1230           HG1      LYS1230 -36.499  -0.026  -1.095
  987   1HD   LYS1230           HD2      LYS1230 -37.591  -1.987  -0.122
  988   2HD   LYS1230           HD1      LYS1230 -39.073  -1.053   0.101
  989   1HE   LYS1230           HE2      LYS1230 -39.227  -0.724  -2.318
  990   2HE   LYS1230           HE1      LYS1230 -37.748  -1.659  -2.540
  991   1HZ   LYS1230           HZ3      LYS1230 -38.867  -3.583  -1.597
  992   2HZ   LYS1230           HZ2      LYS1230 -40.285  -2.685  -1.386
  993   3HZ   LYS1230           HZ1      LYS1230 -39.710  -3.002  -2.945
  994    H    ARG1231           HN       ARG1231 -35.022   3.836   1.914
  995    HA   ARG1231           HA       ARG1231 -34.515   2.967   4.542
  996   1HB   ARG1231           HB2      ARG1231 -33.317   4.877   4.745
  997   2HB   ARG1231           HB1      ARG1231 -33.476   4.886   3.001
  998   1HG   ARG1231           HG2      ARG1231 -35.358   6.407   3.142
  999   2HG   ARG1231           HG1      ARG1231 -35.254   6.390   4.904
 1000   1HD   ARG1231           HD2      ARG1231 -33.107   7.360   3.022
 1001   2HD   ARG1231           HD1      ARG1231 -34.200   8.385   3.951
 1002    HE   ARG1231           HE       ARG1231 -32.837   6.649   5.695
 1003   1HH1  ARG1231          1HH1      ARG1231 -32.271   9.427   3.668
 1004   2HH1  ARG1231          2HH1      ARG1231 -30.965  10.026   4.634
 1005   1HH2  ARG1231          1HH2      ARG1231 -31.119   7.432   6.972
 1006   2HH2  ARG1231          2HH2      ARG1231 -30.308   8.892   6.511

  No H/Q in entry =        1006
  Start of MODEL   21
    1    H1   GLU1103           HT2      GLU1103  44.693   0.409  -4.058
    2    H2   GLU1103           HT1      GLU1103  43.669   1.679  -4.500
    3    H3   GLU1103           HT3      GLU1103  44.754   1.875  -3.218
    4    HA   GLU1103           HA       GLU1103  43.601   0.249  -1.909
    5   1HB   GLU1103           HB2      GLU1103  41.862   2.414  -3.098
    6   2HB   GLU1103           HB1      GLU1103  41.381   1.449  -1.711
    7   1HG   GLU1103           HG2      GLU1103  42.237   3.514  -0.910
    8   2HG   GLU1103           HG1      GLU1103  43.410   2.255  -0.524
    9    H    ALA1104           HN       ALA1104  41.228  -0.651  -1.699
   10    HA   ALA1104           HA       ALA1104  40.888  -2.455  -3.960
   11   1HB   ALA1104           HB2      ALA1104  39.574  -2.486  -1.246
   12   2HB   ALA1104           HB1      ALA1104  39.461  -3.750  -2.470
   13   3HB   ALA1104           HB3      ALA1104  41.011  -3.399  -1.705
   14    H    GLU1105           HN       GLU1105  38.406  -3.126  -4.185
   15    HA   GLU1105           HA       GLU1105  37.134  -0.913  -5.412
   16   1HB   GLU1105           HB2      GLU1105  36.023  -3.638  -4.715
   17   2HB   GLU1105           HB1      GLU1105  35.258  -2.476  -5.790
   18   1HG   GLU1105           HG2      GLU1105  37.164  -2.623  -7.310
   19   2HG   GLU1105           HG1      GLU1105  37.928  -3.792  -6.233
   20    H    PHE1106           HN       PHE1106  35.194   0.137  -4.867
   21    HA   PHE1106           HA       PHE1106  34.140  -0.265  -2.175
   22   1HB   PHE1106           HB2      PHE1106  34.261   2.160  -1.683
   23   2HB   PHE1106           HB1      PHE1106  35.854   1.428  -1.852
   24    HD1  PHE1106           HD1      PHE1106  33.490   3.824  -3.209
   25    HD2  PHE1106           HD2      PHE1106  37.224   1.881  -3.833
   26    HE1  PHE1106           HE1      PHE1106  34.085   5.516  -4.892
   27    HE2  PHE1106           HE2      PHE1106  37.826   3.570  -5.518
   28    HZ   PHE1106           HZ       PHE1106  36.255   5.390  -6.049
   29    H    GLY1107           HN       GLY1107  32.074   0.795  -1.826
   30   1HA   GLY1107           HA1      GLY1107  30.243   0.412  -3.841
   31   2HA   GLY1107           HA2      GLY1107  30.702   2.103  -3.938
   32    H    LYS1108           HN       LYS1108  30.641   3.269  -1.746
   33    HA   LYS1108           HA       LYS1108  29.051   2.386   0.360
   34   1HB   LYS1108           HB2      LYS1108  29.235   5.250  -0.580
   35   2HB   LYS1108           HB1      LYS1108  28.874   4.684   1.043
   36   1HG   LYS1108           HG2      LYS1108  31.149   3.725   1.176
   37   2HG   LYS1108           HG1      LYS1108  31.500   4.432  -0.403
   38   1HD   LYS1108           HD2      LYS1108  31.049   6.663   0.495
   39   2HD   LYS1108           HD1      LYS1108  30.694   5.955   2.073
   40   1HE   LYS1108           HE2      LYS1108  32.958   6.857   2.008
   41   2HE   LYS1108           HE1      LYS1108  32.978   5.106   2.214
   42   1HZ   LYS1108           HZ1      LYS1108  33.426   6.549  -0.343
   43   2HZ   LYS1108           HZ3      LYS1108  34.625   5.822   0.604
   44   3HZ   LYS1108           HZ2      LYS1108  33.446   4.869  -0.146
   45    H    CYS1109           HN       CYS1109  26.908   2.314   0.744
   46    HA   CYS1109           HA       CYS1109  25.152   2.436  -1.507
   47   1HB   CYS1109           HB2      CYS1109  24.366   2.128   1.392
   48   2HB   CYS1109           HB1      CYS1109  23.470   1.597  -0.028
   49    H    GLY1110           HN       GLY1110  23.904   4.068  -2.161
   50   1HA   GLY1110           HA1      GLY1110  23.413   6.366  -2.284
   51   2HA   GLY1110           HA2      GLY1110  23.958   6.548  -0.622
   52    HA   PRO1111           HA       PRO1111  19.713   6.884   0.562
   53   1HB   PRO1111           HB2      PRO1111  18.764   8.268  -1.887
   54   2HB   PRO1111           HB1      PRO1111  18.624   8.745  -0.189
   55   1HG   PRO1111           HG2      PRO1111  20.364   9.949  -1.835
   56   2HG   PRO1111           HG1      PRO1111  20.756   9.646  -0.133
   57   1HD   PRO1111           HD2      PRO1111  21.682   8.205  -2.578
   58   2HD   PRO1111           HD1      PRO1111  22.561   8.565  -1.078
   59    HA   PRO1112           HA       PRO1112  18.427   3.055  -1.481
   60   1HB   PRO1112           HB2      PRO1112  16.258   2.779   0.259
   61   2HB   PRO1112           HB1      PRO1112  17.868   2.096   0.487
   62   1HG   PRO1112           HG2      PRO1112  16.693   4.599   1.609
   63   2HG   PRO1112           HG1      PRO1112  17.780   3.425   2.374
   64   1HD   PRO1112           HD2      PRO1112  18.704   5.763   1.501
   65   2HD   PRO1112           HD1      PRO1112  19.658   4.278   1.291
   66    HA   PRO1113           HA       PRO1113  15.045   5.136  -3.705
   67   1HB   PRO1113           HB2      PRO1113  15.790   4.444  -6.176
   68   2HB   PRO1113           HB1      PRO1113  16.634   5.725  -5.298
   69   1HG   PRO1113           HG2      PRO1113  17.471   2.920  -5.833
   70   2HG   PRO1113           HG1      PRO1113  18.460   4.382  -5.701
   71   1HD   PRO1113           HD2      PRO1113  18.043   2.446  -3.696
   72   2HD   PRO1113           HD1      PRO1113  18.795   4.037  -3.487
   73    HA   PRO1114           HA       PRO1114  13.182   0.974  -3.903
   74   1HB   PRO1114           HB2      PRO1114  11.062   1.434  -2.374
   75   2HB   PRO1114           HB1      PRO1114  12.672   1.300  -1.659
   76   1HG   PRO1114           HG2      PRO1114  11.018   3.722  -2.172
   77   2HG   PRO1114           HG1      PRO1114  12.144   3.390  -0.847
   78   1HD   PRO1114           HD2      PRO1114  12.673   4.885  -3.191
   79   2HD   PRO1114           HD1      PRO1114  13.853   4.352  -1.980
   80    H    ILE1115           HN       ILE1115  10.476   0.741  -3.836
   81    HA   ILE1115           HA       ILE1115   9.692   1.125  -6.482
   82    HB   ILE1115           HB       ILE1115   7.365   0.632  -5.533
   83   1HG1  ILE1115          2HG1      ILE1115   9.073   0.536  -3.045
   84   2HG1  ILE1115          1HG1      ILE1115   7.573   1.420  -3.297
   85   1HG2  ILE1115          2HG2      ILE1115   9.700  -1.214  -5.058
   86   2HG2  ILE1115          1HG2      ILE1115   8.009  -1.722  -5.038
   87   3HG2  ILE1115          3HG2      ILE1115   8.720  -1.081  -6.520
   88   1HD1  ILE1115          1HD1      ILE1115   7.813  -1.573  -3.138
   89   2HD1  ILE1115          3HD1      ILE1115   7.293  -0.511  -1.828
   90   3HD1  ILE1115          2HD1      ILE1115   6.322  -0.645  -3.295
   91    H    ASP1116           HN       ASP1116   7.916   2.369  -7.321
   92    HA   ASP1116           HA       ASP1116   8.031   5.118  -6.471
   93   1HB   ASP1116           HB2      ASP1116   7.970   4.402  -8.878
   94   2HB   ASP1116           HB1      ASP1116   6.302   3.896  -8.631
   95    H    ASN1117           HN       ASN1117   6.975   3.541  -4.475
   96    HA   ASN1117           HA       ASN1117   4.655   4.920  -3.764
   97   1HB   ASN1117           HB2      ASN1117   3.157   2.789  -3.725
   98   2HB   ASN1117           HB1      ASN1117   3.314   3.694  -5.228
   99   1HD2  ASN1117          1HD2      ASN1117   2.881   1.982  -6.551
  100   2HD2  ASN1117          2HD2      ASN1117   3.956   0.645  -6.748
  101    H    GLY1118           HN       GLY1118   7.311   3.425  -3.027
  102   1HA   GLY1118           HA1      GLY1118   7.562   1.652  -1.238
  103   2HA   GLY1118           HA2      GLY1118   6.335   2.567  -0.374
  104    H    ASP1119           HN       ASP1119   8.936   1.955   0.610
  105    HA   ASP1119           HA       ASP1119  10.752   4.088   0.308
  106   1HB   ASP1119           HB2      ASP1119  10.359   5.121   2.606
  107   2HB   ASP1119           HB1      ASP1119   9.214   5.551   1.343
  108    H    ILE1120           HN       ILE1120  12.185   4.250   2.399
  109    HA   ILE1120           HA       ILE1120  13.290   1.670   2.786
  110    HB   ILE1120           HB       ILE1120  14.138   3.680   4.725
  111   1HG1  ILE1120          2HG1      ILE1120  14.679   4.319   1.831
  112   2HG1  ILE1120          1HG1      ILE1120  13.318   5.034   2.686
  113   1HG2  ILE1120          2HG2      ILE1120  15.517   2.171   2.520
  114   2HG2  ILE1120          1HG2      ILE1120  16.327   3.113   3.773
  115   3HG2  ILE1120          3HG2      ILE1120  15.398   1.678   4.208
  116   1HD1  ILE1120          3HD1      ILE1120  16.213   5.294   3.453
  117   2HD1  ILE1120          2HD1      ILE1120  15.227   6.525   2.664
  118   3HD1  ILE1120          1HD1      ILE1120  14.849   6.012   4.309
  119    H    THR1121           HN       THR1121  10.841   3.390   4.376
  120    HA   THR1121           HA       THR1121   9.586   2.998   6.237
  121    HB   THR1121           HB       THR1121   9.042   0.822   6.725
  122    HG1  THR1121           HG1      THR1121  10.594  -0.858   6.825
  123   1HG2  THR1121          3HG2      THR1121  10.554   0.617   4.118
  124   2HG2  THR1121          2HG2      THR1121   9.493  -0.647   4.737
  125   3HG2  THR1121          1HG2      THR1121   8.834   0.941   4.335
  126    H    SER1122           HN       SER1122  12.653   3.616   6.374
  127    HA   SER1122           HA       SER1122  12.927   3.025   9.248
  128   1HB   SER1122           HB2      SER1122  14.623   1.864   7.917
  129   2HB   SER1122           HB1      SER1122  15.130   3.397   7.207
  130    HG   SER1122           HG       SER1122  16.127   2.346   9.318
  131    H    PHE1123           HN       PHE1123  15.122   5.140   7.571
  132    HA   PHE1123           HA       PHE1123  13.774   7.559   8.390
  133   1HB   PHE1123           HB2      PHE1123  14.893   6.749  10.468
  134   2HB   PHE1123           HB1      PHE1123  16.438   6.846   9.632
  135    HD1  PHE1123           HD1      PHE1123  17.543   8.926   9.307
  136    HD2  PHE1123           HD2      PHE1123  13.641   8.800  11.000
  137    HE1  PHE1123           HE1      PHE1123  17.764  11.282   9.982
  138    HE2  PHE1123           HE2      PHE1123  13.854  11.155  11.677
  139    HZ   PHE1123           HZ       PHE1123  15.917  12.400  11.168
  140    HA   PRO1124           HA       PRO1124  15.692   9.172   4.740
  141   1HB   PRO1124           HB2      PRO1124  16.060  11.594   6.453
  142   2HB   PRO1124           HB1      PRO1124  15.403  11.464   4.818
  143   1HG   PRO1124           HG2      PRO1124  13.783  11.777   6.906
  144   2HG   PRO1124           HG1      PRO1124  13.342  10.700   5.568
  145   1HD   PRO1124           HD2      PRO1124  14.289  10.029   8.310
  146   2HD   PRO1124           HD1      PRO1124  13.172   9.145   7.250
  147    H    LEU1125           HN       LEU1125  17.707   9.339   3.921
  148    HA   LEU1125           HA       LEU1125  19.979  10.138   5.472
  149   1HB   LEU1125           HB2      LEU1125  21.228   8.024   5.293
  150   2HB   LEU1125           HB1      LEU1125  19.802   7.864   6.300
  151    HG   LEU1125           HG       LEU1125  19.865   5.887   5.056
  152   1HD1  LEU1125          1HD1      LEU1125  17.647   6.907   5.015
  153   2HD1  LEU1125          3HD1      LEU1125  18.047   7.714   3.500
  154   3HD1  LEU1125          2HD1      LEU1125  17.946   5.953   3.561
  155   1HD2  LEU1125          2HD2      LEU1125  21.598   6.598   3.475
  156   2HD2  LEU1125          1HD2      LEU1125  20.277   5.746   2.677
  157   3HD2  LEU1125          3HD2      LEU1125  20.385   7.503   2.569
  158    H    SER1126           HN       SER1126  21.987   9.045   4.032
  159    HA   SER1126           HA       SER1126  21.448   9.484   1.203
  160   1HB   SER1126           HB2      SER1126  23.530  11.045   2.750
  161   2HB   SER1126           HB1      SER1126  23.332  11.066   0.998
  162    HG   SER1126           HG       SER1126  21.759  12.432   1.220
  163    H    VAL1127           HN       VAL1127  23.106   8.088   3.790
  164    HA   VAL1127           HA       VAL1127  24.585   6.346   1.974
  165    HB   VAL1127           HB       VAL1127  25.927   7.515   4.410
  166   1HG1  VAL1127          3HG1      VAL1127  26.684   5.301   3.590
  167   2HG1  VAL1127          2HG1      VAL1127  27.065   6.044   2.036
  168   3HG1  VAL1127          1HG1      VAL1127  27.930   6.545   3.488
  169   1HG2  VAL1127          3HG2      VAL1127  25.481   9.292   2.765
  170   2HG2  VAL1127          2HG2      VAL1127  27.205   8.952   2.936
  171   3HG2  VAL1127          1HG2      VAL1127  26.319   8.344   1.536
  172    H    TYR1128           HN       TYR1128  24.063   4.328   2.480
  173    HA   TYR1128           HA       TYR1128  23.247   3.716   5.239
  174   1HB   TYR1128           HB2      TYR1128  22.254   2.899   2.634
  175   2HB   TYR1128           HB1      TYR1128  22.647   1.505   3.634
  176    HD1  TYR1128           HD1      TYR1128  21.640   1.454   6.014
  177    HD2  TYR1128           HD2      TYR1128  20.227   3.990   2.910
  178    HE1  TYR1128           HE1      TYR1128  19.498   1.699   7.198
  179    HE2  TYR1128           HE2      TYR1128  18.087   4.254   4.081
  180    HH   TYR1128           HH       TYR1128  17.624   3.289   7.304
  181    H    ALA1129           HN       ALA1129  25.955   3.938   4.127
  182    HA   ALA1129           HA       ALA1129  27.978   2.874   4.185
  183   1HB   ALA1129           HB1      ALA1129  27.256   2.548   6.523
  184   2HB   ALA1129           HB3      ALA1129  26.576   0.986   6.070
  185   3HB   ALA1129           HB2      ALA1129  28.314   1.260   5.945
  186    HA   PRO1130           HA       PRO1130  27.620  -0.070   0.867
  187   1HB   PRO1130           HB2      PRO1130  30.240  -0.982   0.988
  188   2HB   PRO1130           HB1      PRO1130  29.685   0.422   0.073
  189   1HG   PRO1130           HG2      PRO1130  30.995   0.293   2.752
  190   2HG   PRO1130           HG1      PRO1130  31.196   1.490   1.460
  191   1HD   PRO1130           HD2      PRO1130  29.730   2.005   3.657
  192   2HD   PRO1130           HD1      PRO1130  29.281   2.645   2.061
  193    H    ALA1131           HN       ALA1131  27.414  -2.270   0.572
  194    HA   ALA1131           HA       ALA1131  27.126  -4.460   1.104
  195   1HB   ALA1131           HB2      ALA1131  29.520  -4.422   1.620
  196   2HB   ALA1131           HB3      ALA1131  28.639  -5.514   2.689
  197   3HB   ALA1131           HB1      ALA1131  29.152  -3.931   3.274
  198    H    SER1132           HN       SER1132  25.356  -2.495   2.195
  199    HA   SER1132           HA       SER1132  24.553  -3.855   4.688
  200   1HB   SER1132           HB2      SER1132  24.120  -0.960   3.916
  201   2HB   SER1132           HB1      SER1132  23.469  -1.728   5.363
  202    HG   SER1132           HG       SER1132  25.440  -1.822   6.229
  203    H    SER1133           HN       SER1133  22.099  -3.445   5.105
  204    HA   SER1133           HA       SER1133  20.553  -3.501   2.624
  205   1HB   SER1133           HB2      SER1133  19.995  -5.631   4.658
  206   2HB   SER1133           HB1      SER1133  19.629  -5.610   2.933
  207    HG   SER1133           HG       SER1133  21.931  -6.387   4.241
  208    H    VAL1134           HN       VAL1134  18.192  -3.414   3.036
  209    HA   VAL1134           HA       VAL1134  17.461  -2.462   5.695
  210    HB   VAL1134           HB       VAL1134  18.070  -0.518   4.064
  211   1HG1  VAL1134          2HG1      VAL1134  15.267  -1.149   3.180
  212   2HG1  VAL1134          1HG1      VAL1134  16.145   0.333   2.801
  213   3HG1  VAL1134          3HG1      VAL1134  16.720  -1.216   2.182
  214   1HG2  VAL1134          1HG2      VAL1134  17.163  -0.228   6.295
  215   2HG2  VAL1134          3HG2      VAL1134  16.451   0.925   5.167
  216   3HG2  VAL1134          2HG2      VAL1134  15.535  -0.495   5.672
  217    H    GLU1135           HN       GLU1135  14.941  -1.633   5.225
  218    HA   GLU1135           HA       GLU1135  13.628  -3.959   3.992
  219   1HB   GLU1135           HB2      GLU1135  13.779  -4.103   6.511
  220   2HB   GLU1135           HB1      GLU1135  12.723  -2.703   6.578
  221   1HG   GLU1135           HG2      GLU1135  10.999  -3.951   5.373
  222   2HG   GLU1135           HG1      GLU1135  12.057  -5.360   5.334
  223    H    TYR1136           HN       TYR1136  12.856  -2.914   2.211
  224    HA   TYR1136           HA       TYR1136  11.570  -0.363   2.320
  225   1HB   TYR1136           HB2      TYR1136  11.690  -2.531   0.222
  226   2HB   TYR1136           HB1      TYR1136  10.760  -1.058  -0.006
  227    HD1  TYR1136           HD1      TYR1136  13.196   0.399   1.694
  228    HD2  TYR1136           HD2      TYR1136  12.787  -1.821  -1.908
  229    HE1  TYR1136           HE1      TYR1136  15.181   1.528   0.774
  230    HE2  TYR1136           HE2      TYR1136  14.754  -0.705  -2.841
  231    HH   TYR1136           HH       TYR1136  16.022   1.375  -2.515
  232    H    GLN1137           HN       GLN1137   9.255  -0.132   1.496
  233    HA   GLN1137           HA       GLN1137   7.380  -2.199   1.662
  234   1HB   GLN1137           HB2      GLN1137   8.038  -2.224   4.058
  235   2HB   GLN1137           HB1      GLN1137   7.502  -0.556   4.196
  236   1HG   GLN1137           HG2      GLN1137   5.228  -1.235   3.628
  237   2HG   GLN1137           HG1      GLN1137   5.764  -2.908   3.485
  238   1HE2  GLN1137          1HE2      GLN1137   6.981  -0.718   5.910
  239   2HE2  GLN1137          2HE2      GLN1137   6.237  -1.491   7.264
  240    H    CYS1138           HN       CYS1138   5.181  -1.479   1.527
  241    HA   CYS1138           HA       CYS1138   4.787   0.737  -0.100
  242   1HB   CYS1138           HB2      CYS1138   3.152  -1.277   1.159
  243   2HB   CYS1138           HB1      CYS1138   2.360   0.287   1.265
  244    H    GLN1139           HN       GLN1139   3.809   2.768   0.269
  245    HA   GLN1139           HA       GLN1139   4.680   4.135   2.568
  246   1HB   GLN1139           HB2      GLN1139   2.594   4.908   0.518
  247   2HB   GLN1139           HB1      GLN1139   3.251   6.000   1.730
  248   1HG   GLN1139           HG2      GLN1139   5.474   5.746   0.770
  249   2HG   GLN1139           HG1      GLN1139   4.831   4.632  -0.435
  250   1HE2  GLN1139          1HE2      GLN1139   3.547   5.423  -2.101
  251   2HE2  GLN1139          2HE2      GLN1139   3.492   7.103  -2.499
  252    H    ASN1140           HN       ASN1140   2.729   5.675   3.574
  253    HA   ASN1140           HA       ASN1140   1.462   4.002   5.437
  254   1HB   ASN1140           HB2      ASN1140   0.312   6.002   6.215
  255   2HB   ASN1140           HB1      ASN1140   1.997   6.377   5.867
  256   1HD2  ASN1140          1HD2      ASN1140  -0.530   7.994   5.927
  257   2HD2  ASN1140          2HD2      ASN1140  -0.540   8.832   4.416
  258    H    LEU1141           HN       LEU1141  -0.563   3.186   5.611
  259    HA   LEU1141           HA       LEU1141  -2.662   2.521   5.068
  260   1HB   LEU1141           HB2      LEU1141  -2.516   4.927   3.268
  261   2HB   LEU1141           HB1      LEU1141  -3.932   3.897   3.347
  262    HG   LEU1141           HG       LEU1141  -4.065   4.403   5.807
  263   1HD1  LEU1141          3HD1      LEU1141  -1.980   6.463   5.107
  264   2HD1  LEU1141          2HD1      LEU1141  -2.865   6.368   6.630
  265   3HD1  LEU1141          1HD1      LEU1141  -1.757   5.074   6.171
  266   1HD2  LEU1141          3HD2      LEU1141  -5.488   5.532   4.186
  267   2HD2  LEU1141          2HD2      LEU1141  -5.024   6.628   5.489
  268   3HD2  LEU1141          1HD2      LEU1141  -4.234   6.743   3.916
  269    H    TYR1142           HN       TYR1142  -0.071   2.330   3.038
  270    HA   TYR1142           HA       TYR1142  -1.540   0.913   0.928
  271   1HB   TYR1142           HB2      TYR1142   1.259   2.021   1.107
  272   2HB   TYR1142           HB1      TYR1142   0.809   0.867  -0.141
  273    HD1  TYR1142           HD1      TYR1142  -1.000   3.828   1.260
  274    HD2  TYR1142           HD2      TYR1142   0.736   1.976  -2.154
  275    HE1  TYR1142           HE1      TYR1142  -1.815   5.672  -0.148
  276    HE2  TYR1142           HE2      TYR1142  -0.075   3.812  -3.572
  277    HH   TYR1142           HH       TYR1142  -1.840   5.526  -3.536
  278    H    GLN1143           HN       GLN1143  -0.281  -1.105   0.072
  279    HA   GLN1143           HA       GLN1143   1.002  -2.562   2.261
  280   1HB   GLN1143           HB2      GLN1143  -1.524  -3.428   0.871
  281   2HB   GLN1143           HB1      GLN1143  -0.455  -4.581   1.661
  282   1HG   GLN1143           HG2      GLN1143  -1.808  -2.237   2.979
  283   2HG   GLN1143           HG1      GLN1143  -2.295  -3.925   3.109
  284   1HE2  GLN1143          1HE2      GLN1143   0.464  -4.874   3.199
  285   2HE2  GLN1143          2HE2      GLN1143   1.044  -4.502   4.783
  286    H    LEU1144           HN       LEU1144   2.856  -3.236   1.492
  287    HA   LEU1144           HA       LEU1144   3.343  -3.544  -1.315
  288   1HB   LEU1144           HB2      LEU1144   5.017  -2.664   0.287
  289   2HB   LEU1144           HB1      LEU1144   5.101  -4.245   1.036
  290    HG   LEU1144           HG       LEU1144   5.699  -4.005  -1.882
  291   1HD1  LEU1144          1HD1      LEU1144   7.630  -3.330   0.332
  292   2HD1  LEU1144          3HD1      LEU1144   8.041  -3.527  -1.372
  293   3HD1  LEU1144          2HD1      LEU1144   6.989  -2.205  -0.866
  294   1HD2  LEU1144          3HD2      LEU1144   6.772  -5.736   0.342
  295   2HD2  LEU1144          2HD2      LEU1144   5.580  -6.213  -0.866
  296   3HD2  LEU1144          1HD2      LEU1144   7.232  -5.842  -1.357
  297    H    GLU1145           HN       GLU1145   4.087  -5.436  -2.356
  298    HA   GLU1145           HA       GLU1145   3.261  -7.962  -1.092
  299   1HB   GLU1145           HB2      GLU1145   1.628  -7.259  -2.803
  300   2HB   GLU1145           HB1      GLU1145   2.917  -7.189  -3.997
  301   1HG   GLU1145           HG2      GLU1145   1.633  -9.223  -4.237
  302   2HG   GLU1145           HG1      GLU1145   3.287  -9.587  -3.745
  303    H    GLY1146           HN       GLY1146   4.737  -9.551  -1.122
  304   1HA   GLY1146           HA1      GLY1146   6.933  -9.432  -3.066
  305   2HA   GLY1146           HA2      GLY1146   6.478 -10.836  -2.113
  306    H    ASN1147           HN       ASN1147   9.082 -10.342  -2.151
  307    HA   ASN1147           HA       ASN1147   9.728  -9.905   0.563
  308   1HB   ASN1147           HB2      ASN1147  11.009 -11.160  -1.429
  309   2HB   ASN1147           HB1      ASN1147  11.866  -9.620  -1.479
  310   1HD2  ASN1147          1HD2      ASN1147  13.114  -8.984   0.269
  311   2HD2  ASN1147          2HD2      ASN1147  13.616 -10.096   1.490
  312    H    LYS1148           HN       LYS1148   9.168  -7.915   1.304
  313    HA   LYS1148           HA       LYS1148   9.762  -5.506  -0.119
  314   1HB   LYS1148           HB2      LYS1148   9.085  -4.464   2.132
  315   2HB   LYS1148           HB1      LYS1148   7.869  -5.349   1.224
  316   1HG   LYS1148           HG2      LYS1148   7.654  -5.957   3.510
  317   2HG   LYS1148           HG1      LYS1148   8.352  -7.334   2.659
  318   1HD   LYS1148           HD2      LYS1148  10.580  -6.685   3.442
  319   2HD   LYS1148           HD1      LYS1148   9.876  -5.311   4.298
  320   1HE   LYS1148           HE2      LYS1148   9.277  -8.221   4.821
  321   2HE   LYS1148           HE1      LYS1148  10.300  -7.181   5.812
  322   1HZ   LYS1148           HZ1      LYS1148   7.398  -6.786   5.322
  323   2HZ   LYS1148           HZ3      LYS1148   8.086  -7.387   6.746
  324   3HZ   LYS1148           HZ2      LYS1148   8.380  -5.790   6.274
  325    H    ARG1149           HN       ARG1149  11.844  -7.546   1.240
  326    HA   ARG1149           HA       ARG1149  13.513  -5.444   2.454
  327   1HB   ARG1149           HB2      ARG1149  12.997  -7.490   3.813
  328   2HB   ARG1149           HB1      ARG1149  13.887  -8.438   2.629
  329   1HG   ARG1149           HG2      ARG1149  15.918  -7.211   3.135
  330   2HG   ARG1149           HG1      ARG1149  15.037  -6.201   4.284
  331   1HD   ARG1149           HD2      ARG1149  15.437  -9.183   4.478
  332   2HD   ARG1149           HD1      ARG1149  16.272  -7.960   5.433
  333    HE   ARG1149           HE       ARG1149  13.534  -7.598   5.798
  334   1HH1  ARG1149          1HH1      ARG1149  15.977  -9.985   6.486
  335   2HH1  ARG1149          2HH1      ARG1149  15.176 -10.585   7.900
  336   1HH2  ARG1149          1HH2      ARG1149  12.472  -8.381   7.658
  337   2HH2  ARG1149          2HH2      ARG1149  13.184  -9.674   8.566
  338    H    ILE1150           HN       ILE1150  15.488  -4.915   1.593
  339    HA   ILE1150           HA       ILE1150  16.489  -6.569  -0.610
  340    HB   ILE1150           HB       ILE1150  16.669  -4.875  -2.180
  341   1HG1  ILE1150          2HG1      ILE1150  17.662  -3.165  -0.720
  342   2HG1  ILE1150          1HG1      ILE1150  16.395  -2.488  -1.736
  343   1HG2  ILE1150          2HG2      ILE1150  14.098  -4.351  -0.699
  344   2HG2  ILE1150          1HG2      ILE1150  14.436  -3.848  -2.356
  345   3HG2  ILE1150          3HG2      ILE1150  14.371  -5.563  -1.952
  346   1HD1  ILE1150          1HD1      ILE1150  14.847  -2.613   0.178
  347   2HD1  ILE1150          3HD1      ILE1150  16.185  -3.175   1.181
  348   3HD1  ILE1150          2HD1      ILE1150  16.238  -1.563   0.460
  349    H    THR1151           HN       THR1151  18.621  -5.194  -1.447
  350    HA   THR1151           HA       THR1151  20.222  -4.326   0.805
  351    HB   THR1151           HB       THR1151  20.951  -6.813  -0.757
  352    HG1  THR1151           HG1      THR1151  20.301  -7.900   0.964
  353   1HG2  THR1151          3HG2      THR1151  22.909  -5.425  -0.239
  354   2HG2  THR1151          2HG2      THR1151  22.445  -5.414   1.463
  355   3HG2  THR1151          1HG2      THR1151  22.915  -6.926   0.687
  356    H    CYS1152           HN       CYS1152  21.628  -2.804   0.153
  357    HA   CYS1152           HA       CYS1152  21.766  -1.997  -2.562
  358   1HB   CYS1152           HB2      CYS1152  23.566  -0.441  -1.706
  359   2HB   CYS1152           HB1      CYS1152  22.008  -0.311  -0.903
  360    H    ARG1153           HN       ARG1153  23.475  -2.055  -4.006
  361    HA   ARG1153           HA       ARG1153  25.717  -3.833  -3.317
  362   1HB   ARG1153           HB2      ARG1153  24.624  -3.878  -6.092
  363   2HB   ARG1153           HB1      ARG1153  25.498  -5.123  -5.212
  364   1HG   ARG1153           HG2      ARG1153  23.391  -6.021  -5.294
  365   2HG   ARG1153           HG1      ARG1153  23.348  -5.192  -3.737
  366   1HD   ARG1153           HD2      ARG1153  21.315  -4.740  -4.981
  367   2HD   ARG1153           HD1      ARG1153  22.263  -3.262  -4.809
  368    HE   ARG1153           HE       ARG1153  23.050  -4.273  -7.210
  369   1HH1  ARG1153          1HH1      ARG1153  19.966  -3.459  -5.809
  370   2HH1  ARG1153          2HH1      ARG1153  19.240  -3.053  -7.328
  371   1HH2  ARG1153          1HH2      ARG1153  22.102  -3.742  -9.212
  372   2HH2  ARG1153          2HH2      ARG1153  20.453  -3.214  -9.262
  373    H    ASN1154           HN       ASN1154  27.483  -2.623  -3.382
  374    HA   ASN1154           HA       ASN1154  29.059  -1.119  -4.035
  375   1HB   ASN1154           HB2      ASN1154  27.847  -1.625  -6.762
  376   2HB   ASN1154           HB1      ASN1154  29.398  -0.846  -6.468
  377   1HD2  ASN1154          1HD2      ASN1154  27.629  -3.831  -6.407
  378   2HD2  ASN1154          2HD2      ASN1154  28.997  -4.875  -6.260
  379    H    GLY1155           HN       GLY1155  26.300  -0.207  -3.334
  380   1HA   GLY1155           HA1      GLY1155  26.668   2.554  -4.170
  381   2HA   GLY1155           HA2      GLY1155  25.563   1.977  -2.933
  382    H    GLN1156           HN       GLN1156  24.179   0.040  -4.433
  383    HA   GLN1156           HA       GLN1156  22.431   1.782  -5.939
  384   1HB   GLN1156           HB2      GLN1156  24.098   1.066  -7.621
  385   2HB   GLN1156           HB1      GLN1156  23.699  -0.611  -7.283
  386   1HG   GLN1156           HG2      GLN1156  22.605   0.144  -9.305
  387   2HG   GLN1156           HG1      GLN1156  21.417  -0.233  -8.057
  388   1HE2  GLN1156          1HE2      GLN1156  20.253   1.432  -7.099
  389   2HE2  GLN1156          2HE2      GLN1156  20.165   3.011  -7.793
  390    H    TRP1157           HN       TRP1157  20.928   1.261  -4.331
  391    HA   TRP1157           HA       TRP1157  20.240  -1.328  -3.510
  392   1HB   TRP1157           HB2      TRP1157  18.611   1.212  -3.561
  393   2HB   TRP1157           HB1      TRP1157  18.089  -0.271  -2.774
  394    HD1  TRP1157           HD1      TRP1157  20.657   2.545  -2.423
  395    HE1  TRP1157           HE1      TRP1157  21.509   2.558   0.006
  396    HE3  TRP1157           HE3      TRP1157  18.446  -1.744  -0.795
  397    HZ2  TRP1157           HZ2      TRP1157  21.283   0.922   2.312
  398    HZ3  TRP1157           HZ3      TRP1157  18.812  -2.467   1.523
  399    HH2  TRP1157           HH2      TRP1157  20.199  -1.169   3.041
  400    H    SER1158           HN       SER1158  18.306  -2.513  -3.912
  401    HA   SER1158           HA       SER1158  17.521  -2.471  -6.727
  402   1HB   SER1158           HB2      SER1158  18.263  -4.616  -5.766
  403   2HB   SER1158           HB1      SER1158  16.971  -4.528  -4.569
  404    HG   SER1158           HG       SER1158  16.673  -5.777  -6.665
  405    H    GLU1159           HN       GLU1159  15.082  -3.310  -6.951
  406    HA   GLU1159           HA       GLU1159  13.436  -1.488  -5.350
  407   1HB   GLU1159           HB2      GLU1159  13.719  -1.021  -7.830
  408   2HB   GLU1159           HB1      GLU1159  12.802  -2.492  -8.120
  409   1HG   GLU1159           HG2      GLU1159  10.903  -1.559  -6.907
  410   2HG   GLU1159           HG1      GLU1159  11.820  -0.082  -6.610
  411    HA   PRO1160           HA       PRO1160  11.336  -5.003  -3.629
  412   1HB   PRO1160           HB2      PRO1160   8.983  -3.182  -3.731
  413   2HB   PRO1160           HB1      PRO1160   9.635  -4.103  -2.372
  414   1HG   PRO1160           HG2      PRO1160  10.014  -1.472  -2.543
  415   2HG   PRO1160           HG1      PRO1160  11.291  -2.543  -1.939
  416   1HD   PRO1160           HD2      PRO1160  11.048  -1.194  -4.585
  417   2HD   PRO1160           HD1      PRO1160  12.495  -1.543  -3.622
  418    HA   PRO1161           HA       PRO1161   9.150  -7.124  -6.814
  419   1HB   PRO1161           HB2      PRO1161   7.022  -7.751  -4.834
  420   2HB   PRO1161           HB1      PRO1161   7.985  -8.842  -5.837
  421   1HG   PRO1161           HG2      PRO1161   8.474  -8.604  -3.228
  422   2HG   PRO1161           HG1      PRO1161   9.801  -8.777  -4.392
  423   1HD   PRO1161           HD2      PRO1161   8.821  -6.328  -2.981
  424   2HD   PRO1161           HD1      PRO1161  10.483  -6.819  -3.366
  425    H    LYS1162           HN       LYS1162   6.549  -5.879  -4.692
  426    HA   LYS1162           HA       LYS1162   5.693  -3.964  -6.659
  427   1HB   LYS1162           HB2      LYS1162   4.843  -6.198  -7.514
  428   2HB   LYS1162           HB1      LYS1162   3.808  -6.250  -6.095
  429   1HG   LYS1162           HG2      LYS1162   2.710  -4.194  -6.802
  430   2HG   LYS1162           HG1      LYS1162   3.760  -4.117  -8.219
  431   1HD   LYS1162           HD2      LYS1162   1.860  -6.378  -7.606
  432   2HD   LYS1162           HD1      LYS1162   1.515  -5.046  -8.711
  433   1HE   LYS1162           HE2      LYS1162   3.761  -7.041  -8.987
  434   2HE   LYS1162           HE1      LYS1162   2.264  -7.034  -9.919
  435   1HZ   LYS1162           HZ2      LYS1162   2.880  -4.882 -10.827
  436   2HZ   LYS1162           HZ1      LYS1162   4.316  -4.888  -9.934
  437   3HZ   LYS1162           HZ3      LYS1162   4.076  -6.032 -11.156
  438    H    CYS1163           HN       CYS1163   3.561  -2.937  -5.964
  439    HA   CYS1163           HA       CYS1163   3.178  -3.083  -3.054
  440   1HB   CYS1163           HB2      CYS1163   4.421  -0.942  -4.426
  441   2HB   CYS1163           HB1      CYS1163   2.818  -0.382  -3.955
  442    H    LEU1164           HN       LEU1164   1.144  -3.686  -2.765
  443    HA   LEU1164           HA       LEU1164  -0.882  -3.316  -4.736
  444   1HB   LEU1164           HB2      LEU1164  -1.457  -4.017  -1.880
  445   2HB   LEU1164           HB1      LEU1164  -2.300  -4.528  -3.328
  446    HG   LEU1164           HG       LEU1164   0.402  -5.479  -2.396
  447   1HD1  LEU1164          2HD1      LEU1164  -2.256  -6.873  -2.618
  448   2HD1  LEU1164          1HD1      LEU1164  -0.730  -7.640  -2.179
  449   3HD1  LEU1164          3HD1      LEU1164  -1.435  -6.413  -1.127
  450   1HD2  LEU1164          3HD2      LEU1164  -1.157  -6.236  -4.864
  451   2HD2  LEU1164          2HD2      LEU1164   0.356  -5.329  -4.826
  452   3HD2  LEU1164          1HD2      LEU1164   0.323  -7.013  -4.304
  453    H    HIS1165           HN       HIS1165  -1.981  -1.525  -5.100
  454    HA   HIS1165           HA       HIS1165  -1.936   0.756  -3.471
  455   1HB   HIS1165           HB2      HIS1165  -3.972  -0.029  -5.575
  456   2HB   HIS1165           HB1      HIS1165  -3.776   1.587  -4.902
  457    HD1  HIS1165           HD1      HIS1165  -2.037   3.067  -5.949
  458    HD2  HIS1165           HD2      HIS1165  -1.750  -0.883  -7.210
  459    HE1  HIS1165           HE1      HIS1165  -0.358   3.079  -7.821
  460    HE2  HIS1165           HE2      HIS1165  -0.268   0.694  -8.628
  461    HA   PRO1166           HA       PRO1166  -4.617  -0.308  -0.155
  462   1HB   PRO1166           HB2      PRO1166  -5.722   2.202   0.282
  463   2HB   PRO1166           HB1      PRO1166  -4.193   1.626   0.947
  464   1HG   PRO1166           HG2      PRO1166  -4.695   3.338  -1.447
  465   2HG   PRO1166           HG1      PRO1166  -3.406   3.452  -0.236
  466   1HD   PRO1166           HD2      PRO1166  -2.951   2.413  -2.662
  467   2HD   PRO1166           HD1      PRO1166  -2.169   1.747  -1.211
  468    H    CYS1167           HN       CYS1167  -6.909   0.343   0.626
  469    HA   CYS1167           HA       CYS1167  -8.728  -0.628  -1.377
  470   1HB   CYS1167           HB2      CYS1167  -9.561   0.312   1.344
  471   2HB   CYS1167           HB1      CYS1167 -10.144  -1.071   0.413
  472    H    VAL1168           HN       VAL1168  -7.774   1.884  -2.109
  473    HA   VAL1168           HA       VAL1168  -9.365   4.048  -1.283
  474    HB   VAL1168           HB       VAL1168  -8.107   3.813  -4.010
  475   1HG1  VAL1168          2HG1      VAL1168  -9.561   5.746  -3.626
  476   2HG1  VAL1168          1HG1      VAL1168  -8.616   6.175  -2.199
  477   3HG1  VAL1168          3HG1      VAL1168  -7.876   6.235  -3.799
  478   1HG2  VAL1168          1HG2      VAL1168  -6.450   3.142  -2.355
  479   2HG2  VAL1168          3HG2      VAL1168  -6.061   4.729  -3.018
  480   3HG2  VAL1168          2HG2      VAL1168  -6.784   4.596  -1.414
  481    H    ILE1169           HN       ILE1169 -11.524   3.516  -1.278
  482    HA   ILE1169           HA       ILE1169 -12.785   2.834  -3.835
  483    HB   ILE1169           HB       ILE1169 -13.364   1.544  -1.748
  484   1HG1  ILE1169          2HG1      ILE1169 -15.635   3.040  -3.079
  485   2HG1  ILE1169          1HG1      ILE1169 -14.869   1.574  -3.686
  486   1HG2  ILE1169          2HG2      ILE1169 -13.312   3.373  -0.158
  487   2HG2  ILE1169          1HG2      ILE1169 -14.687   4.133  -0.960
  488   3HG2  ILE1169          3HG2      ILE1169 -14.890   2.586  -0.138
  489   1HD1  ILE1169          2HD1      ILE1169 -16.411   1.804  -1.112
  490   2HD1  ILE1169          1HD1      ILE1169 -17.006   1.102  -2.616
  491   3HD1  ILE1169          3HD1      ILE1169 -15.670   0.337  -1.753
  492    H    SER1170           HN       SER1170 -14.905   4.035  -4.282
  493    HA   SER1170           HA       SER1170 -14.334   6.872  -4.111
  494   1HB   SER1170           HB2      SER1170 -16.570   5.385  -5.504
  495   2HB   SER1170           HB1      SER1170 -16.283   7.121  -5.628
  496    HG   SER1170           HG       SER1170 -15.281   5.357  -7.178
  497    H    ARG1171           HN       ARG1171 -15.014   8.105  -2.512
  498    HA   ARG1171           HA       ARG1171 -16.659   7.384  -0.409
  499   1HB   ARG1171           HB2      ARG1171 -16.900   9.836   0.002
  500   2HB   ARG1171           HB1      ARG1171 -15.241   9.306  -0.231
  501   1HG   ARG1171           HG2      ARG1171 -15.281  10.130  -2.520
  502   2HG   ARG1171           HG1      ARG1171 -16.958  10.636  -2.315
  503   1HD   ARG1171           HD2      ARG1171 -15.428  12.521  -2.060
  504   2HD   ARG1171           HD1      ARG1171 -16.290  12.186  -0.559
  505    HE   ARG1171           HE       ARG1171 -13.802  10.835  -0.600
  506   1HH1  ARG1171          1HH1      ARG1171 -15.200  14.003  -0.206
  507   2HH1  ARG1171          2HH1      ARG1171 -13.906  14.592   0.785
  508   1HH2  ARG1171          1HH2      ARG1171 -12.095  11.602   0.702
  509   2HH2  ARG1171          2HH2      ARG1171 -12.142  13.227   1.301
  510    H    GLU1172           HN       GLU1172 -17.574   9.286  -3.287
  511    HA   GLU1172           HA       GLU1172 -20.345   9.321  -2.525
  512   1HB   GLU1172           HB2      GLU1172 -20.711  10.502  -4.614
  513   2HB   GLU1172           HB1      GLU1172 -19.319  11.177  -3.780
  514   1HG   GLU1172           HG2      GLU1172 -17.835   9.883  -5.251
  515   2HG   GLU1172           HG1      GLU1172 -19.250   9.277  -6.111
  516    H    ILE1173           HN       ILE1173 -18.967   6.690  -3.012
  517    HA   ILE1173           HA       ILE1173 -20.951   5.653  -4.902
  518    HB   ILE1173           HB       ILE1173 -18.279   5.777  -5.484
  519   1HG1  ILE1173          2HG1      ILE1173 -19.200   3.608  -6.951
  520   2HG1  ILE1173          1HG1      ILE1173 -20.665   4.488  -6.523
  521   1HG2  ILE1173          2HG2      ILE1173 -18.843   2.994  -4.491
  522   2HG2  ILE1173          1HG2      ILE1173 -17.445   3.473  -5.453
  523   3HG2  ILE1173          3HG2      ILE1173 -17.668   4.132  -3.832
  524   1HD1  ILE1173          3HD1      ILE1173 -18.254   5.661  -7.876
  525   2HD1  ILE1173          2HD1      ILE1173 -19.760   5.201  -8.669
  526   3HD1  ILE1173          1HD1      ILE1173 -19.749   6.513  -7.489
  527    H    MET1174           HN       MET1174 -19.429   5.451  -1.875
  528    HA   MET1174           HA       MET1174 -20.826   2.924  -1.317
  529   1HB   MET1174           HB2      MET1174 -19.021   2.806   0.586
  530   2HB   MET1174           HB1      MET1174 -18.666   2.211  -1.027
  531   1HG   MET1174           HG2      MET1174 -16.802   3.476  -0.209
  532   2HG   MET1174           HG1      MET1174 -17.560   4.347  -1.540
  533   1HE   MET1174           HE2      MET1174 -19.039   4.109   2.078
  534   2HE   MET1174           HE1      MET1174 -17.303   4.094   2.388
  535   3HE   MET1174           HE3      MET1174 -18.273   5.484   2.874
  536    H    GLU1175           HN       GLU1175 -20.238   6.175  -0.508
  537    HA   GLU1175           HA       GLU1175 -21.817   5.917   1.959
  538   1HB   GLU1175           HB2      GLU1175 -20.641   7.627   2.887
  539   2HB   GLU1175           HB1      GLU1175 -19.419   7.135   1.719
  540   1HG   GLU1175           HG2      GLU1175 -20.139   8.870   0.191
  541   2HG   GLU1175           HG1      GLU1175 -21.438   9.330   1.289
  542    H    ASN1176           HN       ASN1176 -21.818   6.994  -1.252
  543    HA   ASN1176           HA       ASN1176 -24.152   8.721  -0.858
  544   1HB   ASN1176           HB2      ASN1176 -22.235   9.646  -2.106
  545   2HB   ASN1176           HB1      ASN1176 -22.410   8.352  -3.277
  546   1HD2  ASN1176          1HD2      ASN1176 -22.765   9.740  -4.972
  547   2HD2  ASN1176          2HD2      ASN1176 -24.238  10.619  -5.159
  548    H    TYR1177           HN       TYR1177 -23.264   5.612  -1.795
  549    HA   TYR1177           HA       TYR1177 -25.423   5.196  -3.682
  550   1HB   TYR1177           HB2      TYR1177 -23.091   3.655  -2.713
  551   2HB   TYR1177           HB1      TYR1177 -24.504   2.703  -3.156
  552    HD1  TYR1177           HD1      TYR1177 -23.796   5.857  -4.881
  553    HD2  TYR1177           HD2      TYR1177 -23.309   1.631  -4.975
  554    HE1  TYR1177           HE1      TYR1177 -23.140   5.991  -7.245
  555    HE2  TYR1177           HE2      TYR1177 -22.650   1.752  -7.337
  556    HH   TYR1177           HH       TYR1177 -21.868   4.671  -8.883
  557    H    ASN1178           HN       ASN1178 -26.092   6.017  -0.962
  558    HA   ASN1178           HA       ASN1178 -27.797   5.608   0.485
  559   1HB   ASN1178           HB2      ASN1178 -28.321   2.906  -0.718
  560   2HB   ASN1178           HB1      ASN1178 -29.457   4.032   0.016
  561   1HD2  ASN1178          1HD2      ASN1178 -29.457   2.648  -2.580
  562   2HD2  ASN1178          2HD2      ASN1178 -29.635   3.891  -3.765
  563    H    ILE1179           HN       ILE1179 -24.998   3.964   0.206
  564    HA   ILE1179           HA       ILE1179 -25.496   2.348   2.613
  565    HB   ILE1179           HB       ILE1179 -23.161   1.374   1.888
  566   1HG1  ILE1179          2HG1      ILE1179 -24.294   2.181  -0.795
  567   2HG1  ILE1179          1HG1      ILE1179 -22.996   3.063   0.002
  568   1HG2  ILE1179          2HG2      ILE1179 -25.746   0.672   0.502
  569   2HG2  ILE1179          1HG2      ILE1179 -24.330  -0.372   0.622
  570   3HG2  ILE1179          3HG2      ILE1179 -25.212   0.087   2.078
  571   1HD1  ILE1179          3HD1      ILE1179 -21.605   1.061  -0.049
  572   2HD1  ILE1179          2HD1      ILE1179 -22.906   0.180  -0.849
  573   3HD1  ILE1179          1HD1      ILE1179 -22.126   1.536  -1.664
  574    H    ALA1180           HN       ALA1180 -23.620   2.186   4.101
  575    HA   ALA1180           HA       ALA1180 -21.829   4.479   4.132
  576   1HB   ALA1180           HB3      ALA1180 -22.456   5.125   6.404
  577   2HB   ALA1180           HB2      ALA1180 -23.829   5.277   5.306
  578   3HB   ALA1180           HB1      ALA1180 -23.729   3.904   6.408
  579    H    LEU1181           HN       LEU1181 -20.161   4.232   5.874
  580    HA   LEU1181           HA       LEU1181 -18.893   1.804   5.779
  581   1HB   LEU1181           HB2      LEU1181 -18.656   4.222   7.380
  582   2HB   LEU1181           HB1      LEU1181 -18.151   2.791   8.259
  583    HG   LEU1181           HG       LEU1181 -16.306   3.978   7.060
  584   1HD1  LEU1181          2HD1      LEU1181 -16.100   1.631   7.680
  585   2HD1  LEU1181          1HD1      LEU1181 -16.870   1.154   6.166
  586   3HD1  LEU1181          3HD1      LEU1181 -15.296   1.950   6.143
  587   1HD2  LEU1181          2HD2      LEU1181 -17.852   3.066   4.641
  588   2HD2  LEU1181          1HD2      LEU1181 -17.418   4.719   5.081
  589   3HD2  LEU1181          3HD2      LEU1181 -16.164   3.575   4.598
  590    H    ARG1182           HN       ARG1182 -18.522   0.148   7.379
  591    HA   ARG1182           HA       ARG1182 -20.797  -1.136   8.266
  592   1HB   ARG1182           HB2      ARG1182 -18.620  -2.240   8.031
  593   2HB   ARG1182           HB1      ARG1182 -18.002  -1.335   9.405
  594   1HG   ARG1182           HG2      ARG1182 -19.885  -2.431  10.742
  595   2HG   ARG1182           HG1      ARG1182 -20.032  -3.537   9.374
  596   1HD   ARG1182           HD2      ARG1182 -17.621  -3.087  11.123
  597   2HD   ARG1182           HD1      ARG1182 -18.597  -4.550  10.994
  598    HE   ARG1182           HE       ARG1182 -17.385  -3.746   8.516
  599   1HH1  ARG1182          1HH1      ARG1182 -16.946  -5.536  11.473
  600   2HH1  ARG1182          2HH1      ARG1182 -15.728  -6.577  10.813
  601   1HH2  ARG1182          1HH2      ARG1182 -15.783  -5.111   7.639
  602   2HH2  ARG1182          2HH2      ARG1182 -15.067  -6.334   8.635
  603    H    TRP1183           HN       TRP1183 -19.041   1.430   9.741
  604    HA   TRP1183           HA       TRP1183 -20.532   1.118  12.250
  605   1HB   TRP1183           HB2      TRP1183 -18.179   2.942  11.728
  606   2HB   TRP1183           HB1      TRP1183 -18.845   2.469  13.289
  607    HD1  TRP1183           HD1      TRP1183 -17.290   0.609  10.240
  608    HE1  TRP1183           HE1      TRP1183 -15.801  -1.284  11.142
  609    HE3  TRP1183           HE3      TRP1183 -18.062   1.285  15.252
  610    HZ2  TRP1183           HZ2      TRP1183 -15.039  -2.336  13.633
  611    HZ3  TRP1183           HZ3      TRP1183 -16.907  -0.211  16.830
  612    HH2  TRP1183           HH2      TRP1183 -15.427  -1.984  16.036
  613    H    THR1184           HN       THR1184 -21.670   2.096   9.782
  614    HA   THR1184           HA       THR1184 -22.911   3.787   8.911
  615    HB   THR1184           HB       THR1184 -24.353   4.963  10.470
  616    HG1  THR1184           HG1      THR1184 -23.684   4.070  12.824
  617   1HG2  THR1184          3HG2      THR1184 -23.842   2.114  11.324
  618   2HG2  THR1184          2HG2      THR1184 -25.311   3.036  11.648
  619   3HG2  THR1184          1HG2      THR1184 -24.871   2.632   9.988
  620    H    ALA1185           HN       ALA1185 -20.075   4.382   9.289
  621    HA   ALA1185           HA       ALA1185 -19.814   7.086  10.164
  622   1HB   ALA1185           HB2      ALA1185 -17.927   5.522  10.193
  623   2HB   ALA1185           HB3      ALA1185 -17.561   6.963   9.243
  624   3HB   ALA1185           HB1      ALA1185 -17.963   5.450   8.431
  625    H    LYS1186           HN       LYS1186 -20.284   5.505   7.056
  626    HA   LYS1186           HA       LYS1186 -20.757   6.279   4.975
  627   1HB   LYS1186           HB2      LYS1186 -22.777   7.026   6.115
  628   2HB   LYS1186           HB1      LYS1186 -21.977   8.512   6.600
  629   1HG   LYS1186           HG2      LYS1186 -21.794   9.188   4.261
  630   2HG   LYS1186           HG1      LYS1186 -22.580   7.687   3.766
  631   1HD   LYS1186           HD2      LYS1186 -24.210   9.457   3.765
  632   2HD   LYS1186           HD1      LYS1186 -24.570   8.350   5.092
  633   1HE   LYS1186           HE2      LYS1186 -23.471   9.875   6.660
  634   2HE   LYS1186           HE1      LYS1186 -23.116  10.981   5.333
  635   1HZ   LYS1186           HZ3      LYS1186 -25.492  11.255   4.976
  636   2HZ   LYS1186           HZ2      LYS1186 -25.830  10.197   6.252
  637   3HZ   LYS1186           HZ1      LYS1186 -25.073  11.677   6.560
  638    H    GLN1187           HN       GLN1187 -18.576   6.585   4.396
  639    HA   GLN1187           HA       GLN1187 -17.836   8.857   3.156
  640   1HB   GLN1187           HB2      GLN1187 -17.923  10.057   5.299
  641   2HB   GLN1187           HB1      GLN1187 -16.719   8.957   5.963
  642   1HG   GLN1187           HG2      GLN1187 -15.270   9.729   3.967
  643   2HG   GLN1187           HG1      GLN1187 -16.399  11.083   3.890
  644   1HE2  GLN1187          1HE2      GLN1187 -16.468  12.573   5.571
  645   2HE2  GLN1187          2HE2      GLN1187 -15.198  12.703   6.735
  646    H    LYS1188           HN       LYS1188 -15.807   7.364   5.656
  647    HA   LYS1188           HA       LYS1188 -13.462   6.955   4.727
  648   1HB   LYS1188           HB2      LYS1188 -14.493   5.645   6.624
  649   2HB   LYS1188           HB1      LYS1188 -14.998   4.456   5.433
  650   1HG   LYS1188           HG2      LYS1188 -13.022   3.611   6.353
  651   2HG   LYS1188           HG1      LYS1188 -12.554   4.275   4.786
  652   1HD   LYS1188           HD2      LYS1188 -11.717   6.284   5.851
  653   2HD   LYS1188           HD1      LYS1188 -12.263   5.705   7.426
  654   1HE   LYS1188           HE2      LYS1188 -10.727   3.805   7.254
  655   2HE   LYS1188           HE1      LYS1188 -10.176   4.395   5.687
  656   1HZ   LYS1188           HZ1      LYS1188  -9.899   5.835   8.270
  657   2HZ   LYS1188           HZ3      LYS1188  -8.657   5.027   7.451
  658   3HZ   LYS1188           HZ2      LYS1188  -9.368   6.400   6.766
  659    H    LEU1189           HN       LEU1189 -13.065   7.179   2.596
  660    HA   LEU1189           HA       LEU1189 -14.182   5.228   0.733
  661   1HB   LEU1189           HB2      LEU1189 -13.023   6.852  -0.938
  662   2HB   LEU1189           HB1      LEU1189 -14.535   7.302  -0.178
  663    HG   LEU1189           HG       LEU1189 -12.783   9.110  -0.326
  664   1HD1  LEU1189          1HD1      LEU1189 -13.831   8.397   2.400
  665   2HD1  LEU1189          3HD1      LEU1189 -13.222   9.981   1.919
  666   3HD1  LEU1189          2HD1      LEU1189 -14.672   9.324   1.159
  667   1HD2  LEU1189          1HD2      LEU1189 -10.823   7.789   0.212
  668   2HD2  LEU1189          3HD2      LEU1189 -11.012   9.123   1.349
  669   3HD2  LEU1189          2HD2      LEU1189 -11.457   7.486   1.830
  670    H    TYR1190           HN       TYR1190 -12.181   4.234   2.468
  671    HA   TYR1190           HA       TYR1190 -10.475   2.957   0.688
  672   1HB   TYR1190           HB2      TYR1190  -8.284   4.045   1.348
  673   2HB   TYR1190           HB1      TYR1190  -9.308   4.965   0.253
  674    HD1  TYR1190           HD1      TYR1190 -10.783   5.120   3.429
  675    HD2  TYR1190           HD2      TYR1190  -7.521   6.687   1.184
  676    HE1  TYR1190           HE1      TYR1190 -10.669   7.060   4.944
  677    HE2  TYR1190           HE2      TYR1190  -7.404   8.626   2.688
  678    HH   TYR1190           HH       TYR1190  -9.037   8.748   5.663
  679    H    SER1191           HN       SER1191  -8.374   2.163   1.892
  680    HA   SER1191           HA       SER1191  -8.422   1.820   4.697
  681   1HB   SER1191           HB2      SER1191  -9.661  -0.351   3.011
  682   2HB   SER1191           HB1      SER1191  -8.862  -0.734   4.534
  683    HG   SER1191           HG       SER1191 -10.344   1.086   5.325
  684    H    ARG1192           HN       ARG1192  -7.134  -0.569   4.995
  685    HA   ARG1192           HA       ARG1192  -4.687  -0.148   3.461
  686   1HB   ARG1192           HB2      ARG1192  -5.325  -1.344   6.128
  687   2HB   ARG1192           HB1      ARG1192  -3.873  -1.858   5.289
  688   1HG   ARG1192           HG2      ARG1192  -3.127   0.485   5.187
  689   2HG   ARG1192           HG1      ARG1192  -4.569   0.959   6.089
  690   1HD   ARG1192           HD2      ARG1192  -3.860  -0.426   7.966
  691   2HD   ARG1192           HD1      ARG1192  -2.433  -0.933   7.065
  692    HE   ARG1192           HE       ARG1192  -2.439   1.858   7.193
  693   1HH1  ARG1192          1HH1      ARG1192  -2.108  -0.888   9.314
  694   2HH1  ARG1192          2HH1      ARG1192  -1.100  -0.051  10.449
  695   1HH2  ARG1192          1HH2      ARG1192  -1.113   2.965   8.681
  696   2HH2  ARG1192          2HH2      ARG1192  -0.535   2.138  10.089
  697    H    THR1193           HN       THR1193  -4.455  -1.392   1.733
  698    HA   THR1193           HA       THR1193  -5.984  -3.367   0.785
  699    HB   THR1193           HB       THR1193  -2.985  -3.123   0.586
  700    HG1  THR1193           HG1      THR1193  -4.689  -2.814  -1.588
  701   1HG2  THR1193          3HG2      THR1193  -3.736  -5.505   0.238
  702   2HG2  THR1193          2HG2      THR1193  -4.681  -4.926  -1.134
  703   3HG2  THR1193          1HG2      THR1193  -2.923  -4.763  -1.142
  704    H    GLY1194           HN       GLY1194  -6.335  -5.522   1.041
  705   1HA   GLY1194           HA1      GLY1194  -4.689  -6.966   2.991
  706   2HA   GLY1194           HA2      GLY1194  -5.779  -7.703   1.824
  707    H    GLU1195           HN       GLU1195  -7.142  -5.001   3.320
  708    HA   GLU1195           HA       GLU1195  -8.375  -6.648   5.425
  709   1HB   GLU1195           HB2      GLU1195  -8.278  -3.642   5.107
  710   2HB   GLU1195           HB1      GLU1195  -9.087  -4.491   6.418
  711   1HG   GLU1195           HG2      GLU1195  -6.859  -5.503   6.992
  712   2HG   GLU1195           HG1      GLU1195  -6.142  -4.380   5.837
  713    H    SER1196           HN       SER1196 -10.624  -6.690   5.697
  714    HA   SER1196           HA       SER1196 -12.095  -6.274   3.218
  715   1HB   SER1196           HB2      SER1196 -12.970  -7.590   5.802
  716   2HB   SER1196           HB1      SER1196 -13.872  -7.585   4.287
  717    HG   SER1196           HG       SER1196 -12.733  -9.234   3.701
  718    H    VAL1197           HN       VAL1197 -13.218  -4.476   2.877
  719    HA   VAL1197           HA       VAL1197 -13.913  -2.800   5.180
  720    HB   VAL1197           HB       VAL1197 -14.165  -1.974   2.296
  721   1HG1  VAL1197          1HG1      VAL1197 -13.777  -0.429   4.861
  722   2HG1  VAL1197          3HG1      VAL1197 -13.892   0.275   3.248
  723   3HG1  VAL1197          2HG1      VAL1197 -15.277  -0.567   3.944
  724   1HG2  VAL1197          2HG2      VAL1197 -11.876  -2.749   2.620
  725   2HG2  VAL1197          1HG2      VAL1197 -11.924  -0.993   2.465
  726   3HG2  VAL1197          3HG2      VAL1197 -11.723  -1.733   4.053
  727    H    GLU1198           HN       GLU1198 -15.863  -3.108   5.978
  728    HA   GLU1198           HA       GLU1198 -18.032  -3.986   4.221
  729   1HB   GLU1198           HB2      GLU1198 -17.844  -5.388   6.109
  730   2HB   GLU1198           HB1      GLU1198 -17.626  -4.028   7.202
  731   1HG   GLU1198           HG2      GLU1198 -19.876  -3.498   7.204
  732   2HG   GLU1198           HG1      GLU1198 -20.187  -4.366   5.699
  733    H    PHE1199           HN       PHE1199 -19.716  -2.720   3.708
  734    HA   PHE1199           HA       PHE1199 -20.007  -0.161   5.146
  735   1HB   PHE1199           HB2      PHE1199 -20.808  -0.479   2.267
  736   2HB   PHE1199           HB1      PHE1199 -20.495   0.998   3.165
  737    HD1  PHE1199           HD1      PHE1199 -18.406   2.031   3.082
  738    HD2  PHE1199           HD2      PHE1199 -18.856  -1.966   1.695
  739    HE1  PHE1199           HE1      PHE1199 -16.136   2.122   2.116
  740    HE2  PHE1199           HE2      PHE1199 -16.601  -1.896   0.736
  741    HZ   PHE1199           HZ       PHE1199 -15.233   0.146   0.941
  742    H    VAL1200           HN       VAL1200 -21.787  -0.442   6.393
  743    HA   VAL1200           HA       VAL1200 -23.953  -2.138   5.797
  744    HB   VAL1200           HB       VAL1200 -25.187  -0.938   7.542
  745   1HG1  VAL1200          1HG1      VAL1200 -22.288  -1.380   8.242
  746   2HG1  VAL1200          3HG1      VAL1200 -23.613  -1.265   9.401
  747   3HG1  VAL1200          2HG1      VAL1200 -23.563  -2.598   8.247
  748   1HG2  VAL1200          3HG2      VAL1200 -22.909   1.029   7.435
  749   2HG2  VAL1200          2HG2      VAL1200 -24.592   1.334   7.010
  750   3HG2  VAL1200          1HG2      VAL1200 -24.153   0.992   8.684
  751    H    CYS1201           HN       CYS1201 -26.286  -0.723   5.975
  752    HA   CYS1201           HA       CYS1201 -26.173   1.024   3.611
  753   1HB   CYS1201           HB2      CYS1201 -28.472  -0.797   4.349
  754   2HB   CYS1201           HB1      CYS1201 -28.341   0.208   2.912
  755    H    LYS1202           HN       LYS1202 -26.825   2.995   3.890
  756    HA   LYS1202           HA       LYS1202 -27.322   4.308   6.147
  757   1HB   LYS1202           HB2      LYS1202 -27.128   5.292   3.868
  758   2HB   LYS1202           HB1      LYS1202 -28.816   4.894   3.599
  759   1HG   LYS1202           HG2      LYS1202 -29.516   6.398   5.317
  760   2HG   LYS1202           HG1      LYS1202 -27.842   6.694   5.798
  761   1HD   LYS1202           HD2      LYS1202 -27.390   7.656   3.586
  762   2HD   LYS1202           HD1      LYS1202 -29.074   7.385   3.133
  763   1HE   LYS1202           HE2      LYS1202 -28.538   9.719   3.864
  764   2HE   LYS1202           HE1      LYS1202 -29.842   8.946   4.764
  765   1HZ   LYS1202           HZ3      LYS1202 -27.022   9.192   5.667
  766   2HZ   LYS1202           HZ2      LYS1202 -28.321  10.117   6.229
  767   3HZ   LYS1202           HZ1      LYS1202 -28.274   8.454   6.535
  768    H    ARG1203           HN       ARG1203 -28.495   3.496   7.718
  769    HA   ARG1203           HA       ARG1203 -30.304   2.231   8.606
  770   1HB   ARG1203           HB2      ARG1203 -31.784   4.091   9.429
  771   2HB   ARG1203           HB1      ARG1203 -30.071   4.269   9.742
  772   1HG   ARG1203           HG2      ARG1203 -29.824   5.900   8.065
  773   2HG   ARG1203           HG1      ARG1203 -31.417   5.552   7.394
  774   1HD   ARG1203           HD2      ARG1203 -31.436   7.626   8.680
  775   2HD   ARG1203           HD1      ARG1203 -32.465   6.405   9.429
  776    HE   ARG1203           HE       ARG1203 -29.944   6.228  10.603
  777   1HH1  ARG1203          1HH1      ARG1203 -32.584   8.492  10.387
  778   2HH1  ARG1203          2HH1      ARG1203 -32.264   9.209  11.931
  779   1HH2  ARG1203          1HH2      ARG1203 -29.516   7.165  12.636
  780   2HH2  ARG1203          2HH2      ARG1203 -30.519   8.455  13.209
  781    H    GLY1204           HN       GLY1204 -31.488   0.840   7.365
  782   1HA   GLY1204           HA1      GLY1204 -33.860   2.034   6.086
  783   2HA   GLY1204           HA2      GLY1204 -33.813   0.437   6.809
  784    H    TYR1205           HN       TYR1205 -31.993   2.209   4.286
  785    HA   TYR1205           HA       TYR1205 -32.801   1.031   2.029
  786   1HB   TYR1205           HB2      TYR1205 -30.003   1.689   2.878
  787   2HB   TYR1205           HB1      TYR1205 -30.335   1.079   1.267
  788    HD1  TYR1205           HD1      TYR1205 -29.866   3.954   3.164
  789    HD2  TYR1205           HD2      TYR1205 -32.291   2.439   0.025
  790    HE1  TYR1205           HE1      TYR1205 -30.315   6.251   2.412
  791    HE2  TYR1205           HE2      TYR1205 -32.752   4.728  -0.738
  792    HH   TYR1205           HH       TYR1205 -32.751   7.009   0.176
  793    H    ARG1206           HN       ARG1206 -33.438  -1.020   1.867
  794    HA   ARG1206           HA       ARG1206 -31.923  -3.197   3.010
  795   1HB   ARG1206           HB2      ARG1206 -33.726  -4.613   2.231
  796   2HB   ARG1206           HB1      ARG1206 -34.393  -3.187   3.013
  797   1HG   ARG1206           HG2      ARG1206 -34.817  -2.182   0.826
  798   2HG   ARG1206           HG1      ARG1206 -34.154  -3.619   0.043
  799   1HD   ARG1206           HD2      ARG1206 -36.578  -3.716   0.069
  800   2HD   ARG1206           HD1      ARG1206 -35.898  -4.987   1.084
  801    HE   ARG1206           HE       ARG1206 -36.416  -2.783   2.710
  802   1HH1  ARG1206          1HH1      ARG1206 -38.176  -5.098   0.790
  803   2HH1  ARG1206          2HH1      ARG1206 -39.597  -5.030   1.778
  804   1HH2  ARG1206          1HH2      ARG1206 -38.282  -2.688   4.017
  805   2HH2  ARG1206          2HH2      ARG1206 -39.657  -3.660   3.612
  806    H    LEU1207           HN       LEU1207 -30.676  -4.668   1.975
  807    HA   LEU1207           HA       LEU1207 -29.304  -4.064  -0.326
  808   1HB   LEU1207           HB2      LEU1207 -29.829  -6.632   1.106
  809   2HB   LEU1207           HB1      LEU1207 -29.028  -6.684  -0.451
  810    HG   LEU1207           HG       LEU1207 -28.037  -5.155   1.960
  811   1HD1  LEU1207          2HD1      LEU1207 -27.885  -7.569   2.275
  812   2HD1  LEU1207          1HD1      LEU1207 -27.055  -7.726   0.726
  813   3HD1  LEU1207          3HD1      LEU1207 -26.287  -6.855   2.054
  814   1HD2  LEU1207          1HD2      LEU1207 -26.784  -5.640  -0.740
  815   2HD2  LEU1207          3HD2      LEU1207 -27.374  -4.097  -0.122
  816   3HD2  LEU1207          2HD2      LEU1207 -25.988  -4.878   0.638
  817    H    SER1208           HN       SER1208 -29.621  -4.246  -2.460
  818    HA   SER1208           HA       SER1208 -32.256  -5.032  -3.373
  819   1HB   SER1208           HB2      SER1208 -31.266  -2.953  -4.221
  820   2HB   SER1208           HB1      SER1208 -29.917  -3.864  -4.898
  821    HG   SER1208           HG       SER1208 -32.381  -3.436  -5.924
  822    H    SER1209           HN       SER1209 -29.595  -6.720  -2.696
  823    HA   SER1209           HA       SER1209 -28.983  -8.868  -3.154
  824   1HB   SER1209           HB2      SER1209 -31.332  -9.409  -3.593
  825   2HB   SER1209           HB1      SER1209 -31.175  -8.802  -5.242
  826    HG   SER1209           HG       SER1209 -30.957 -11.145  -4.937
  827    H    ARG1210           HN       ARG1210 -29.638  -6.901  -6.032
  828    HA   ARG1210           HA       ARG1210 -27.481  -8.095  -7.514
  829   1HB   ARG1210           HB2      ARG1210 -29.173  -5.654  -8.088
  830   2HB   ARG1210           HB1      ARG1210 -28.021  -6.365  -9.210
  831   1HG   ARG1210           HG2      ARG1210 -30.441  -7.776  -8.106
  832   2HG   ARG1210           HG1      ARG1210 -30.352  -6.994  -9.686
  833   1HD   ARG1210           HD2      ARG1210 -28.538  -8.505 -10.329
  834   2HD   ARG1210           HD1      ARG1210 -28.626  -9.285  -8.750
  835    HE   ARG1210           HE       ARG1210 -31.160  -9.448  -9.835
  836   1HH1  ARG1210          1HH1      ARG1210 -27.958 -10.546 -10.661
  837   2HH1  ARG1210          2HH1      ARG1210 -28.517 -11.955 -11.498
  838   1HH2  ARG1210          1HH2      ARG1210 -31.905 -11.302 -10.934
  839   2HH2  ARG1210          2HH2      ARG1210 -30.760 -12.385 -11.653
  840    H    SER1211           HN       SER1211 -27.337  -6.325  -4.911
  841    HA   SER1211           HA       SER1211 -25.770  -4.076  -5.518
  842   1HB   SER1211           HB2      SER1211 -26.202  -5.724  -3.048
  843   2HB   SER1211           HB1      SER1211 -24.985  -4.446  -3.055
  844    HG   SER1211           HG       SER1211 -27.136  -3.400  -4.113
  845    H    HIS1212           HN       HIS1212 -23.481  -4.281  -3.957
  846    HA   HIS1212           HA       HIS1212 -21.904  -6.284  -5.435
  847   1HB   HIS1212           HB2      HIS1212 -20.891  -3.564  -4.609
  848   2HB   HIS1212           HB1      HIS1212 -20.115  -4.722  -5.685
  849    HD1  HIS1212           HD1      HIS1212 -20.773  -4.670  -8.132
  850    HD2  HIS1212           HD2      HIS1212 -23.110  -2.187  -5.755
  851    HE1  HIS1212           HE1      HIS1212 -22.128  -3.286  -9.737
  852    HE2  HIS1212           HE2      HIS1212 -23.473  -1.733  -8.278
  853    H    THR1213           HN       THR1213 -22.921  -6.973  -3.019
  854    HA   THR1213           HA       THR1213 -22.400  -7.798  -0.978
  855    HB   THR1213           HB       THR1213 -20.196  -8.668  -0.604
  856    HG1  THR1213           HG1      THR1213 -18.482  -8.088  -2.049
  857   1HG2  THR1213          1HG2      THR1213 -20.916  -8.833  -3.532
  858   2HG2  THR1213          3HG2      THR1213 -19.851  -9.945  -2.671
  859   3HG2  THR1213          2HG2      THR1213 -21.560  -9.852  -2.244
  860    H    LEU1214           HN       LEU1214 -22.423  -6.905   0.963
  861    HA   LEU1214           HA       LEU1214 -21.746  -4.221   1.414
  862   1HB   LEU1214           HB2      LEU1214 -22.234  -6.491   3.339
  863   2HB   LEU1214           HB1      LEU1214 -22.061  -4.816   3.831
  864    HG   LEU1214           HG       LEU1214 -24.167  -5.716   1.875
  865   1HD1  LEU1214          1HD1      LEU1214 -24.489  -6.932   3.957
  866   2HD1  LEU1214          3HD1      LEU1214 -24.409  -5.422   4.865
  867   3HD1  LEU1214          2HD1      LEU1214 -25.739  -5.707   3.741
  868   1HD2  LEU1214          2HD2      LEU1214 -23.481  -3.308   1.990
  869   2HD2  LEU1214          1HD2      LEU1214 -25.184  -3.617   2.336
  870   3HD2  LEU1214          3HD2      LEU1214 -24.058  -3.294   3.655
  871    H    ARG1215           HN       ARG1215 -20.163  -7.169   2.645
  872    HA   ARG1215           HA       ARG1215 -17.775  -5.580   3.249
  873   1HB   ARG1215           HB2      ARG1215 -18.705  -7.028   5.033
  874   2HB   ARG1215           HB1      ARG1215 -18.431  -8.433   4.012
  875   1HG   ARG1215           HG2      ARG1215 -16.027  -7.993   4.050
  876   2HG   ARG1215           HG1      ARG1215 -16.306  -6.588   5.083
  877   1HD   ARG1215           HD2      ARG1215 -15.606  -8.519   6.398
  878   2HD   ARG1215           HD1      ARG1215 -17.251  -8.031   6.807
  879    HE   ARG1215           HE       ARG1215 -17.377 -10.009   4.832
  880   1HH1  ARG1215          1HH1      ARG1215 -16.462  -9.647   8.174
  881   2HH1  ARG1215          2HH1      ARG1215 -16.850 -11.283   8.591
  882   1HH2  ARG1215          1HH2      ARG1215 -17.890 -12.164   5.372
  883   2HH2  ARG1215          2HH2      ARG1215 -17.660 -12.714   6.998
  884    H    THR1216           HN       THR1216 -16.207  -5.525   1.785
  885    HA   THR1216           HA       THR1216 -15.817  -7.888   0.063
  886    HB   THR1216           HB       THR1216 -16.712  -6.140  -1.325
  887    HG1  THR1216           HG1      THR1216 -15.013  -7.306  -2.273
  888   1HG2  THR1216          2HG2      THR1216 -16.207  -4.227   0.112
  889   2HG2  THR1216          1HG2      THR1216 -14.493  -4.395  -0.268
  890   3HG2  THR1216          3HG2      THR1216 -15.637  -3.952  -1.535
  891    H    THR1217           HN       THR1217 -13.622  -7.793  -1.023
  892    HA   THR1217           HA       THR1217 -11.597  -7.134   1.012
  893    HB   THR1217           HB       THR1217 -11.640  -9.280  -1.106
  894    HG1  THR1217           HG1      THR1217 -10.879 -10.383   0.998
  895   1HG2  THR1217          1HG2      THR1217  -9.453  -8.009  -1.092
  896   2HG2  THR1217          3HG2      THR1217  -9.245  -8.545   0.577
  897   3HG2  THR1217          2HG2      THR1217  -9.325  -9.733  -0.726
  898    H    CYS1218           HN       CYS1218 -10.397  -5.418   0.550
  899    HA   CYS1218           HA       CYS1218 -10.339  -4.363  -2.120
  900   1HB   CYS1218           HB2      CYS1218  -8.777  -2.663  -1.072
  901   2HB   CYS1218           HB1      CYS1218 -10.412  -2.727  -0.429
  902    H    TRP1219           HN       TRP1219  -8.347  -3.847  -3.244
  903    HA   TRP1219           HA       TRP1219  -5.861  -4.948  -2.655
  904   1HB   TRP1219           HB2      TRP1219  -7.613  -6.986  -3.138
  905   2HB   TRP1219           HB1      TRP1219  -6.980  -6.704  -4.756
  906    HD1  TRP1219           HD1      TRP1219  -4.248  -6.950  -5.020
  907    HE1  TRP1219           HE1      TRP1219  -2.646  -8.536  -3.792
  908    HE3  TRP1219           HE3      TRP1219  -7.179  -8.156  -1.006
  909    HZ2  TRP1219           HZ2      TRP1219  -2.607 -10.088  -1.455
  910    HZ3  TRP1219           HZ3      TRP1219  -6.280  -9.704   0.683
  911    HH2  TRP1219           HH2      TRP1219  -4.039 -10.651   0.463
  912    H    ASP1220           HN       ASP1220  -4.453  -3.978  -3.965
  913    HA   ASP1220           HA       ASP1220  -3.545  -2.865  -5.720
  914   1HB   ASP1220           HB2      ASP1220  -4.207  -4.912  -6.969
  915   2HB   ASP1220           HB1      ASP1220  -5.743  -4.142  -7.360
  916    H    GLY1221           HN       GLY1221  -6.503  -2.194  -4.473
  917   1HA   GLY1221           HA1      GLY1221  -6.548   0.414  -5.812
  918   2HA   GLY1221           HA2      GLY1221  -7.276   0.042  -4.260
  919    H    LYS1222           HN       LYS1222  -8.855  -2.115  -4.809
  920    HA   LYS1222           HA       LYS1222 -11.037  -0.859  -6.175
  921   1HB   LYS1222           HB2      LYS1222  -9.359  -2.276  -7.802
  922   2HB   LYS1222           HB1      LYS1222 -10.544  -3.495  -7.357
  923   1HG   LYS1222           HG2      LYS1222 -11.227  -0.810  -8.527
  924   2HG   LYS1222           HG1      LYS1222 -11.084  -2.305  -9.453
  925   1HD   LYS1222           HD2      LYS1222 -12.879  -3.303  -8.127
  926   2HD   LYS1222           HD1      LYS1222 -13.020  -1.812  -7.191
  927   1HE   LYS1222           HE2      LYS1222 -14.743  -1.930  -8.910
  928   2HE   LYS1222           HE1      LYS1222 -13.634  -0.594  -9.216
  929   1HZ   LYS1222           HZ1      LYS1222 -12.492  -1.965 -10.847
  930   2HZ   LYS1222           HZ3      LYS1222 -13.561  -3.244 -10.556
  931   3HZ   LYS1222           HZ2      LYS1222 -14.129  -1.806 -11.241
  932    H    LEU1223           HN       LEU1223 -12.971  -1.639  -5.485
  933    HA   LEU1223           HA       LEU1223 -13.204  -4.273  -4.346
  934   1HB   LEU1223           HB2      LEU1223 -14.251  -3.109  -2.217
  935   2HB   LEU1223           HB1      LEU1223 -12.557  -3.543  -2.308
  936    HG   LEU1223           HG       LEU1223 -13.213  -0.820  -3.247
  937   1HD1  LEU1223          3HD1      LEU1223 -13.439  -1.615  -0.348
  938   2HD1  LEU1223          2HD1      LEU1223 -13.332   0.043  -0.943
  939   3HD1  LEU1223          1HD1      LEU1223 -14.724  -0.957  -1.363
  940   1HD2  LEU1223          1HD2      LEU1223 -10.937  -1.807  -3.073
  941   2HD2  LEU1223          3HD2      LEU1223 -11.152  -0.301  -2.179
  942   3HD2  LEU1223          2HD2      LEU1223 -11.150  -1.844  -1.323
  943    H    GLU1224           HN       GLU1224 -15.437  -4.714  -3.570
  944    HA   GLU1224           HA       GLU1224 -17.340  -3.445  -5.382
  945   1HB   GLU1224           HB2      GLU1224 -17.640  -5.921  -3.670
  946   2HB   GLU1224           HB1      GLU1224 -18.792  -5.355  -4.871
  947   1HG   GLU1224           HG2      GLU1224 -17.122  -5.689  -6.627
  948   2HG   GLU1224           HG1      GLU1224 -15.976  -6.267  -5.418
  949    H    TYR1225           HN       TYR1225 -18.758  -1.982  -4.710
  950    HA   TYR1225           HA       TYR1225 -19.285  -1.766  -1.823
  951   1HB   TYR1225           HB2      TYR1225 -20.155   0.590  -2.656
  952   2HB   TYR1225           HB1      TYR1225 -18.447   0.305  -2.336
  953    HD1  TYR1225           HD1      TYR1225 -16.862   0.074  -4.186
  954    HD2  TYR1225           HD2      TYR1225 -20.963   0.950  -4.887
  955    HE1  TYR1225           HE1      TYR1225 -16.310   0.783  -6.469
  956    HE2  TYR1225           HE2      TYR1225 -20.424   1.664  -7.173
  957    HH   TYR1225           HH       TYR1225 -17.432   1.022  -8.646
  958    HA   PRO1226           HA       PRO1226 -23.395  -3.282  -2.621
  959   1HB   PRO1226           HB2      PRO1226 -24.525  -2.223  -0.332
  960   2HB   PRO1226           HB1      PRO1226 -23.653  -3.759  -0.408
  961   1HG   PRO1226           HG2      PRO1226 -22.676  -1.058   0.434
  962   2HG   PRO1226           HG1      PRO1226 -22.364  -2.641   1.174
  963   1HD   PRO1226           HD2      PRO1226 -20.532  -1.463  -0.363
  964   2HD   PRO1226           HD1      PRO1226 -20.794  -3.219  -0.449
  965    H    THR1227           HN       THR1227 -25.715  -2.135  -1.930
  966    HA   THR1227           HA       THR1227 -25.717   0.628  -2.870
  967    HB   THR1227           HB       THR1227 -27.392  -1.518  -4.180
  968    HG1  THR1227           HG1      THR1227 -26.091  -0.981  -6.024
  969   1HG2  THR1227          3HG2      THR1227 -28.555   0.628  -4.027
  970   2HG2  THR1227          2HG2      THR1227 -27.168   1.440  -4.753
  971   3HG2  THR1227          1HG2      THR1227 -28.102   0.277  -5.695
  972    H    CYS1228           HN       CYS1228 -28.047  -1.969  -2.283
  973    HA   CYS1228           HA       CYS1228 -29.848  -2.150  -0.913
  974   1HB   CYS1228           HB2      CYS1228 -28.134  -0.218   0.591
  975   2HB   CYS1228           HB1      CYS1228 -29.789  -0.471   1.136
  976    H    ALA1229           HN       ALA1229 -31.844  -0.975  -0.192
  977    HA   ALA1229           HA       ALA1229 -32.284   1.632  -1.323
  978   1HB   ALA1229           HB1      ALA1229 -33.703  -0.742  -2.514
  979   2HB   ALA1229           HB2      ALA1229 -32.482   0.247  -3.313
  980   3HB   ALA1229           HB3      ALA1229 -34.039   0.951  -2.874
  981    H    LYS1230           HN       LYS1230 -33.995   2.656  -0.484
  982    HA   LYS1230           HA       LYS1230 -35.846   3.111   0.713
  983   1HB   LYS1230           HB2      LYS1230 -36.103   0.129   0.985
  984   2HB   LYS1230           HB1      LYS1230 -37.301   1.285   1.552
  985   1HG   LYS1230           HG2      LYS1230 -37.681   2.041  -0.714
  986   2HG   LYS1230           HG1      LYS1230 -36.410   0.969  -1.305
  987   1HD   LYS1230           HD2      LYS1230 -37.699  -0.969  -0.511
  988   2HD   LYS1230           HD1      LYS1230 -38.980   0.119   0.030
  989   1HE   LYS1230           HE2      LYS1230 -39.301   0.887  -2.269
  990   2HE   LYS1230           HE1      LYS1230 -38.020  -0.198  -2.811
  991   1HZ   LYS1230           HZ2      LYS1230 -39.344  -2.076  -2.064
  992   2HZ   LYS1230           HZ1      LYS1230 -40.572  -1.036  -1.545
  993   3HZ   LYS1230           HZ3      LYS1230 -40.201  -1.153  -3.192
  994    H    ARG1231           HN       ARG1231 -34.313   4.075   2.113
  995    HA   ARG1231           HA       ARG1231 -33.280   2.859   4.399
  996   1HB   ARG1231           HB2      ARG1231 -33.315   5.377   5.189
  997   2HB   ARG1231           HB1      ARG1231 -32.211   4.827   3.947
  998   1HG   ARG1231           HG2      ARG1231 -33.167   6.904   3.256
  999   2HG   ARG1231           HG1      ARG1231 -33.824   5.624   2.236
 1000   1HD   ARG1231           HD2      ARG1231 -35.857   5.588   3.604
 1001   2HD   ARG1231           HD1      ARG1231 -35.200   6.878   4.608
 1002    HE   ARG1231           HE       ARG1231 -35.173   7.769   1.972
 1003   1HH1  ARG1231          1HH1      ARG1231 -37.500   6.852   4.397
 1004   2HH1  ARG1231          2HH1      ARG1231 -38.738   7.901   3.792
 1005   1HH2  ARG1231          1HH2      ARG1231 -36.796   9.155   1.168
 1006   2HH2  ARG1231          2HH2      ARG1231 -38.338   9.209   1.956

  No H/Q in entry =        1006
  Start of MODEL   22
    1    H1   GLU1103           HT1      GLU1103  37.862  -4.170   2.313
    2    H2   GLU1103           HT3      GLU1103  36.485  -5.147   2.426
    3    H3   GLU1103           HT2      GLU1103  38.022  -5.828   2.612
    4    HA   GLU1103           HA       GLU1103  38.568  -5.311   0.328
    5   1HB   GLU1103           HB2      GLU1103  37.046  -6.927  -0.744
    6   2HB   GLU1103           HB1      GLU1103  37.613  -7.496   0.820
    7   1HG   GLU1103           HG2      GLU1103  35.497  -6.823   1.835
    8   2HG   GLU1103           HG1      GLU1103  34.928  -6.253   0.267
    9    H    ALA1104           HN       ALA1104  35.752  -3.802   1.526
   10    HA   ALA1104           HA       ALA1104  34.916  -2.833  -1.095
   11   1HB   ALA1104           HB1      ALA1104  33.729  -2.314   1.629
   12   2HB   ALA1104           HB2      ALA1104  33.194  -3.551   0.491
   13   3HB   ALA1104           HB3      ALA1104  33.026  -1.843   0.080
   14    H    GLU1105           HN       GLU1105  35.750  -1.043  -1.920
   15    HA   GLU1105           HA       GLU1105  36.635   1.081  -0.081
   16   1HB   GLU1105           HB2      GLU1105  37.973   0.229  -2.656
   17   2HB   GLU1105           HB1      GLU1105  38.451   1.605  -1.671
   18   1HG   GLU1105           HG2      GLU1105  38.980   0.100   0.178
   19   2HG   GLU1105           HG1      GLU1105  38.502  -1.280  -0.810
   20    H    PHE1106           HN       PHE1106  35.293   2.735  -0.301
   21    HA   PHE1106           HA       PHE1106  33.960   4.341  -1.198
   22   1HB   PHE1106           HB2      PHE1106  35.664   3.849  -3.651
   23   2HB   PHE1106           HB1      PHE1106  34.602   5.233  -3.414
   24    HD1  PHE1106           HD1      PHE1106  37.758   3.668  -2.466
   25    HD2  PHE1106           HD2      PHE1106  35.177   6.998  -1.861
   26    HE1  PHE1106           HE1      PHE1106  39.589   4.882  -1.358
   27    HE2  PHE1106           HE2      PHE1106  37.003   8.218  -0.753
   28    HZ   PHE1106           HZ       PHE1106  39.213   7.160  -0.500
   29    H    GLY1107           HN       GLY1107  31.993   3.303  -1.150
   30   1HA   GLY1107           HA1      GLY1107  31.163   1.385  -3.059
   31   2HA   GLY1107           HA2      GLY1107  30.579   2.979  -3.503
   32    H    LYS1108           HN       LYS1108  29.955   4.088  -1.081
   33    HA   LYS1108           HA       LYS1108  28.531   2.478   0.701
   34   1HB   LYS1108           HB2      LYS1108  27.733   5.296  -0.043
   35   2HB   LYS1108           HB1      LYS1108  27.484   4.475   1.489
   36   1HG   LYS1108           HG2      LYS1108  30.169   5.240   0.366
   37   2HG   LYS1108           HG1      LYS1108  29.276   6.152   1.583
   38   1HD   LYS1108           HD2      LYS1108  29.363   4.229   3.093
   39   2HD   LYS1108           HD1      LYS1108  30.249   3.311   1.873
   40   1HE   LYS1108           HE2      LYS1108  32.069   4.944   1.969
   41   2HE   LYS1108           HE1      LYS1108  31.185   5.858   3.190
   42   1HZ   LYS1108           HZ3      LYS1108  32.160   3.069   3.492
   43   2HZ   LYS1108           HZ2      LYS1108  32.864   4.441   4.188
   44   3HZ   LYS1108           HZ1      LYS1108  31.317   3.951   4.665
   45    H    CYS1109           HN       CYS1109  25.988   2.902   0.936
   46    HA   CYS1109           HA       CYS1109  24.904   1.865  -1.555
   47   1HB   CYS1109           HB2      CYS1109  23.855   1.887   1.262
   48   2HB   CYS1109           HB1      CYS1109  22.884   1.349  -0.099
   49    H    GLY1110           HN       GLY1110  25.114   4.717   0.077
   50   1HA   GLY1110           HA1      GLY1110  23.730   6.280  -1.710
   51   2HA   GLY1110           HA2      GLY1110  24.019   6.744  -0.040
   52    HA   PRO1111           HA       PRO1111  19.648   6.824   0.603
   53   1HB   PRO1111           HB2      PRO1111  19.021   8.121  -1.995
   54   2HB   PRO1111           HB1      PRO1111  18.627   8.637  -0.351
   55   1HG   PRO1111           HG2      PRO1111  20.540   9.867  -1.743
   56   2HG   PRO1111           HG1      PRO1111  20.723   9.574  -0.003
   57   1HD   PRO1111           HD2      PRO1111  21.946   8.113  -2.312
   58   2HD   PRO1111           HD1      PRO1111  22.664   8.554  -0.748
   59    HA   PRO1112           HA       PRO1112  18.512   3.100  -1.631
   60   1HB   PRO1112           HB2      PRO1112  16.364   2.471  -0.102
   61   2HB   PRO1112           HB1      PRO1112  18.030   2.186   0.416
   62   1HG   PRO1112           HG2      PRO1112  16.191   4.451   1.110
   63   2HG   PRO1112           HG1      PRO1112  17.254   3.510   2.174
   64   1HD   PRO1112           HD2      PRO1112  17.942   5.950   1.259
   65   2HD   PRO1112           HD1      PRO1112  19.143   4.669   1.523
   66    HA   PRO1113           HA       PRO1113  15.210   5.155  -3.996
   67   1HB   PRO1113           HB2      PRO1113  15.950   4.294  -6.416
   68   2HB   PRO1113           HB1      PRO1113  16.837   5.587  -5.599
   69   1HG   PRO1113           HG2      PRO1113  17.527   2.694  -5.881
   70   2HG   PRO1113           HG1      PRO1113  18.586   4.112  -5.966
   71   1HD   PRO1113           HD2      PRO1113  18.270   2.488  -3.739
   72   2HD   PRO1113           HD1      PRO1113  18.891   4.148  -3.709
   73    HA   PRO1114           HA       PRO1114  13.077   1.122  -4.065
   74   1HB   PRO1114           HB2      PRO1114  11.037   1.760  -2.522
   75   2HB   PRO1114           HB1      PRO1114  12.652   1.617  -1.817
   76   1HG   PRO1114           HG2      PRO1114  11.083   4.061  -2.487
   77   2HG   PRO1114           HG1      PRO1114  12.200   3.777  -1.143
   78   1HD   PRO1114           HD2      PRO1114  12.777   5.068  -3.603
   79   2HD   PRO1114           HD1      PRO1114  13.932   4.610  -2.338
   80    H    ILE1115           HN       ILE1115  10.238   1.386  -3.832
   81    HA   ILE1115           HA       ILE1115   9.477   1.618  -6.502
   82    HB   ILE1115           HB       ILE1115   7.121   1.813  -5.516
   83   1HG1  ILE1115          2HG1      ILE1115   8.227   2.687  -3.287
   84   2HG1  ILE1115          1HG1      ILE1115   6.780   1.699  -3.237
   85   1HG2  ILE1115          3HG2      ILE1115   8.946  -0.493  -4.884
   86   2HG2  ILE1115          2HG2      ILE1115   7.187  -0.568  -4.753
   87   3HG2  ILE1115          1HG2      ILE1115   7.943  -0.267  -6.319
   88   1HD1  ILE1115          1HD1      ILE1115   9.581   0.709  -2.782
   89   2HD1  ILE1115          3HD1      ILE1115   8.373   1.022  -1.534
   90   3HD1  ILE1115          2HD1      ILE1115   8.113  -0.266  -2.711
   91    H    ASP1116           HN       ASP1116   7.906   3.183  -7.407
   92    HA   ASP1116           HA       ASP1116   8.866   5.841  -7.031
   93   1HB   ASP1116           HB2      ASP1116   8.072   4.848  -9.224
   94   2HB   ASP1116           HB1      ASP1116   6.430   5.024  -8.614
   95    H    ASN1117           HN       ASN1117   7.320   4.387  -4.878
   96    HA   ASN1117           HA       ASN1117   5.884   6.669  -3.922
   97   1HB   ASN1117           HB2      ASN1117   4.330   4.105  -4.336
   98   2HB   ASN1117           HB1      ASN1117   3.716   5.614  -3.666
   99   1HD2  ASN1117          1HD2      ASN1117   3.446   7.407  -5.055
  100   2HD2  ASN1117          2HD2      ASN1117   3.247   7.187  -6.757
  101    H    GLY1118           HN       GLY1118   8.124   4.780  -3.173
  102   1HA   GLY1118           HA1      GLY1118   7.999   2.960  -1.360
  103   2HA   GLY1118           HA2      GLY1118   7.087   4.171  -0.478
  104    H    ASP1119           HN       ASP1119   9.455   2.873   0.366
  105    HA   ASP1119           HA       ASP1119  11.856   4.154   0.127
  106   1HB   ASP1119           HB2      ASP1119  10.566   6.229   0.763
  107   2HB   ASP1119           HB1      ASP1119  10.274   5.490   2.334
  108    H    ILE1120           HN       ILE1120  13.221   3.926   2.259
  109    HA   ILE1120           HA       ILE1120  12.877   1.282   3.173
  110    HB   ILE1120           HB       ILE1120  14.572   1.955   4.969
  111   1HG1  ILE1120          2HG1      ILE1120  14.694   4.443   3.252
  112   2HG1  ILE1120          1HG1      ILE1120  14.088   4.378   4.904
  113   1HG2  ILE1120          1HG2      ILE1120  15.242   2.267   2.049
  114   2HG2  ILE1120          3HG2      ILE1120  16.408   1.963   3.337
  115   3HG2  ILE1120          2HG2      ILE1120  15.178   0.758   2.960
  116   1HD1  ILE1120          3HD1      ILE1120  16.895   3.650   4.112
  117   2HD1  ILE1120          2HD1      ILE1120  16.402   5.237   4.704
  118   3HD1  ILE1120          1HD1      ILE1120  16.253   3.822   5.748
  119    H    THR1121           HN       THR1121  12.250   0.472   5.167
  120    HA   THR1121           HA       THR1121  10.096   1.918   6.399
  121    HB   THR1121           HB       THR1121   9.599  -0.088   7.566
  122    HG1  THR1121           HG1      THR1121  11.355  -1.854   7.182
  123   1HG2  THR1121          3HG2      THR1121   9.225  -0.134   5.104
  124   2HG2  THR1121          2HG2      THR1121  10.790  -0.922   4.916
  125   3HG2  THR1121          1HG2      THR1121   9.495  -1.734   5.794
  126    H    SER1122           HN       SER1122  12.618   3.192   6.783
  127    HA   SER1122           HA       SER1122  12.546   3.492   9.641
  128   1HB   SER1122           HB2      SER1122  14.965   2.290   8.292
  129   2HB   SER1122           HB1      SER1122  15.042   3.072   9.869
  130    HG   SER1122           HG       SER1122  14.452   1.204  10.615
  131    H    PHE1123           HN       PHE1123  14.467   4.165   6.733
  132    HA   PHE1123           HA       PHE1123  15.468   6.039   5.944
  133   1HB   PHE1123           HB2      PHE1123  13.081   6.701   5.828
  134   2HB   PHE1123           HB1      PHE1123  13.226   7.408   7.430
  135    HD1  PHE1123           HD1      PHE1123  15.015   7.565   4.156
  136    HD2  PHE1123           HD2      PHE1123  13.468   9.689   7.503
  137    HE1  PHE1123           HE1      PHE1123  15.728   9.686   3.135
  138    HE2  PHE1123           HE2      PHE1123  14.179  11.814   6.488
  139    HZ   PHE1123           HZ       PHE1123  15.310  11.815   4.301
  140    HA   PRO1124           HA       PRO1124  17.387   7.309   9.962
  141   1HB   PRO1124           HB2      PRO1124  18.725   5.183  10.835
  142   2HB   PRO1124           HB1      PRO1124  16.973   5.289  11.033
  143   1HG   PRO1124           HG2      PRO1124  18.552   3.602   9.193
  144   2HG   PRO1124           HG1      PRO1124  16.916   3.352   9.825
  145   1HD   PRO1124           HD2      PRO1124  17.718   4.499   7.284
  146   2HD   PRO1124           HD1      PRO1124  16.082   4.122   7.860
  147    H    LEU1125           HN       LEU1125  18.360   7.297   7.112
  148    HA   LEU1125           HA       LEU1125  21.040   8.117   7.667
  149   1HB   LEU1125           HB2      LEU1125  22.029   6.477   5.958
  150   2HB   LEU1125           HB1      LEU1125  21.730   5.909   7.587
  151    HG   LEU1125           HG       LEU1125  21.038   4.546   5.369
  152   1HD1  LEU1125          3HD1      LEU1125  19.590   4.548   8.005
  153   2HD1  LEU1125          2HD1      LEU1125  19.548   3.245   6.817
  154   3HD1  LEU1125          1HD1      LEU1125  21.065   3.663   7.614
  155   1HD2  LEU1125          1HD2      LEU1125  18.543   6.043   6.155
  156   2HD2  LEU1125          3HD2      LEU1125  19.399   6.183   4.620
  157   3HD2  LEU1125          2HD2      LEU1125  18.614   4.664   5.059
  158    H    SER1126           HN       SER1126  22.203   8.066   5.220
  159    HA   SER1126           HA       SER1126  20.359   8.985   3.195
  160   1HB   SER1126           HB2      SER1126  22.334  10.864   4.497
  161   2HB   SER1126           HB1      SER1126  21.496  11.204   2.982
  162    HG   SER1126           HG       SER1126  20.420  12.111   4.791
  163    H    VAL1127           HN       VAL1127  23.192   7.515   4.122
  164    HA   VAL1127           HA       VAL1127  24.126   7.466   1.361
  165    HB   VAL1127           HB       VAL1127  25.470   9.186   2.557
  166   1HG1  VAL1127          2HG1      VAL1127  25.432   8.192   4.775
  167   2HG1  VAL1127          1HG1      VAL1127  26.395   6.832   4.198
  168   3HG1  VAL1127          3HG1      VAL1127  27.093   8.451   4.241
  169   1HG2  VAL1127          3HG2      VAL1127  26.987   6.730   1.687
  170   2HG2  VAL1127          2HG2      VAL1127  26.410   8.026   0.639
  171   3HG2  VAL1127          1HG2      VAL1127  27.662   8.352   1.840
  172    H    TYR1128           HN       TYR1128  23.320   5.895   4.081
  173    HA   TYR1128           HA       TYR1128  23.668   3.813   4.996
  174   1HB   TYR1128           HB2      TYR1128  23.122   3.574   2.109
  175   2HB   TYR1128           HB1      TYR1128  23.759   2.124   2.875
  176    HD1  TYR1128           HD1      TYR1128  22.535   1.200   4.899
  177    HD2  TYR1128           HD2      TYR1128  20.864   4.154   2.335
  178    HE1  TYR1128           HE1      TYR1128  20.289   0.640   5.727
  179    HE2  TYR1128           HE2      TYR1128  18.615   3.613   3.165
  180    HH   TYR1128           HH       TYR1128  17.462   1.673   4.214
  181    H    ALA1129           HN       ALA1129  24.862   1.546   3.979
  182    HA   ALA1129           HA       ALA1129  27.697   2.203   3.611
  183   1HB   ALA1129           HB2      ALA1129  27.375   1.833   6.010
  184   2HB   ALA1129           HB1      ALA1129  26.651   0.260   5.674
  185   3HB   ALA1129           HB3      ALA1129  28.349   0.549   5.293
  186    HA   PRO1130           HA       PRO1130  27.405  -0.817   0.405
  187   1HB   PRO1130           HB2      PRO1130  29.958  -1.880   0.566
  188   2HB   PRO1130           HB1      PRO1130  29.517  -0.420  -0.322
  189   1HG   PRO1130           HG2      PRO1130  30.730  -0.700   2.395
  190   2HG   PRO1130           HG1      PRO1130  31.067   0.499   1.133
  191   1HD   PRO1130           HD2      PRO1130  29.564   1.090   3.281
  192   2HD   PRO1130           HD1      PRO1130  29.216   1.779   1.682
  193    H    ALA1131           HN       ALA1131  26.998  -2.963   0.119
  194    HA   ALA1131           HA       ALA1131  26.588  -5.143   0.602
  195   1HB   ALA1131           HB3      ALA1131  28.961  -5.264   1.199
  196   2HB   ALA1131           HB1      ALA1131  27.972  -6.314   2.216
  197   3HB   ALA1131           HB2      ALA1131  28.565  -4.778   2.848
  198    H    SER1132           HN       SER1132  25.334  -2.724   2.112
  199    HA   SER1132           HA       SER1132  24.266  -4.160   4.432
  200   1HB   SER1132           HB2      SER1132  23.977  -1.278   3.563
  201   2HB   SER1132           HB1      SER1132  23.193  -1.967   4.984
  202    HG   SER1132           HG       SER1132  25.171  -2.294   5.914
  203    H    SER1133           HN       SER1133  21.983  -4.281   4.817
  204    HA   SER1133           HA       SER1133  20.281  -3.989   2.445
  205   1HB   SER1133           HB2      SER1133  19.964  -6.431   4.151
  206   2HB   SER1133           HB1      SER1133  19.520  -6.177   2.465
  207    HG   SER1133           HG       SER1133  21.826  -7.141   3.503
  208    H    VAL1134           HN       VAL1134  18.049  -3.735   2.893
  209    HA   VAL1134           HA       VAL1134  17.215  -3.582   5.677
  210    HB   VAL1134           HB       VAL1134  16.233  -1.284   5.314
  211   1HG1  VAL1134          1HG1      VAL1134  18.176  -1.656   6.732
  212   2HG1  VAL1134          3HG1      VAL1134  19.239  -1.523   5.330
  213   3HG1  VAL1134          2HG1      VAL1134  18.311  -0.124   5.870
  214   1HG2  VAL1134          2HG2      VAL1134  16.437  -1.226   2.877
  215   2HG2  VAL1134          1HG2      VAL1134  17.260   0.141   3.629
  216   3HG2  VAL1134          3HG2      VAL1134  18.194  -1.227   3.025
  217    H    GLU1135           HN       GLU1135  14.845  -2.601   5.661
  218    HA   GLU1135           HA       GLU1135  13.354  -4.232   3.735
  219   1HB   GLU1135           HB2      GLU1135  12.959  -4.666   6.123
  220   2HB   GLU1135           HB1      GLU1135  12.473  -2.992   6.349
  221   1HG   GLU1135           HG2      GLU1135  10.591  -3.350   4.816
  222   2HG   GLU1135           HG1      GLU1135  11.067  -5.038   4.650
  223    H    TYR1136           HN       TYR1136  11.526  -3.405   2.653
  224    HA   TYR1136           HA       TYR1136  11.527  -0.472   2.382
  225   1HB   TYR1136           HB2      TYR1136  11.315  -2.671   0.391
  226   2HB   TYR1136           HB1      TYR1136  10.363  -1.222   0.097
  227    HD1  TYR1136           HD1      TYR1136  12.170  -1.834  -1.924
  228    HD2  TYR1136           HD2      TYR1136  13.015   0.113   1.758
  229    HE1  TYR1136           HE1      TYR1136  14.107  -0.749  -2.958
  230    HE2  TYR1136           HE2      TYR1136  14.967   1.204   0.735
  231    HH   TYR1136           HH       TYR1136  15.508   1.246  -2.613
  232    H    GLN1137           HN       GLN1137   9.449   0.451   1.647
  233    HA   GLN1137           HA       GLN1137   7.007  -0.952   1.975
  234   1HB   GLN1137           HB2      GLN1137   7.631  -0.826   4.351
  235   2HB   GLN1137           HB1      GLN1137   7.790   0.921   4.219
  236   1HG   GLN1137           HG2      GLN1137   5.408   1.097   3.695
  237   2HG   GLN1137           HG1      GLN1137   5.252  -0.653   3.843
  238   1HE2  GLN1137          1HE2      GLN1137   3.947   1.489   5.343
  239   2HE2  GLN1137          2HE2      GLN1137   4.324   1.203   7.004
  240    H    CYS1138           HN       CYS1138   5.322   0.185   1.163
  241    HA   CYS1138           HA       CYS1138   5.978   2.613  -0.231
  242   1HB   CYS1138           HB2      CYS1138   4.089   0.518  -0.527
  243   2HB   CYS1138           HB1      CYS1138   3.184   2.015  -0.358
  244    H    GLN1139           HN       GLN1139   4.707   4.558  -0.095
  245    HA   GLN1139           HA       GLN1139   4.605   5.725   2.372
  246   1HB   GLN1139           HB2      GLN1139   3.109   7.431   1.355
  247   2HB   GLN1139           HB1      GLN1139   4.519   7.056   0.375
  248   1HG   GLN1139           HG2      GLN1139   3.149   5.613  -1.043
  249   2HG   GLN1139           HG1      GLN1139   1.735   6.000  -0.062
  250   1HE2  GLN1139          1HE2      GLN1139   2.222   6.444  -2.903
  251   2HE2  GLN1139          2HE2      GLN1139   2.029   8.142  -3.162
  252    H    ASN1140           HN       ASN1140   2.782   6.547   3.621
  253    HA   ASN1140           HA       ASN1140   1.291   4.702   4.879
  254   1HB   ASN1140           HB2      ASN1140  -0.236   6.493   5.579
  255   2HB   ASN1140           HB1      ASN1140   1.442   7.030   5.613
  256   1HD2  ASN1140          1HD2      ASN1140  -1.628   7.309   4.017
  257   2HD2  ASN1140          2HD2      ASN1140  -1.257   8.733   3.112
  258    H    LEU1141           HN       LEU1141  -0.711   3.773   4.758
  259    HA   LEU1141           HA       LEU1141  -2.672   3.022   3.882
  260   1HB   LEU1141           HB2      LEU1141  -2.257   5.188   1.823
  261   2HB   LEU1141           HB1      LEU1141  -3.673   4.158   1.900
  262    HG   LEU1141           HG       LEU1141  -2.798   6.066   4.077
  263   1HD1  LEU1141          1HD1      LEU1141  -3.540   7.254   2.083
  264   2HD1  LEU1141          3HD1      LEU1141  -5.021   6.296   2.052
  265   3HD1  LEU1141          2HD1      LEU1141  -4.718   7.410   3.386
  266   1HD2  LEU1141          2HD2      LEU1141  -4.018   4.138   4.937
  267   2HD2  LEU1141          1HD2      LEU1141  -4.994   5.602   5.042
  268   3HD2  LEU1141          3HD2      LEU1141  -5.309   4.423   3.769
  269    H    TYR1142           HN       TYR1142  -0.256   3.778   1.373
  270    HA   TYR1142           HA       TYR1142  -1.003   1.706  -0.376
  271   1HB   TYR1142           HB2      TYR1142   1.553   3.263  -0.029
  272   2HB   TYR1142           HB1      TYR1142   1.390   2.006  -1.250
  273    HD1  TYR1142           HD1      TYR1142  -0.328   5.104  -0.063
  274    HD2  TYR1142           HD2      TYR1142   0.633   2.586  -3.357
  275    HE1  TYR1142           HE1      TYR1142  -1.349   6.731  -1.598
  276    HE2  TYR1142           HE2      TYR1142  -0.387   4.207  -4.900
  277    HH   TYR1142           HH       TYR1142  -1.214   7.362  -3.973
  278    H    GLN1143           HN       GLN1143  -0.509  -0.397  -0.481
  279    HA   GLN1143           HA       GLN1143   1.034  -1.525   1.740
  280   1HB   GLN1143           HB2      GLN1143  -1.309  -2.314   1.353
  281   2HB   GLN1143           HB1      GLN1143  -0.801  -2.931  -0.212
  282   1HG   GLN1143           HG2      GLN1143  -0.902  -4.722   1.389
  283   2HG   GLN1143           HG1      GLN1143   0.770  -4.444   0.905
  284   1HE2  GLN1143          1HE2      GLN1143   1.576  -5.408   2.759
  285   2HE2  GLN1143          2HE2      GLN1143   1.494  -4.646   4.307
  286    H    LEU1144           HN       LEU1144   2.255  -3.621   1.098
  287    HA   LEU1144           HA       LEU1144   3.638  -3.147  -1.463
  288   1HB   LEU1144           HB2      LEU1144   4.726  -3.080   1.103
  289   2HB   LEU1144           HB1      LEU1144   5.192  -4.648   0.473
  290    HG   LEU1144           HG       LEU1144   6.034  -3.359  -1.593
  291   1HD1  LEU1144          3HD1      LEU1144   4.932  -1.246  -1.098
  292   2HD1  LEU1144          2HD1      LEU1144   5.861  -1.100   0.393
  293   3HD1  LEU1144          1HD1      LEU1144   6.683  -1.046  -1.166
  294   1HD2  LEU1144          1HD2      LEU1144   7.403  -3.035   1.070
  295   2HD2  LEU1144          3HD2      LEU1144   7.507  -4.439   0.007
  296   3HD2  LEU1144          2HD2      LEU1144   8.174  -2.888  -0.508
  297    H    GLU1145           HN       GLU1145   4.988  -5.253  -2.000
  298    HA   GLU1145           HA       GLU1145   3.816  -7.750  -1.294
  299   1HB   GLU1145           HB2      GLU1145   2.111  -6.670  -2.873
  300   2HB   GLU1145           HB1      GLU1145   3.310  -6.893  -4.138
  301   1HG   GLU1145           HG2      GLU1145   2.194  -9.119  -2.451
  302   2HG   GLU1145           HG1      GLU1145   1.582  -8.668  -4.041
  303    H    GLY1146           HN       GLY1146   5.414  -9.166  -1.431
  304   1HA   GLY1146           HA1      GLY1146   7.392  -8.870  -3.597
  305   2HA   GLY1146           HA2      GLY1146   7.001 -10.383  -2.794
  306    H    ASN1147           HN       ASN1147   9.605  -9.817  -2.989
  307    HA   ASN1147           HA       ASN1147  10.453  -9.745  -0.295
  308   1HB   ASN1147           HB2      ASN1147  12.765  -9.669  -1.275
  309   2HB   ASN1147           HB1      ASN1147  11.763 -10.990  -1.871
  310   1HD2  ASN1147          1HD2      ASN1147  13.445  -8.100  -2.659
  311   2HD2  ASN1147          2HD2      ASN1147  13.192  -8.159  -4.367
  312    H    LYS1148           HN       LYS1148   9.682  -7.827   0.583
  313    HA   LYS1148           HA       LYS1148  10.237  -5.265  -0.479
  314   1HB   LYS1148           HB2      LYS1148   9.719  -4.609   2.007
  315   2HB   LYS1148           HB1      LYS1148   8.450  -5.214   0.950
  316   1HG   LYS1148           HG2      LYS1148   8.261  -6.247   3.110
  317   2HG   LYS1148           HG1      LYS1148   8.744  -7.458   1.922
  318   1HD   LYS1148           HD2      LYS1148  11.059  -7.283   2.668
  319   2HD   LYS1148           HD1      LYS1148  10.597  -6.043   3.836
  320   1HE   LYS1148           HE2      LYS1148   9.147  -7.653   4.971
  321   2HE   LYS1148           HE1      LYS1148   9.607  -8.891   3.804
  322   1HZ   LYS1148           HZ1      LYS1148  11.894  -8.709   4.568
  323   2HZ   LYS1148           HZ3      LYS1148  11.448  -7.523   5.691
  324   3HZ   LYS1148           HZ2      LYS1148  10.864  -9.102   5.851
  325    H    ARG1149           HN       ARG1149  12.178  -7.490   1.204
  326    HA   ARG1149           HA       ARG1149  14.010  -5.415   2.154
  327   1HB   ARG1149           HB2      ARG1149  13.498  -7.241   3.704
  328   2HB   ARG1149           HB1      ARG1149  14.075  -8.415   2.529
  329   1HG   ARG1149           HG2      ARG1149  16.314  -7.647   2.737
  330   2HG   ARG1149           HG1      ARG1149  15.809  -6.259   3.704
  331   1HD   ARG1149           HD2      ARG1149  15.061  -7.760   5.478
  332   2HD   ARG1149           HD1      ARG1149  15.544  -9.153   4.511
  333    HE   ARG1149           HE       ARG1149  17.768  -7.494   4.799
  334   1HH1  ARG1149          1HH1      ARG1149  15.693  -9.483   6.769
  335   2HH1  ARG1149          2HH1      ARG1149  16.924  -9.840   7.933
  336   1HH2  ARG1149          1HH2      ARG1149  19.395  -7.959   6.327
  337   2HH2  ARG1149          2HH2      ARG1149  19.029  -8.974   7.682
  338    H    ILE1150           HN       ILE1150  15.658  -4.772   0.933
  339    HA   ILE1150           HA       ILE1150  16.743  -6.672  -1.036
  340    HB   ILE1150           HB       ILE1150  16.889  -5.076  -2.729
  341   1HG1  ILE1150          2HG1      ILE1150  17.799  -3.220  -1.420
  342   2HG1  ILE1150          1HG1      ILE1150  16.464  -2.671  -2.427
  343   1HG2  ILE1150          3HG2      ILE1150  14.291  -4.551  -1.297
  344   2HG2  ILE1150          2HG2      ILE1150  14.614  -4.197  -2.994
  345   3HG2  ILE1150          1HG2      ILE1150  14.621  -5.866  -2.424
  346   1HD1  ILE1150          1HD1      ILE1150  14.985  -2.731  -0.478
  347   2HD1  ILE1150          3HD1      ILE1150  16.346  -3.237   0.523
  348   3HD1  ILE1150          2HD1      ILE1150  16.360  -1.649  -0.248
  349    H    THR1151           HN       THR1151  18.845  -5.492  -2.013
  350    HA   THR1151           HA       THR1151  20.476  -4.386   0.143
  351    HB   THR1151           HB       THR1151  21.380  -6.781  -1.465
  352    HG1  THR1151           HG1      THR1151  20.373  -7.937  -0.017
  353   1HG2  THR1151          2HG2      THR1151  23.177  -5.294  -0.712
  354   2HG2  THR1151          1HG2      THR1151  22.584  -5.414   0.945
  355   3HG2  THR1151          3HG2      THR1151  23.230  -6.841   0.134
  356    H    CYS1152           HN       CYS1152  21.629  -2.723  -0.630
  357    HA   CYS1152           HA       CYS1152  21.601  -1.952  -3.316
  358   1HB   CYS1152           HB2      CYS1152  22.700  -0.088  -2.624
  359   2HB   CYS1152           HB1      CYS1152  22.258  -0.691  -1.031
  360    H    ARG1153           HN       ARG1153  23.569  -1.532  -4.618
  361    HA   ARG1153           HA       ARG1153  25.783  -3.353  -4.262
  362   1HB   ARG1153           HB2      ARG1153  25.508  -4.313  -6.565
  363   2HB   ARG1153           HB1      ARG1153  24.320  -4.858  -5.392
  364   1HG   ARG1153           HG2      ARG1153  23.727  -2.577  -7.234
  365   2HG   ARG1153           HG1      ARG1153  23.533  -4.251  -7.754
  366   1HD   ARG1153           HD2      ARG1153  22.070  -4.604  -5.744
  367   2HD   ARG1153           HD1      ARG1153  22.137  -2.861  -5.474
  368    HE   ARG1153           HE       ARG1153  20.721  -2.550  -7.264
  369   1HH1  ARG1153          1HH1      ARG1153  21.811  -5.859  -7.183
  370   2HH1  ARG1153          2HH1      ARG1153  20.678  -6.396  -8.378
  371   1HH2  ARG1153          1HH2      ARG1153  19.227  -3.249  -8.839
  372   2HH2  ARG1153          2HH2      ARG1153  19.210  -4.913  -9.319
  373    H    ASN1154           HN       ASN1154  27.511  -2.184  -4.650
  374    HA   ASN1154           HA       ASN1154  28.851  -0.489  -5.339
  375   1HB   ASN1154           HB2      ASN1154  28.980  -0.219  -7.834
  376   2HB   ASN1154           HB1      ASN1154  29.163  -1.868  -7.257
  377   1HD2  ASN1154          1HD2      ASN1154  27.625  -3.369  -7.737
  378   2HD2  ASN1154          2HD2      ASN1154  26.368  -3.101  -8.892
  379    H    GLY1155           HN       GLY1155  27.303   0.893  -4.068
  380   1HA   GLY1155           HA1      GLY1155  27.029   3.369  -5.239
  381   2HA   GLY1155           HA2      GLY1155  26.161   2.858  -3.803
  382    H    GLN1156           HN       GLN1156  24.704   0.728  -5.234
  383    HA   GLN1156           HA       GLN1156  22.570   2.412  -6.226
  384   1HB   GLN1156           HB2      GLN1156  23.960   2.078  -8.226
  385   2HB   GLN1156           HB1      GLN1156  23.835   0.336  -8.021
  386   1HG   GLN1156           HG2      GLN1156  22.302   0.945  -9.710
  387   2HG   GLN1156           HG1      GLN1156  21.355   0.578  -8.270
  388   1HE2  GLN1156          1HE2      GLN1156  20.680   2.200 -10.598
  389   2HE2  GLN1156          2HE2      GLN1156  20.282   3.768  -9.990
  390    H    TRP1157           HN       TRP1157  21.033   1.653  -4.873
  391    HA   TRP1157           HA       TRP1157  20.809  -1.022  -3.997
  392   1HB   TRP1157           HB2      TRP1157  18.899   1.303  -3.986
  393   2HB   TRP1157           HB1      TRP1157  18.434  -0.276  -3.371
  394    HD1  TRP1157           HD1      TRP1157  20.751   2.662  -2.587
  395    HE1  TRP1157           HE1      TRP1157  21.432   2.520  -0.107
  396    HE3  TRP1157           HE3      TRP1157  18.744  -1.890  -1.485
  397    HZ2  TRP1157           HZ2      TRP1157  21.158   0.680   2.037
  398    HZ3  TRP1157           HZ3      TRP1157  18.996  -2.782   0.791
  399    HH2  TRP1157           HH2      TRP1157  20.177  -1.528   2.512
  400    H    SER1158           HN       SER1158  18.483  -2.039  -4.222
  401    HA   SER1158           HA       SER1158  17.836  -2.209  -7.092
  402   1HB   SER1158           HB2      SER1158  17.247  -4.576  -6.708
  403   2HB   SER1158           HB1      SER1158  18.939  -4.256  -6.324
  404    HG   SER1158           HG       SER1158  18.565  -4.761  -4.319
  405    H    GLU1159           HN       GLU1159  15.825  -1.659  -7.600
  406    HA   GLU1159           HA       GLU1159  13.935  -0.722  -5.783
  407   1HB   GLU1159           HB2      GLU1159  13.936  -0.106  -8.149
  408   2HB   GLU1159           HB1      GLU1159  13.529  -1.756  -8.598
  409   1HG   GLU1159           HG2      GLU1159  11.381  -1.539  -7.459
  410   2HG   GLU1159           HG1      GLU1159  11.789   0.116  -7.009
  411    HA   PRO1160           HA       PRO1160  12.102  -4.481  -4.267
  412   1HB   PRO1160           HB2      PRO1160   9.811  -3.525  -3.241
  413   2HB   PRO1160           HB1      PRO1160  11.378  -3.155  -2.510
  414   1HG   PRO1160           HG2      PRO1160   9.728  -1.497  -4.387
  415   2HG   PRO1160           HG1      PRO1160  10.522  -1.008  -2.879
  416   1HD   PRO1160           HD2      PRO1160  11.610  -0.538  -5.316
  417   2HD   PRO1160           HD1      PRO1160  12.597  -0.859  -3.876
  418    HA   PRO1161           HA       PRO1161   9.271  -6.317  -7.098
  419   1HB   PRO1161           HB2      PRO1161   7.342  -6.693  -4.858
  420   2HB   PRO1161           HB1      PRO1161   7.951  -7.869  -6.028
  421   1HG   PRO1161           HG2      PRO1161   8.878  -7.852  -3.538
  422   2HG   PRO1161           HG1      PRO1161   9.973  -8.128  -4.906
  423   1HD   PRO1161           HD2      PRO1161   9.594  -5.678  -3.241
  424   2HD   PRO1161           HD1      PRO1161  11.078  -6.340  -3.956
  425    H    LYS1162           HN       LYS1162   6.654  -5.237  -4.951
  426    HA   LYS1162           HA       LYS1162   6.099  -2.888  -6.484
  427   1HB   LYS1162           HB2      LYS1162   3.987  -3.709  -7.425
  428   2HB   LYS1162           HB1      LYS1162   5.387  -4.528  -8.088
  429   1HG   LYS1162           HG2      LYS1162   4.964  -6.434  -6.623
  430   2HG   LYS1162           HG1      LYS1162   3.553  -5.608  -5.960
  431   1HD   LYS1162           HD2      LYS1162   2.524  -5.584  -8.182
  432   2HD   LYS1162           HD1      LYS1162   3.935  -6.415  -8.843
  433   1HE   LYS1162           HE2      LYS1162   3.496  -8.324  -7.375
  434   2HE   LYS1162           HE1      LYS1162   2.082  -7.495  -6.723
  435   1HZ   LYS1162           HZ3      LYS1162   2.448  -8.316  -9.553
  436   2HZ   LYS1162           HZ2      LYS1162   1.462  -9.094  -8.420
  437   3HZ   LYS1162           HZ1      LYS1162   1.092  -7.522  -8.926
  438    H    CYS1163           HN       CYS1163   4.058  -1.846  -5.881
  439    HA   CYS1163           HA       CYS1163   3.355  -2.409  -3.081
  440   1HB   CYS1163           HB2      CYS1163   3.019   0.108  -4.730
  441   2HB   CYS1163           HB1      CYS1163   2.484  -0.077  -3.066
  442    H    LEU1164           HN       LEU1164   1.290  -2.847  -2.489
  443    HA   LEU1164           HA       LEU1164  -0.662  -3.189  -4.649
  444   1HB   LEU1164           HB2      LEU1164  -0.038  -4.610  -2.189
  445   2HB   LEU1164           HB1      LEU1164  -1.747  -4.247  -2.319
  446    HG   LEU1164           HG       LEU1164  -1.203  -6.474  -3.199
  447   1HD1  LEU1164          1HD1      LEU1164  -3.113  -5.273  -4.107
  448   2HD1  LEU1164          3HD1      LEU1164  -2.077  -4.518  -5.317
  449   3HD1  LEU1164          2HD1      LEU1164  -2.341  -6.260  -5.349
  450   1HD2  LEU1164          3HD2      LEU1164   1.074  -5.988  -3.965
  451   2HD2  LEU1164          2HD2      LEU1164   0.097  -6.722  -5.236
  452   3HD2  LEU1164          1HD2      LEU1164   0.418  -4.988  -5.261
  453    H    HIS1165           HN       HIS1165  -1.909  -1.448  -4.944
  454    HA   HIS1165           HA       HIS1165  -2.368   0.649  -3.234
  455   1HB   HIS1165           HB2      HIS1165  -4.314  -0.492  -5.254
  456   2HB   HIS1165           HB1      HIS1165  -4.396   1.124  -4.559
  457    HD1  HIS1165           HD1      HIS1165  -2.827  -0.813  -7.256
  458    HD2  HIS1165           HD2      HIS1165  -2.259   2.864  -5.407
  459    HE1  HIS1165           HE1      HIS1165  -1.329   0.492  -8.798
  460    HE2  HIS1165           HE2      HIS1165  -1.069   2.743  -7.699
  461    HA   PRO1166           HA       PRO1166  -4.706  -1.187   0.059
  462   1HB   PRO1166           HB2      PRO1166  -5.607   1.121   1.200
  463   2HB   PRO1166           HB1      PRO1166  -3.971   0.496   1.418
  464   1HG   PRO1166           HG2      PRO1166  -4.960   2.633  -0.429
  465   2HG   PRO1166           HG1      PRO1166  -3.482   2.595   0.549
  466   1HD   PRO1166           HD2      PRO1166  -3.485   2.058  -2.099
  467   2HD   PRO1166           HD1      PRO1166  -2.357   1.275  -0.974
  468    H    CYS1167           HN       CYS1167  -6.848   1.275   0.510
  469    HA   CYS1167           HA       CYS1167  -8.840  -0.008  -1.226
  470   1HB   CYS1167           HB2      CYS1167  -8.835   0.020   1.527
  471   2HB   CYS1167           HB1      CYS1167  -9.918   1.350   1.118
  472    H    VAL1168           HN       VAL1168  -9.540   1.252  -2.756
  473    HA   VAL1168           HA       VAL1168 -10.123   4.059  -2.168
  474    HB   VAL1168           HB       VAL1168  -8.682   3.192  -4.680
  475   1HG1  VAL1168          3HG1      VAL1168 -10.244   5.095  -4.918
  476   2HG1  VAL1168          2HG1      VAL1168  -9.350   5.951  -3.663
  477   3HG1  VAL1168          1HG1      VAL1168  -8.560   5.549  -5.189
  478   1HG2  VAL1168          2HG2      VAL1168  -7.641   4.706  -2.288
  479   2HG2  VAL1168          1HG2      VAL1168  -7.181   3.074  -2.773
  480   3HG2  VAL1168          3HG2      VAL1168  -6.765   4.449  -3.797
  481    H    ILE1169           HN       ILE1169 -12.268   3.110  -2.057
  482    HA   ILE1169           HA       ILE1169 -13.409   2.123  -4.537
  483    HB   ILE1169           HB       ILE1169 -13.964   1.559  -1.922
  484   1HG1  ILE1169          2HG1      ILE1169 -15.816   1.273  -4.298
  485   2HG1  ILE1169          1HG1      ILE1169 -14.521   0.166  -3.854
  486   1HG2  ILE1169          2HG2      ILE1169 -15.046   3.712  -1.564
  487   2HG2  ILE1169          1HG2      ILE1169 -16.170   3.374  -2.880
  488   3HG2  ILE1169          3HG2      ILE1169 -16.198   2.385  -1.419
  489   1HD1  ILE1169          1HD1      ILE1169 -15.705  -0.332  -1.754
  490   2HD1  ILE1169          3HD1      ILE1169 -17.023   0.717  -2.274
  491   3HD1  ILE1169          2HD1      ILE1169 -16.649  -0.745  -3.186
  492    H    SER1170           HN       SER1170 -15.661   3.077  -5.099
  493    HA   SER1170           HA       SER1170 -15.219   5.888  -5.622
  494   1HB   SER1170           HB2      SER1170 -17.473   4.056  -6.471
  495   2HB   SER1170           HB1      SER1170 -17.232   5.707  -7.044
  496    HG   SER1170           HG       SER1170 -15.264   5.049  -7.949
  497    H    ARG1171           HN       ARG1171 -15.572   7.112  -3.820
  498    HA   ARG1171           HA       ARG1171 -17.610   6.742  -1.921
  499   1HB   ARG1171           HB2      ARG1171 -17.205   9.173  -1.383
  500   2HB   ARG1171           HB1      ARG1171 -15.775   8.152  -1.354
  501   1HG   ARG1171           HG2      ARG1171 -14.997   9.999  -2.465
  502   2HG   ARG1171           HG1      ARG1171 -15.479   8.964  -3.810
  503   1HD   ARG1171           HD2      ARG1171 -16.242  11.242  -4.171
  504   2HD   ARG1171           HD1      ARG1171 -17.614  10.156  -3.955
  505    HE   ARG1171           HE       ARG1171 -16.940  11.270  -1.472
  506   1HH1  ARG1171          1HH1      ARG1171 -18.290  12.207  -4.545
  507   2HH1  ARG1171          2HH1      ARG1171 -19.236  13.497  -3.882
  508   1HH2  ARG1171          1HH2      ARG1171 -18.183  12.966  -0.590
  509   2HH2  ARG1171          2HH2      ARG1171 -19.175  13.928  -1.634
  510    H    GLU1172           HN       GLU1172 -17.616   8.182  -5.074
  511    HA   GLU1172           HA       GLU1172 -20.104   9.579  -4.740
  512   1HB   GLU1172           HB2      GLU1172 -18.277  10.224  -6.364
  513   2HB   GLU1172           HB1      GLU1172 -18.740   8.830  -7.330
  514   1HG   GLU1172           HG2      GLU1172 -19.728  10.851  -8.214
  515   2HG   GLU1172           HG1      GLU1172 -20.978   9.764  -7.610
  516    H    ILE1173           HN       ILE1173 -19.566   6.449  -4.608
  517    HA   ILE1173           HA       ILE1173 -22.040   5.756  -6.035
  518    HB   ILE1173           HB       ILE1173 -19.515   4.135  -5.750
  519   1HG1  ILE1173          2HG1      ILE1173 -19.675   5.851  -7.567
  520   2HG1  ILE1173          1HG1      ILE1173 -19.447   4.205  -8.151
  521   1HG2  ILE1173          1HG2      ILE1173 -22.209   3.264  -6.773
  522   2HG2  ILE1173          3HG2      ILE1173 -20.717   2.342  -6.935
  523   3HG2  ILE1173          2HG2      ILE1173 -21.384   2.665  -5.335
  524   1HD1  ILE1173          3HD1      ILE1173 -21.835   4.069  -8.661
  525   2HD1  ILE1173          2HD1      ILE1173 -22.047   5.723  -8.086
  526   3HD1  ILE1173          1HD1      ILE1173 -21.055   5.404  -9.509
  527    H    MET1174           HN       MET1174 -19.967   5.197  -3.237
  528    HA   MET1174           HA       MET1174 -21.897   3.446  -1.978
  529   1HB   MET1174           HB2      MET1174 -19.645   4.625  -0.432
  530   2HB   MET1174           HB1      MET1174 -20.265   2.978  -0.434
  531   1HG   MET1174           HG2      MET1174 -18.431   4.272  -2.424
  532   2HG   MET1174           HG1      MET1174 -18.112   2.888  -1.380
  533   1HE   MET1174           HE2      MET1174 -17.119   2.232  -3.916
  534   2HE   MET1174           HE1      MET1174 -18.172   1.677  -5.218
  535   3HE   MET1174           HE3      MET1174 -18.036   3.399  -4.865
  536    H    GLU1175           HN       GLU1175 -20.349   6.507  -1.021
  537    HA   GLU1175           HA       GLU1175 -22.370   7.104   0.896
  538   1HB   GLU1175           HB2      GLU1175 -21.002   8.798   1.541
  539   2HB   GLU1175           HB1      GLU1175 -19.819   7.924   0.572
  540   1HG   GLU1175           HG2      GLU1175 -20.246   9.391  -1.312
  541   2HG   GLU1175           HG1      GLU1175 -21.480  10.246  -0.388
  542    H    ASN1176           HN       ASN1176 -22.574   7.022  -2.336
  543    HA   ASN1176           HA       ASN1176 -24.188   9.441  -2.636
  544   1HB   ASN1176           HB2      ASN1176 -22.424   8.895  -4.316
  545   2HB   ASN1176           HB1      ASN1176 -23.362   7.469  -4.737
  546   1HD2  ASN1176          1HD2      ASN1176 -23.668   8.155  -6.846
  547   2HD2  ASN1176          2HD2      ASN1176 -24.746   9.443  -7.246
  548    H    TYR1177           HN       TYR1177 -24.422   6.025  -3.667
  549    HA   TYR1177           HA       TYR1177 -27.086   5.956  -4.322
  550   1HB   TYR1177           HB2      TYR1177 -25.420   3.815  -2.989
  551   2HB   TYR1177           HB1      TYR1177 -27.031   3.532  -3.634
  552    HD1  TYR1177           HD1      TYR1177 -26.044   5.714  -5.952
  553    HD2  TYR1177           HD2      TYR1177 -24.898   1.867  -4.546
  554    HE1  TYR1177           HE1      TYR1177 -25.071   5.205  -8.150
  555    HE2  TYR1177           HE2      TYR1177 -23.918   1.346  -6.733
  556    HH   TYR1177           HH       TYR1177 -23.388   3.709  -9.120
  557    H    ASN1178           HN       ASN1178 -25.878   4.688  -1.247
  558    HA   ASN1178           HA       ASN1178 -27.329   6.110   0.553
  559   1HB   ASN1178           HB2      ASN1178 -29.247   4.417   0.973
  560   2HB   ASN1178           HB1      ASN1178 -29.439   5.592  -0.320
  561   1HD2  ASN1178          1HD2      ASN1178 -27.451   2.689  -0.340
  562   2HD2  ASN1178          2HD2      ASN1178 -28.314   1.884  -1.599
  563    H    ILE1179           HN       ILE1179 -24.947   4.423   0.189
  564    HA   ILE1179           HA       ILE1179 -25.324   2.679   2.536
  565    HB   ILE1179           HB       ILE1179 -23.478   1.253   1.596
  566   1HG1  ILE1179          2HG1      ILE1179 -24.122   2.782  -0.937
  567   2HG1  ILE1179          1HG1      ILE1179 -22.620   2.908  -0.027
  568   1HG2  ILE1179          2HG2      ILE1179 -26.047   1.434   0.027
  569   2HG2  ILE1179          1HG2      ILE1179 -24.969   0.038   0.071
  570   3HG2  ILE1179          3HG2      ILE1179 -25.803   0.554   1.537
  571   1HD1  ILE1179          2HD1      ILE1179 -23.642   0.426  -1.378
  572   2HD1  ILE1179          1HD1      ILE1179 -22.375   1.489  -1.988
  573   3HD1  ILE1179          3HD1      ILE1179 -22.123   0.580  -0.496
  574    H    ALA1180           HN       ALA1180 -24.004   2.984   4.193
  575    HA   ALA1180           HA       ALA1180 -21.662   4.737   3.818
  576   1HB   ALA1180           HB1      ALA1180 -22.000   5.495   6.125
  577   2HB   ALA1180           HB3      ALA1180 -23.419   5.817   5.127
  578   3HB   ALA1180           HB2      ALA1180 -23.423   4.462   6.257
  579    H    LEU1181           HN       LEU1181 -19.895   4.366   5.410
  580    HA   LEU1181           HA       LEU1181 -19.022   1.716   5.394
  581   1HB   LEU1181           HB2      LEU1181 -18.031   4.231   6.256
  582   2HB   LEU1181           HB1      LEU1181 -17.827   3.112   7.589
  583    HG   LEU1181           HG       LEU1181 -15.846   3.297   6.080
  584   1HD1  LEU1181          1HD1      LEU1181 -17.186   0.614   6.327
  585   2HD1  LEU1181          3HD1      LEU1181 -15.499   0.846   5.870
  586   3HD1  LEU1181          2HD1      LEU1181 -16.059   1.356   7.462
  587   1HD2  LEU1181          3HD2      LEU1181 -17.032   3.561   3.966
  588   2HD2  LEU1181          2HD2      LEU1181 -15.921   2.193   3.906
  589   3HD2  LEU1181          1HD2      LEU1181 -17.652   1.917   4.101
  590    H    ARG1182           HN       ARG1182 -18.394   0.484   7.462
  591    HA   ARG1182           HA       ARG1182 -20.757  -0.228   8.824
  592   1HB   ARG1182           HB2      ARG1182 -19.379  -1.719  10.132
  593   2HB   ARG1182           HB1      ARG1182 -18.830  -1.757   8.463
  594   1HG   ARG1182           HG2      ARG1182 -16.969  -0.305   9.011
  595   2HG   ARG1182           HG1      ARG1182 -17.535  -0.183  10.678
  596   1HD   ARG1182           HD2      ARG1182 -15.757  -1.789  10.594
  597   2HD   ARG1182           HD1      ARG1182 -17.271  -2.643  10.891
  598    HE   ARG1182           HE       ARG1182 -16.704  -2.563   8.119
  599   1HH1  ARG1182          1HH1      ARG1182 -15.728  -4.123  11.078
  600   2HH1  ARG1182          2HH1      ARG1182 -15.174  -5.561  10.290
  601   1HH2  ARG1182          1HH2      ARG1182 -15.975  -4.454   7.071
  602   2HH2  ARG1182          2HH2      ARG1182 -15.314  -5.749   8.012
  603    H    TRP1183           HN       TRP1183 -18.785   2.405   9.223
  604    HA   TRP1183           HA       TRP1183 -19.334   2.688  12.089
  605   1HB   TRP1183           HB2      TRP1183 -17.701   4.618  10.461
  606   2HB   TRP1183           HB1      TRP1183 -17.583   4.244  12.179
  607    HD1  TRP1183           HD1      TRP1183 -16.834   2.571   8.767
  608    HE1  TRP1183           HE1      TRP1183 -14.869   0.942   9.086
  609    HE3  TRP1183           HE3      TRP1183 -16.184   3.054  13.818
  610    HZ2  TRP1183           HZ2      TRP1183 -13.250   0.005  11.180
  611    HZ3  TRP1183           HZ3      TRP1183 -14.396   1.754  14.901
  612    HH2  TRP1183           HH2      TRP1183 -12.960   0.261  13.609
  613    H    THR1184           HN       THR1184 -20.445   3.617   9.048
  614    HA   THR1184           HA       THR1184 -21.942   5.125   8.266
  615    HB   THR1184           HB       THR1184 -23.895   5.563   9.660
  616    HG1  THR1184           HG1      THR1184 -23.468   4.239  11.853
  617   1HG2  THR1184          2HG2      THR1184 -23.688   3.382   8.574
  618   2HG2  THR1184          1HG2      THR1184 -22.849   2.751   9.992
  619   3HG2  THR1184          3HG2      THR1184 -24.537   3.247  10.115
  620    H    ALA1185           HN       ALA1185 -20.473   6.804   7.912
  621    HA   ALA1185           HA       ALA1185 -20.951   9.126   9.613
  622   1HB   ALA1185           HB1      ALA1185 -18.170   8.223   8.875
  623   2HB   ALA1185           HB2      ALA1185 -18.892   8.124  10.481
  624   3HB   ALA1185           HB3      ALA1185 -18.590   9.698   9.746
  625    H    LYS1186           HN       LYS1186 -18.872   8.197   6.861
  626    HA   LYS1186           HA       LYS1186 -20.169   9.386   4.796
  627   1HB   LYS1186           HB2      LYS1186 -19.010  11.595   4.555
  628   2HB   LYS1186           HB1      LYS1186 -20.164  11.528   5.879
  629   1HG   LYS1186           HG2      LYS1186 -18.326  11.208   7.462
  630   2HG   LYS1186           HG1      LYS1186 -17.172  11.287   6.129
  631   1HD   LYS1186           HD2      LYS1186 -17.909  13.566   5.626
  632   2HD   LYS1186           HD1      LYS1186 -19.065  13.487   6.956
  633   1HE   LYS1186           HE2      LYS1186 -16.068  13.275   7.205
  634   2HE   LYS1186           HE1      LYS1186 -17.040  14.691   7.605
  635   1HZ   LYS1186           HZ1      LYS1186 -18.161  13.396   9.308
  636   2HZ   LYS1186           HZ3      LYS1186 -17.228  12.037   8.925
  637   3HZ   LYS1186           HZ2      LYS1186 -16.492  13.414   9.576
  638    H    GLN1187           HN       GLN1187 -19.217   8.166   3.328
  639    HA   GLN1187           HA       GLN1187 -17.640   7.386   1.881
  640   1HB   GLN1187           HB2      GLN1187 -16.795   9.708   1.841
  641   2HB   GLN1187           HB1      GLN1187 -15.793   9.360   3.242
  642   1HG   GLN1187           HG2      GLN1187 -14.560   7.698   1.934
  643   2HG   GLN1187           HG1      GLN1187 -15.549   8.088   0.528
  644   1HE2  GLN1187          1HE2      GLN1187 -13.788   8.749  -0.682
  645   2HE2  GLN1187          2HE2      GLN1187 -12.953  10.230  -0.371
  646    H    LYS1188           HN       LYS1188 -15.205   8.075   4.300
  647    HA   LYS1188           HA       LYS1188 -13.745   6.687   5.381
  648   1HB   LYS1188           HB2      LYS1188 -15.857   6.710   6.777
  649   2HB   LYS1188           HB1      LYS1188 -16.249   5.151   6.067
  650   1HG   LYS1188           HG2      LYS1188 -15.273   4.590   8.090
  651   2HG   LYS1188           HG1      LYS1188 -13.947   4.409   6.941
  652   1HD   LYS1188           HD2      LYS1188 -14.363   6.994   8.398
  653   2HD   LYS1188           HD1      LYS1188 -13.518   5.651   9.171
  654   1HE   LYS1188           HE2      LYS1188 -12.758   6.952   6.558
  655   2HE   LYS1188           HE1      LYS1188 -11.954   7.199   8.108
  656   1HZ   LYS1188           HZ1      LYS1188 -12.133   4.620   6.646
  657   2HZ   LYS1188           HZ3      LYS1188 -10.763   5.609   6.739
  658   3HZ   LYS1188           HZ2      LYS1188 -11.360   4.858   8.131
  659    H    LEU1189           HN       LEU1189 -14.446   5.906   2.565
  660    HA   LEU1189           HA       LEU1189 -14.249   3.002   2.612
  661   1HB   LEU1189           HB2      LEU1189 -13.941   3.743  -0.005
  662   2HB   LEU1189           HB1      LEU1189 -15.449   3.295   0.769
  663    HG   LEU1189           HG       LEU1189 -14.958   6.071   1.248
  664   1HD1  LEU1189          1HD1      LEU1189 -13.544   5.946  -0.761
  665   2HD1  LEU1189          3HD1      LEU1189 -14.910   5.290  -1.662
  666   3HD1  LEU1189          2HD1      LEU1189 -14.987   6.927  -1.012
  667   1HD2  LEU1189          3HD2      LEU1189 -17.115   4.863   1.269
  668   2HD2  LEU1189          2HD2      LEU1189 -17.132   6.306   0.253
  669   3HD2  LEU1189          1HD2      LEU1189 -17.009   4.708  -0.484
  670    H    TYR1190           HN       TYR1190 -12.058   4.995   3.450
  671    HA   TYR1190           HA       TYR1190  -9.955   4.122   1.604
  672   1HB   TYR1190           HB2      TYR1190 -10.101   6.354   3.617
  673   2HB   TYR1190           HB1      TYR1190  -8.571   5.836   2.918
  674    HD1  TYR1190           HD1      TYR1190 -11.664   5.780   0.933
  675    HD2  TYR1190           HD2      TYR1190  -8.160   7.999   1.904
  676    HE1  TYR1190           HE1      TYR1190 -12.054   7.240  -1.008
  677    HE2  TYR1190           HE2      TYR1190  -8.544   9.461  -0.034
  678    HH   TYR1190           HH       TYR1190 -11.465   9.504  -1.758
  679    H    SER1191           HN       SER1191  -9.708   2.023   2.317
  680    HA   SER1191           HA       SER1191  -8.719   1.656   5.064
  681   1HB   SER1191           HB2      SER1191  -9.832  -0.339   3.073
  682   2HB   SER1191           HB1      SER1191  -9.149  -0.782   4.636
  683    HG   SER1191           HG       SER1191 -10.830   0.134   5.654
  684    H    ARG1192           HN       ARG1192  -7.363  -0.680   4.794
  685    HA   ARG1192           HA       ARG1192  -5.191  -0.067   2.905
  686   1HB   ARG1192           HB2      ARG1192  -4.548   0.460   5.243
  687   2HB   ARG1192           HB1      ARG1192  -4.908  -1.197   5.701
  688   1HG   ARG1192           HG2      ARG1192  -3.147  -1.997   4.210
  689   2HG   ARG1192           HG1      ARG1192  -2.784  -0.333   3.748
  690   1HD   ARG1192           HD2      ARG1192  -1.215  -1.122   5.432
  691   2HD   ARG1192           HD1      ARG1192  -2.210   0.187   6.067
  692    HE   ARG1192           HE       ARG1192  -3.461  -2.195   6.749
  693   1HH1  ARG1192          1HH1      ARG1192  -0.456  -0.563   7.414
  694   2HH1  ARG1192          2HH1      ARG1192  -0.274  -1.265   8.987
  695   1HH2  ARG1192          1HH2      ARG1192  -3.230  -3.123   8.820
  696   2HH2  ARG1192          2HH2      ARG1192  -1.850  -2.720   9.786
  697    H    THR1193           HN       THR1193  -4.968  -1.645   1.452
  698    HA   THR1193           HA       THR1193  -6.424  -3.901   1.219
  699    HB   THR1193           HB       THR1193  -3.591  -3.406   0.327
  700    HG1  THR1193           HG1      THR1193  -5.601  -3.863  -1.497
  701   1HG2  THR1193          3HG2      THR1193  -5.297  -5.816  -0.313
  702   2HG2  THR1193          2HG2      THR1193  -3.773  -5.404  -1.100
  703   3HG2  THR1193          1HG2      THR1193  -3.795  -5.821   0.613
  704    H    GLY1194           HN       GLY1194  -6.594  -5.818   2.148
  705   1HA   GLY1194           HA1      GLY1194  -4.513  -6.592   4.093
  706   2HA   GLY1194           HA2      GLY1194  -5.412  -7.759   3.128
  707    H    GLU1195           HN       GLU1195  -6.901  -4.922   4.465
  708    HA   GLU1195           HA       GLU1195  -8.090  -6.464   6.652
  709   1HB   GLU1195           HB2      GLU1195  -8.268  -3.503   6.054
  710   2HB   GLU1195           HB1      GLU1195  -8.869  -4.303   7.499
  711   1HG   GLU1195           HG2      GLU1195  -5.985  -4.130   6.655
  712   2HG   GLU1195           HG1      GLU1195  -6.758  -3.158   7.906
  713    H    SER1196           HN       SER1196 -10.348  -6.590   6.939
  714    HA   SER1196           HA       SER1196 -11.813  -6.699   4.454
  715   1HB   SER1196           HB2      SER1196 -12.733  -7.313   7.272
  716   2HB   SER1196           HB1      SER1196 -13.598  -7.714   5.788
  717    HG   SER1196           HG       SER1196 -12.460  -9.464   5.745
  718    H    VAL1197           HN       VAL1197 -13.229  -5.255   3.708
  719    HA   VAL1197           HA       VAL1197 -13.842  -2.929   5.400
  720    HB   VAL1197           HB       VAL1197 -14.157  -3.146   2.403
  721   1HG1  VAL1197          2HG1      VAL1197 -14.083  -0.766   4.256
  722   2HG1  VAL1197          1HG1      VAL1197 -14.200  -0.696   2.498
  723   3HG1  VAL1197          3HG1      VAL1197 -15.509  -1.407   3.440
  724   1HG2  VAL1197          1HG2      VAL1197 -11.814  -3.463   2.995
  725   2HG2  VAL1197          3HG2      VAL1197 -12.059  -1.890   2.234
  726   3HG2  VAL1197          2HG2      VAL1197 -11.854  -2.003   3.982
  727    H    GLU1198           HN       GLU1198 -16.013  -1.991   5.219
  728    HA   GLU1198           HA       GLU1198 -18.107  -3.770   4.266
  729   1HB   GLU1198           HB2      GLU1198 -18.074  -4.686   6.384
  730   2HB   GLU1198           HB1      GLU1198 -17.561  -3.185   7.141
  731   1HG   GLU1198           HG2      GLU1198 -19.704  -2.314   7.172
  732   2HG   GLU1198           HG1      GLU1198 -20.287  -3.436   5.940
  733    H    PHE1199           HN       PHE1199 -19.850  -2.694   3.521
  734    HA   PHE1199           HA       PHE1199 -20.057   0.177   4.167
  735   1HB   PHE1199           HB2      PHE1199 -20.780  -1.094   1.521
  736   2HB   PHE1199           HB1      PHE1199 -20.808   0.621   1.911
  737    HD1  PHE1199           HD1      PHE1199 -18.892   1.953   1.684
  738    HD2  PHE1199           HD2      PHE1199 -18.592  -2.282   1.426
  739    HE1  PHE1199           HE1      PHE1199 -16.583   2.175   0.857
  740    HE2  PHE1199           HE2      PHE1199 -16.291  -2.077   0.607
  741    HZ   PHE1199           HZ       PHE1199 -15.275   0.154   0.322
  742    H    VAL1200           HN       VAL1200 -21.612  -0.299   5.811
  743    HA   VAL1200           HA       VAL1200 -23.949  -1.811   5.382
  744    HB   VAL1200           HB       VAL1200 -24.863  -0.745   7.346
  745   1HG1  VAL1200          2HG1      VAL1200 -21.892  -1.176   7.611
  746   2HG1  VAL1200          1HG1      VAL1200 -23.031  -1.107   8.955
  747   3HG1  VAL1200          3HG1      VAL1200 -23.152  -2.400   7.762
  748   1HG2  VAL1200          1HG2      VAL1200 -22.627   1.258   7.082
  749   2HG2  VAL1200          3HG2      VAL1200 -24.341   1.568   6.811
  750   3HG2  VAL1200          2HG2      VAL1200 -23.764   1.160   8.427
  751    H    CYS1201           HN       CYS1201 -26.158  -0.372   5.851
  752    HA   CYS1201           HA       CYS1201 -26.248   1.517   3.592
  753   1HB   CYS1201           HB2      CYS1201 -28.802   0.363   4.494
  754   2HB   CYS1201           HB1      CYS1201 -28.188   0.610   2.861
  755    H    LYS1202           HN       LYS1202 -27.128   3.514   3.923
  756    HA   LYS1202           HA       LYS1202 -27.085   4.686   6.394
  757   1HB   LYS1202           HB2      LYS1202 -29.064   5.568   4.316
  758   2HB   LYS1202           HB1      LYS1202 -28.202   6.552   5.487
  759   1HG   LYS1202           HG2      LYS1202 -26.150   6.284   4.313
  760   2HG   LYS1202           HG1      LYS1202 -26.868   5.074   3.244
  761   1HD   LYS1202           HD2      LYS1202 -26.883   7.015   1.958
  762   2HD   LYS1202           HD1      LYS1202 -28.523   6.906   2.602
  763   1HE   LYS1202           HE2      LYS1202 -26.326   8.568   3.825
  764   2HE   LYS1202           HE1      LYS1202 -27.532   9.194   2.704
  765   1HZ   LYS1202           HZ1      LYS1202 -29.257   8.484   4.294
  766   2HZ   LYS1202           HZ3      LYS1202 -28.046   8.032   5.386
  767   3HZ   LYS1202           HZ2      LYS1202 -28.215   9.653   4.935
  768    H    ARG1203           HN       ARG1203 -28.030   3.860   8.064
  769    HA   ARG1203           HA       ARG1203 -29.676   2.490   9.129
  770   1HB   ARG1203           HB2      ARG1203 -30.383   5.406   9.112
  771   2HB   ARG1203           HB1      ARG1203 -30.974   4.246  10.293
  772   1HG   ARG1203           HG2      ARG1203 -28.712   3.839  11.065
  773   2HG   ARG1203           HG1      ARG1203 -28.080   4.933   9.830
  774   1HD   ARG1203           HD2      ARG1203 -29.314   6.787  10.852
  775   2HD   ARG1203           HD1      ARG1203 -29.933   5.693  12.088
  776    HE   ARG1203           HE       ARG1203 -27.179   5.495  12.181
  777   1HH1  ARG1203          1HH1      ARG1203 -29.579   7.981  12.627
  778   2HH1  ARG1203          2HH1      ARG1203 -28.629   8.875  13.766
  779   1HH2  ARG1203          1HH2      ARG1203 -25.921   6.663  13.681
  780   2HH2  ARG1203          2HH2      ARG1203 -26.548   8.126  14.365
  781    H    GLY1204           HN       GLY1204 -30.890   1.164   7.750
  782   1HA   GLY1204           HA1      GLY1204 -33.385   2.400   6.763
  783   2HA   GLY1204           HA2      GLY1204 -33.365   0.844   7.573
  784    H    TYR1205           HN       TYR1205 -31.712   2.412   4.814
  785    HA   TYR1205           HA       TYR1205 -32.728   1.071   2.728
  786   1HB   TYR1205           HB2      TYR1205 -29.818   1.703   3.162
  787   2HB   TYR1205           HB1      TYR1205 -30.486   1.214   1.616
  788    HD1  TYR1205           HD1      TYR1205 -32.383   2.718   0.658
  789    HD2  TYR1205           HD2      TYR1205 -29.716   3.953   3.730
  790    HE1  TYR1205           HE1      TYR1205 -32.868   5.066   0.123
  791    HE2  TYR1205           HE2      TYR1205 -30.198   6.308   3.206
  792    HH   TYR1205           HH       TYR1205 -31.012   7.644   1.308
  793    H    ARG1206           HN       ARG1206 -32.844  -0.921   1.924
  794    HA   ARG1206           HA       ARG1206 -31.227  -3.016   3.221
  795   1HB   ARG1206           HB2      ARG1206 -33.046  -4.561   2.806
  796   2HB   ARG1206           HB1      ARG1206 -33.652  -3.161   3.681
  797   1HG   ARG1206           HG2      ARG1206 -35.282  -3.222   2.149
  798   2HG   ARG1206           HG1      ARG1206 -34.105  -2.380   1.140
  799   1HD   ARG1206           HD2      ARG1206 -35.108  -4.247  -0.062
  800   2HD   ARG1206           HD1      ARG1206 -33.383  -4.509   0.191
  801    HE   ARG1206           HE       ARG1206 -34.721  -5.728   2.299
  802   1HH1  ARG1206          1HH1      ARG1206 -34.477  -6.052  -1.162
  803   2HH1  ARG1206          2HH1      ARG1206 -34.787  -7.756  -1.152
  804   1HH2  ARG1206          1HH2      ARG1206 -35.131  -7.971   2.319
  805   2HH2  ARG1206          2HH2      ARG1206 -35.159  -8.846   0.826
  806    H    LEU1207           HN       LEU1207 -30.094  -4.411   1.990
  807    HA   LEU1207           HA       LEU1207 -29.008  -3.874  -0.383
  808   1HB   LEU1207           HB2      LEU1207 -29.868  -6.591   0.592
  809   2HB   LEU1207           HB1      LEU1207 -28.829  -6.352  -0.800
  810    HG   LEU1207           HG       LEU1207 -28.178  -5.486   2.020
  811   1HD1  LEU1207          3HD1      LEU1207 -28.205  -7.923   1.757
  812   2HD1  LEU1207          2HD1      LEU1207 -27.101  -7.781   0.388
  813   3HD1  LEU1207          1HD1      LEU1207 -26.571  -7.309   2.002
  814   1HD2  LEU1207          1HD2      LEU1207 -27.156  -4.059   0.321
  815   2HD2  LEU1207          3HD2      LEU1207 -25.945  -5.055   1.132
  816   3HD2  LEU1207          2HD2      LEU1207 -26.501  -5.484  -0.487
  817    H    SER1208           HN       SER1208 -29.501  -3.795  -2.485
  818    HA   SER1208           HA       SER1208 -32.278  -4.119  -3.244
  819   1HB   SER1208           HB2      SER1208 -31.616  -3.073  -5.349
  820   2HB   SER1208           HB1      SER1208 -30.986  -2.146  -3.990
  821    HG   SER1208           HG       SER1208 -29.647  -3.472  -5.966
  822    H    SER1209           HN       SER1209 -30.285  -6.397  -2.706
  823    HA   SER1209           HA       SER1209 -30.130  -8.564  -3.382
  824   1HB   SER1209           HB2      SER1209 -32.465  -8.436  -4.100
  825   2HB   SER1209           HB1      SER1209 -31.968  -7.730  -5.637
  826    HG   SER1209           HG       SER1209 -32.305  -9.956  -5.860
  827    H    ARG1210           HN       ARG1210 -30.234  -6.640  -6.395
  828    HA   ARG1210           HA       ARG1210 -28.278  -8.087  -7.750
  829   1HB   ARG1210           HB2      ARG1210 -28.977  -5.161  -8.048
  830   2HB   ARG1210           HB1      ARG1210 -28.087  -6.122  -9.221
  831   1HG   ARG1210           HG2      ARG1210 -30.049  -7.565  -9.513
  832   2HG   ARG1210           HG1      ARG1210 -30.941  -6.559  -8.367
  833   1HD   ARG1210           HD2      ARG1210 -31.481  -5.952 -10.664
  834   2HD   ARG1210           HD1      ARG1210 -30.661  -4.629  -9.835
  835    HE   ARG1210           HE       ARG1210 -28.713  -6.107 -11.154
  836   1HH1  ARG1210          1HH1      ARG1210 -31.495  -4.168 -11.959
  837   2HH1  ARG1210          2HH1      ARG1210 -30.862  -3.668 -13.491
  838   1HH2  ARG1210          1HH2      ARG1210 -27.873  -5.454 -13.170
  839   2HH2  ARG1210          2HH2      ARG1210 -28.804  -4.399 -14.180
  840    H    SER1211           HN       SER1211 -27.946  -5.992  -5.107
  841    HA   SER1211           HA       SER1211 -25.446  -4.827  -5.545
  842   1HB   SER1211           HB2      SER1211 -25.317  -4.587  -3.110
  843   2HB   SER1211           HB1      SER1211 -26.942  -4.205  -3.680
  844    HG   SER1211           HG       SER1211 -26.663  -6.841  -3.085
  845    H    HIS1212           HN       HIS1212 -23.383  -5.402  -4.494
  846    HA   HIS1212           HA       HIS1212 -22.739  -8.162  -5.039
  847   1HB   HIS1212           HB2      HIS1212 -20.972  -5.924  -4.024
  848   2HB   HIS1212           HB1      HIS1212 -20.420  -7.488  -4.615
  849    HD1  HIS1212           HD1      HIS1212 -20.821  -7.943  -7.217
  850    HD2  HIS1212           HD2      HIS1212 -21.343  -4.020  -5.953
  851    HE1  HIS1212           HE1      HIS1212 -20.767  -6.551  -9.310
  852    HE2  HIS1212           HE2      HIS1212 -21.003  -4.172  -8.513
  853    H    THR1213           HN       THR1213 -21.628  -6.205  -2.293
  854    HA   THR1213           HA       THR1213 -22.881  -7.830  -0.324
  855    HB   THR1213           HB       THR1213 -21.347  -9.532  -0.679
  856    HG1  THR1213           HG1      THR1213 -19.819  -8.040   1.166
  857   1HG2  THR1213          1HG2      THR1213 -19.920  -8.370  -2.289
  858   2HG2  THR1213          3HG2      THR1213 -19.180  -7.451  -0.979
  859   3HG2  THR1213          2HG2      THR1213 -18.947  -9.197  -1.072
  860    H    LEU1214           HN       LEU1214 -22.078  -7.331   1.883
  861    HA   LEU1214           HA       LEU1214 -21.570  -4.477   2.081
  862   1HB   LEU1214           HB2      LEU1214 -22.273  -6.569   4.138
  863   2HB   LEU1214           HB1      LEU1214 -21.955  -4.893   4.538
  864    HG   LEU1214           HG       LEU1214 -24.318  -5.170   4.465
  865   1HD1  LEU1214          3HD1      LEU1214 -23.294  -3.832   1.968
  866   2HD1  LEU1214          2HD1      LEU1214 -24.946  -3.679   2.571
  867   3HD1  LEU1214          1HD1      LEU1214 -23.594  -3.087   3.538
  868   1HD2  LEU1214          3HD2      LEU1214 -24.404  -7.240   3.185
  869   2HD2  LEU1214          2HD2      LEU1214 -25.494  -6.031   2.504
  870   3HD2  LEU1214          1HD2      LEU1214 -23.950  -6.365   1.722
  871    H    ARG1215           HN       ARG1215 -20.301  -7.358   3.741
  872    HA   ARG1215           HA       ARG1215 -17.781  -5.925   4.169
  873   1HB   ARG1215           HB2      ARG1215 -19.020  -7.032   6.086
  874   2HB   ARG1215           HB1      ARG1215 -18.583  -8.575   5.363
  875   1HG   ARG1215           HG2      ARG1215 -16.209  -7.983   5.574
  876   2HG   ARG1215           HG1      ARG1215 -16.675  -6.463   6.342
  877   1HD   ARG1215           HD2      ARG1215 -16.043  -8.132   8.004
  878   2HD   ARG1215           HD1      ARG1215 -17.745  -7.693   8.152
  879    HE   ARG1215           HE       ARG1215 -17.564  -9.943   6.505
  880   1HH1  ARG1215          1HH1      ARG1215 -17.013  -9.045   9.827
  881   2HH1  ARG1215          2HH1      ARG1215 -17.359 -10.626  10.445
  882   1HH2  ARG1215          1HH2      ARG1215 -18.020 -12.026   7.311
  883   2HH2  ARG1215          2HH2      ARG1215 -17.930 -12.320   9.016
  884    H    THR1216           HN       THR1216 -16.245  -6.232   2.731
  885    HA   THR1216           HA       THR1216 -15.821  -8.930   1.642
  886    HB   THR1216           HB       THR1216 -16.967  -7.523  -0.054
  887    HG1  THR1216           HG1      THR1216 -15.463  -8.006  -1.712
  888   1HG2  THR1216          2HG2      THR1216 -14.467  -5.840   0.116
  889   2HG2  THR1216          1HG2      THR1216 -15.726  -5.680  -1.109
  890   3HG2  THR1216          3HG2      THR1216 -16.094  -5.342   0.583
  891    H    THR1217           HN       THR1217 -13.625  -8.289   0.054
  892    HA   THR1217           HA       THR1217 -11.664  -7.379   2.055
  893    HB   THR1217           HB       THR1217 -11.378  -9.597   0.022
  894    HG1  THR1217           HG1      THR1217 -11.708 -10.820   1.710
  895   1HG2  THR1217          2HG2      THR1217  -9.346  -8.149   0.132
  896   2HG2  THR1217          1HG2      THR1217  -9.244  -8.497   1.858
  897   3HG2  THR1217          3HG2      THR1217  -9.065  -9.801   0.682
  898    H    CYS1218           HN       CYS1218 -10.272  -5.841   1.445
  899    HA   CYS1218           HA       CYS1218 -10.556  -4.770  -1.242
  900   1HB   CYS1218           HB2      CYS1218 -10.451  -3.497   1.100
  901   2HB   CYS1218           HB1      CYS1218  -8.728  -3.514   0.736
  902    H    TRP1219           HN       TRP1219  -9.006  -4.835  -2.776
  903    HA   TRP1219           HA       TRP1219  -6.288  -5.558  -2.111
  904   1HB   TRP1219           HB2      TRP1219  -8.000  -7.637  -2.565
  905   2HB   TRP1219           HB1      TRP1219  -7.376  -7.342  -4.185
  906    HD1  TRP1219           HD1      TRP1219  -4.657  -7.553  -4.480
  907    HE1  TRP1219           HE1      TRP1219  -2.987  -9.049  -3.221
  908    HE3  TRP1219           HE3      TRP1219  -7.489  -8.700  -0.380
  909    HZ2  TRP1219           HZ2      TRP1219  -2.868 -10.514  -0.833
  910    HZ3  TRP1219           HZ3      TRP1219  -6.520 -10.159   1.349
  911    HH2  TRP1219           HH2      TRP1219  -4.255 -11.048   1.127
  912    H    ASP1220           HN       ASP1220  -4.885  -4.678  -3.500
  913    HA   ASP1220           HA       ASP1220  -4.048  -3.496  -5.248
  914   1HB   ASP1220           HB2      ASP1220  -4.744  -5.575  -6.464
  915   2HB   ASP1220           HB1      ASP1220  -6.260  -4.772  -6.868
  916    H    GLY1221           HN       GLY1221  -6.585  -2.625  -3.684
  917   1HA   GLY1221           HA1      GLY1221  -6.864  -0.119  -5.108
  918   2HA   GLY1221           HA2      GLY1221  -7.528  -0.504  -3.527
  919    H    LYS1222           HN       LYS1222  -8.895  -2.908  -4.374
  920    HA   LYS1222           HA       LYS1222 -11.228  -1.625  -5.532
  921   1HB   LYS1222           HB2      LYS1222  -9.553  -2.943  -7.244
  922   2HB   LYS1222           HB1      LYS1222 -10.681  -4.214  -6.797
  923   1HG   LYS1222           HG2      LYS1222 -11.477  -1.526  -7.890
  924   2HG   LYS1222           HG1      LYS1222 -11.339  -3.007  -8.841
  925   1HD   LYS1222           HD2      LYS1222 -13.059  -4.059  -7.456
  926   2HD   LYS1222           HD1      LYS1222 -13.197  -2.580  -6.502
  927   1HE   LYS1222           HE2      LYS1222 -13.774  -2.845  -9.451
  928   2HE   LYS1222           HE1      LYS1222 -14.979  -2.738  -8.168
  929   1HZ   LYS1222           HZ2      LYS1222 -14.145  -0.533  -7.625
  930   2HZ   LYS1222           HZ1      LYS1222 -12.996  -0.637  -8.862
  931   3HZ   LYS1222           HZ3      LYS1222 -14.646  -0.604  -9.238
  932    H    LEU1223           HN       LEU1223 -13.082  -2.419  -4.754
  933    HA   LEU1223           HA       LEU1223 -13.255  -5.082  -3.647
  934   1HB   LEU1223           HB2      LEU1223 -13.990  -4.354  -1.447
  935   2HB   LEU1223           HB1      LEU1223 -12.329  -3.905  -1.774
  936    HG   LEU1223           HG       LEU1223 -14.667  -2.011  -1.990
  937   1HD1  LEU1223          3HD1      LEU1223 -14.306  -2.834   0.289
  938   2HD1  LEU1223          2HD1      LEU1223 -12.622  -2.325   0.189
  939   3HD1  LEU1223          1HD1      LEU1223 -13.912  -1.121   0.128
  940   1HD2  LEU1223          1HD2      LEU1223 -11.689  -1.636  -2.126
  941   2HD2  LEU1223          3HD2      LEU1223 -12.878  -1.278  -3.376
  942   3HD2  LEU1223          2HD2      LEU1223 -12.833  -0.314  -1.899
  943    H    GLU1224           HN       GLU1224 -15.433  -5.706  -3.098
  944    HA   GLU1224           HA       GLU1224 -17.349  -4.651  -4.918
  945   1HB   GLU1224           HB2      GLU1224 -17.785  -6.566  -2.618
  946   2HB   GLU1224           HB1      GLU1224 -18.872  -6.306  -3.976
  947   1HG   GLU1224           HG2      GLU1224 -17.146  -7.160  -5.499
  948   2HG   GLU1224           HG1      GLU1224 -16.098  -7.462  -4.113
  949    H    TYR1225           HN       TYR1225 -19.326  -3.618  -4.479
  950    HA   TYR1225           HA       TYR1225 -19.653  -2.506  -1.796
  951   1HB   TYR1225           HB2      TYR1225 -20.375  -0.318  -3.031
  952   2HB   TYR1225           HB1      TYR1225 -18.676  -0.627  -2.692
  953    HD1  TYR1225           HD1      TYR1225 -20.943   0.412  -5.114
  954    HD2  TYR1225           HD2      TYR1225 -17.404  -1.904  -4.666
  955    HE1  TYR1225           HE1      TYR1225 -20.414   0.777  -7.485
  956    HE2  TYR1225           HE2      TYR1225 -16.870  -1.560  -7.042
  957    HH   TYR1225           HH       TYR1225 -18.043  -1.009  -9.134
  958    HA   PRO1226           HA       PRO1226 -23.832  -3.755  -2.489
  959   1HB   PRO1226           HB2      PRO1226 -24.969  -2.539  -0.364
  960   2HB   PRO1226           HB1      PRO1226 -23.929  -3.959  -0.201
  961   1HG   PRO1226           HG2      PRO1226 -23.251  -1.064   0.181
  962   2HG   PRO1226           HG1      PRO1226 -22.821  -2.453   1.195
  963   1HD   PRO1226           HD2      PRO1226 -21.108  -1.352  -0.589
  964   2HD   PRO1226           HD1      PRO1226 -21.094  -3.083  -0.193
  965    H    THR1227           HN       THR1227 -26.091  -2.473  -1.974
  966    HA   THR1227           HA       THR1227 -26.214   0.239  -2.848
  967    HB   THR1227           HB       THR1227 -27.252  -1.798  -4.836
  968    HG1  THR1227           HG1      THR1227 -25.465  -1.391  -6.056
  969   1HG2  THR1227          2HG2      THR1227 -26.958   1.205  -4.976
  970   2HG2  THR1227          1HG2      THR1227 -27.515   0.169  -6.290
  971   3HG2  THR1227          3HG2      THR1227 -28.471   0.313  -4.815
  972    H    CYS1228           HN       CYS1228 -27.220  -0.760  -0.630
  973    HA   CYS1228           HA       CYS1228 -29.703  -1.996  -0.609
  974   1HB   CYS1228           HB2      CYS1228 -28.851   0.157   1.326
  975   2HB   CYS1228           HB1      CYS1228 -29.930  -1.201   1.634
  976    H    ALA1229           HN       ALA1229 -31.770  -0.824   0.247
  977    HA   ALA1229           HA       ALA1229 -32.258   1.843  -0.570
  978   1HB   ALA1229           HB1      ALA1229 -33.245  -0.317  -2.402
  979   2HB   ALA1229           HB3      ALA1229 -33.763   1.367  -2.449
  980   3HB   ALA1229           HB2      ALA1229 -32.082   0.952  -2.789
  981    H    LYS1230           HN       LYS1230 -33.173   1.804   1.519
  982    HA   LYS1230           HA       LYS1230 -35.908   1.707   1.659
  983   1HB   LYS1230           HB2      LYS1230 -35.192  -0.835   1.488
  984   2HB   LYS1230           HB1      LYS1230 -34.978  -0.644   3.222
  985   1HG   LYS1230           HG2      LYS1230 -37.293   0.121   3.421
  986   2HG   LYS1230           HG1      LYS1230 -37.506  -0.103   1.684
  987   1HD   LYS1230           HD2      LYS1230 -38.415  -2.013   2.835
  988   2HD   LYS1230           HD1      LYS1230 -36.954  -2.505   1.973
  989   1HE   LYS1230           HE2      LYS1230 -37.015  -3.479   4.204
  990   2HE   LYS1230           HE1      LYS1230 -35.674  -2.345   4.048
  991   1HZ   LYS1230           HZ3      LYS1230 -36.997  -0.676   5.188
  992   2HZ   LYS1230           HZ2      LYS1230 -38.283  -1.765   5.340
  993   3HZ   LYS1230           HZ1      LYS1230 -36.826  -2.060   6.147
  994    H    ARG1231           HN       ARG1231 -34.074   3.475   2.615
  995    HA   ARG1231           HA       ARG1231 -33.282   3.177   5.263
  996   1HB   ARG1231           HB2      ARG1231 -32.625   5.366   5.151
  997   2HB   ARG1231           HB1      ARG1231 -32.785   5.015   3.451
  998   1HG   ARG1231           HG2      ARG1231 -34.963   6.057   3.385
  999   2HG   ARG1231           HG1      ARG1231 -34.887   6.364   5.123
 1000   1HD   ARG1231           HD2      ARG1231 -33.021   7.492   3.038
 1001   2HD   ARG1231           HD1      ARG1231 -34.323   8.366   3.844
 1002    HE   ARG1231           HE       ARG1231 -32.648   7.341   5.818
 1003   1HH1  ARG1231          1HH1      ARG1231 -32.514   9.651   3.212
 1004   2HH1  ARG1231          2HH1      ARG1231 -31.324  10.646   3.983
 1005   1HH2  ARG1231          1HH2      ARG1231 -31.082   8.645   6.840
 1006   2HH2  ARG1231          2HH2      ARG1231 -30.509  10.073   6.045

  No H/Q in entry =        1006
  Start of MODEL   23
    1    H1   GLU1103           HT3      GLU1103  28.258  12.256 -10.072
    2    H2   GLU1103           HT2      GLU1103  29.385  13.442 -10.500
    3    H3   GLU1103           HT1      GLU1103  28.519  12.626 -11.702
    4    HA   GLU1103           HA       GLU1103  29.580  10.551 -11.110
    5   1HB   GLU1103           HB2      GLU1103  31.843  11.104 -11.923
    6   2HB   GLU1103           HB1      GLU1103  30.588  11.897 -12.866
    7   1HG   GLU1103           HG2      GLU1103  30.981  13.974 -11.642
    8   2HG   GLU1103           HG1      GLU1103  32.243  13.179 -10.702
    9    H    ALA1104           HN       ALA1104  30.987   9.373  -9.822
   10    HA   ALA1104           HA       ALA1104  32.441  10.646  -7.678
   11   1HB   ALA1104           HB3      ALA1104  30.179  10.549  -6.743
   12   2HB   ALA1104           HB2      ALA1104  30.143   8.808  -7.015
   13   3HB   ALA1104           HB1      ALA1104  31.289   9.498  -5.866
   14    H    GLU1105           HN       GLU1105  31.328   7.720  -9.268
   15    HA   GLU1105           HA       GLU1105  32.334   5.734  -9.712
   16   1HB   GLU1105           HB2      GLU1105  34.851   7.200  -8.902
   17   2HB   GLU1105           HB1      GLU1105  34.800   5.646  -9.721
   18   1HG   GLU1105           HG2      GLU1105  33.759   8.248 -10.821
   19   2HG   GLU1105           HG1      GLU1105  35.278   7.469 -11.264
   20    H    PHE1106           HN       PHE1106  31.700   6.759  -6.815
   21    HA   PHE1106           HA       PHE1106  33.260   4.821  -5.288
   22   1HB   PHE1106           HB2      PHE1106  31.272   6.931  -4.428
   23   2HB   PHE1106           HB1      PHE1106  32.068   5.821  -3.318
   24    HD1  PHE1106           HD1      PHE1106  32.206   9.001  -4.752
   25    HD2  PHE1106           HD2      PHE1106  34.701   5.782  -3.518
   26    HE1  PHE1106           HE1      PHE1106  34.109  10.550  -4.570
   27    HE2  PHE1106           HE2      PHE1106  36.609   7.325  -3.334
   28    HZ   PHE1106           HZ       PHE1106  36.314   9.713  -3.860
   29    H    GLY1107           HN       GLY1107  32.511   2.883  -4.713
   30   1HA   GLY1107           HA1      GLY1107  31.125   1.059  -4.627
   31   2HA   GLY1107           HA2      GLY1107  30.030   1.932  -5.685
   32    H    LYS1108           HN       LYS1108  30.617   3.870  -3.069
   33    HA   LYS1108           HA       LYS1108  29.136   2.795  -0.983
   34   1HB   LYS1108           HB2      LYS1108  29.217   5.715  -1.763
   35   2HB   LYS1108           HB1      LYS1108  28.861   5.062  -0.171
   36   1HG   LYS1108           HG2      LYS1108  31.144   4.167  -0.042
   37   2HG   LYS1108           HG1      LYS1108  31.495   4.884  -1.616
   38   1HD   LYS1108           HD2      LYS1108  31.019   7.107  -0.707
   39   2HD   LYS1108           HD1      LYS1108  30.672   6.388   0.866
   40   1HE   LYS1108           HE2      LYS1108  32.966   5.556   0.997
   41   2HE   LYS1108           HE1      LYS1108  33.315   6.259  -0.583
   42   1HZ   LYS1108           HZ3      LYS1108  32.537   7.775   1.851
   43   2HZ   LYS1108           HZ2      LYS1108  34.098   7.675   1.207
   44   3HZ   LYS1108           HZ1      LYS1108  32.872   8.450   0.336
   45    H    CYS1109           HN       CYS1109  26.997   2.843  -0.393
   46    HA   CYS1109           HA       CYS1109  25.120   2.968  -2.585
   47   1HB   CYS1109           HB2      CYS1109  24.469   2.413   0.304
   48   2HB   CYS1109           HB1      CYS1109  23.589   1.894  -1.130
   49    H    GLY1110           HN       GLY1110  23.623   4.498  -2.954
   50   1HA   GLY1110           HA1      GLY1110  23.071   6.806  -2.882
   51   2HA   GLY1110           HA2      GLY1110  23.694   6.876  -1.239
   52    HA   PRO1111           HA       PRO1111  19.452   6.933   0.071
   53   1HB   PRO1111           HB2      PRO1111  17.877   8.224  -1.816
   54   2HB   PRO1111           HB1      PRO1111  18.772   9.016  -0.518
   55   1HG   PRO1111           HG2      PRO1111  19.494   8.682  -3.396
   56   2HG   PRO1111           HG1      PRO1111  19.777  10.062  -2.320
   57   1HD   PRO1111           HD2      PRO1111  21.744   8.351  -2.974
   58   2HD   PRO1111           HD1      PRO1111  21.649   9.090  -1.362
   59    HA   PRO1112           HA       PRO1112  18.365   3.068  -2.026
   60   1HB   PRO1112           HB2      PRO1112  16.400   3.111   0.215
   61   2HB   PRO1112           HB1      PRO1112  17.457   1.805  -0.333
   62   1HG   PRO1112           HG2      PRO1112  18.038   3.182   1.866
   63   2HG   PRO1112           HG1      PRO1112  19.316   2.685   0.742
   64   1HD   PRO1112           HD2      PRO1112  18.081   5.372   1.142
   65   2HD   PRO1112           HD1      PRO1112  19.760   4.947   0.756
   66    HA   PRO1113           HA       PRO1113  14.598   4.726  -3.915
   67   1HB   PRO1113           HB2      PRO1113  15.264   4.095  -6.443
   68   2HB   PRO1113           HB1      PRO1113  15.989   5.475  -5.611
   69   1HG   PRO1113           HG2      PRO1113  17.192   2.900  -6.355
   70   2HG   PRO1113           HG1      PRO1113  17.983   4.429  -5.940
   71   1HD   PRO1113           HD2      PRO1113  17.508   2.110  -4.257
   72   2HD   PRO1113           HD1      PRO1113  18.456   3.568  -3.900
   73    HA   PRO1114           HA       PRO1114  13.211   0.339  -4.211
   74   1HB   PRO1114           HB2      PRO1114  11.692   0.179  -2.053
   75   2HB   PRO1114           HB1      PRO1114  13.454   0.204  -1.903
   76   1HG   PRO1114           HG2      PRO1114  11.472   2.349  -1.340
   77   2HG   PRO1114           HG1      PRO1114  13.029   2.023  -0.559
   78   1HD   PRO1114           HD2      PRO1114  12.483   3.909  -2.633
   79   2HD   PRO1114           HD1      PRO1114  14.058   3.498  -1.931
   80    H    ILE1115           HN       ILE1115  10.674  -0.207  -3.224
   81    HA   ILE1115           HA       ILE1115   8.935  -0.010  -5.242
   82    HB   ILE1115           HB       ILE1115   7.172   0.310  -3.214
   83   1HG1  ILE1115          2HG1      ILE1115   9.709  -0.757  -1.952
   84   2HG1  ILE1115          1HG1      ILE1115   8.995   0.816  -1.621
   85   1HG2  ILE1115          2HG2      ILE1115   8.741  -2.164  -3.912
   86   2HG2  ILE1115          1HG2      ILE1115   7.253  -2.157  -2.966
   87   3HG2  ILE1115          3HG2      ILE1115   7.235  -1.613  -4.644
   88   1HD1  ILE1115          2HD1      ILE1115   7.719  -1.841  -1.039
   89   2HD1  ILE1115          1HD1      ILE1115   8.503  -0.784   0.137
   90   3HD1  ILE1115          3HD1      ILE1115   7.033  -0.257  -0.683
   91    H    ASP1116           HN       ASP1116   7.325   1.343  -5.992
   92    HA   ASP1116           HA       ASP1116   7.736   4.133  -5.738
   93   1HB   ASP1116           HB2      ASP1116   6.704   3.007  -7.734
   94   2HB   ASP1116           HB1      ASP1116   5.261   2.717  -6.768
   95    H    ASN1117           HN       ASN1117   6.891   5.560  -4.317
   96    HA   ASN1117           HA       ASN1117   5.640   6.432  -2.616
   97   1HB   ASN1117           HB2      ASN1117   3.906   3.979  -3.029
   98   2HB   ASN1117           HB1      ASN1117   3.523   5.302  -1.928
   99   1HD2  ASN1117          1HD2      ASN1117   3.728   4.289  -5.229
  100   2HD2  ASN1117          2HD2      ASN1117   2.910   5.649  -5.913
  101    H    GLY1118           HN       GLY1118   7.383   3.654  -2.601
  102   1HA   GLY1118           HA1      GLY1118   7.986   2.124  -0.912
  103   2HA   GLY1118           HA2      GLY1118   7.005   3.031   0.230
  104    H    ASP1119           HN       ASP1119   9.403   2.274   1.102
  105    HA   ASP1119           HA       ASP1119  11.712   3.603   0.731
  106   1HB   ASP1119           HB2      ASP1119  10.334   5.734   0.812
  107   2HB   ASP1119           HB1      ASP1119  10.062   5.396   2.519
  108    H    ILE1120           HN       ILE1120  13.070   3.851   2.721
  109    HA   ILE1120           HA       ILE1120  13.074   1.597   4.249
  110    HB   ILE1120           HB       ILE1120  14.032   3.884   5.784
  111   1HG1  ILE1120          2HG1      ILE1120  15.159   3.401   3.016
  112   2HG1  ILE1120          1HG1      ILE1120  14.198   4.804   3.470
  113   1HG2  ILE1120          1HG2      ILE1120  15.336   1.460   4.565
  114   2HG2  ILE1120          3HG2      ILE1120  16.102   2.555   5.716
  115   3HG2  ILE1120          2HG2      ILE1120  14.706   1.595   6.208
  116   1HD1  ILE1120          1HD1      ILE1120  15.927   5.440   5.086
  117   2HD1  ILE1120          3HD1      ILE1120  16.896   4.064   4.565
  118   3HD1  ILE1120          2HD1      ILE1120  16.536   5.368   3.433
  119    H    THR1121           HN       THR1121  12.327   0.946   6.210
  120    HA   THR1121           HA       THR1121   9.812   1.977   7.028
  121    HB   THR1121           HB       THR1121   9.934   0.313   8.852
  122    HG1  THR1121           HG1      THR1121  11.771  -0.727   9.297
  123   1HG2  THR1121          3HG2      THR1121   9.236  -0.301   6.512
  124   2HG2  THR1121          2HG2      THR1121  10.876  -0.893   6.250
  125   3HG2  THR1121          1HG2      THR1121   9.856  -1.643   7.475
  126    H    SER1122           HN       SER1122  12.841   3.166   7.576
  127    HA   SER1122           HA       SER1122  12.096   4.232  10.222
  128   1HB   SER1122           HB2      SER1122  14.842   3.982   8.971
  129   2HB   SER1122           HB1      SER1122  14.504   4.677  10.556
  130    HG   SER1122           HG       SER1122  15.074   2.549  10.856
  131    H    PHE1123           HN       PHE1123  14.530   5.501   8.028
  132    HA   PHE1123           HA       PHE1123  12.887   7.737   7.211
  133   1HB   PHE1123           HB2      PHE1123  13.718   8.360   9.490
  134   2HB   PHE1123           HB1      PHE1123  15.364   8.220   8.884
  135    HD1  PHE1123           HD1      PHE1123  12.226  10.131   8.600
  136    HD2  PHE1123           HD2      PHE1123  16.364   9.953   7.628
  137    HE1  PHE1123           HE1      PHE1123  12.149  12.478   7.866
  138    HE2  PHE1123           HE2      PHE1123  16.297  12.300   6.891
  139    HZ   PHE1123           HZ       PHE1123  14.188  13.566   7.010
  140    HA   PRO1124           HA       PRO1124  15.442   7.205   3.627
  141   1HB   PRO1124           HB2      PRO1124  15.257   9.764   2.611
  142   2HB   PRO1124           HB1      PRO1124  14.046   8.499   2.383
  143   1HG   PRO1124           HG2      PRO1124  14.093  10.747   4.356
  144   2HG   PRO1124           HG1      PRO1124  12.731  10.111   3.414
  145   1HD   PRO1124           HD2      PRO1124  13.045   9.494   6.002
  146   2HD   PRO1124           HD1      PRO1124  12.431   8.302   4.836
  147    H    LEU1125           HN       LEU1125  17.544   7.437   3.070
  148    HA   LEU1125           HA       LEU1125  19.140   9.438   4.541
  149   1HB   LEU1125           HB2      LEU1125  19.722   6.583   3.838
  150   2HB   LEU1125           HB1      LEU1125  21.046   7.706   4.074
  151    HG   LEU1125           HG       LEU1125  20.091   8.179   6.366
  152   1HD1  LEU1125          2HD1      LEU1125  18.208   6.063   5.442
  153   2HD1  LEU1125          1HD1      LEU1125  18.699   6.089   7.140
  154   3HD1  LEU1125          3HD1      LEU1125  17.914   7.498   6.428
  155   1HD2  LEU1125          2HD2      LEU1125  20.973   5.363   5.752
  156   2HD2  LEU1125          1HD2      LEU1125  22.025   6.747   6.052
  157   3HD2  LEU1125          3HD2      LEU1125  20.998   6.123   7.343
  158    H    SER1126           HN       SER1126  21.519   8.986   3.238
  159    HA   SER1126           HA       SER1126  21.029   9.562   0.409
  160   1HB   SER1126           HB2      SER1126  22.761  11.255   2.234
  161   2HB   SER1126           HB1      SER1126  22.620  11.451   0.487
  162    HG   SER1126           HG       SER1126  20.312  11.769   0.903
  163    H    VAL1127           HN       VAL1127  22.974   8.423   2.997
  164    HA   VAL1127           HA       VAL1127  24.642   6.931   1.123
  165    HB   VAL1127           HB       VAL1127  25.861   8.364   3.483
  166   1HG1  VAL1127          1HG1      VAL1127  26.858   6.212   2.562
  167   2HG1  VAL1127          3HG1      VAL1127  27.244   7.139   1.111
  168   3HG1  VAL1127          2HG1      VAL1127  27.934   7.607   2.666
  169   1HG2  VAL1127          3HG2      VAL1127  25.092   9.991   1.807
  170   2HG2  VAL1127          2HG2      VAL1127  26.853   9.926   1.912
  171   3HG2  VAL1127          1HG2      VAL1127  26.018   9.139   0.572
  172    H    TYR1128           HN       TYR1128  24.295   4.883   1.651
  173    HA   TYR1128           HA       TYR1128  23.900   4.194   4.481
  174   1HB   TYR1128           HB2      TYR1128  22.619   3.296   2.007
  175   2HB   TYR1128           HB1      TYR1128  23.142   1.967   3.035
  176    HD1  TYR1128           HD1      TYR1128  22.401   2.043   5.504
  177    HD2  TYR1128           HD2      TYR1128  20.604   4.369   2.431
  178    HE1  TYR1128           HE1      TYR1128  20.392   2.313   6.894
  179    HE2  TYR1128           HE2      TYR1128  18.590   4.650   3.810
  180    HH   TYR1128           HH       TYR1128  17.467   3.402   5.705
  181    H    ALA1129           HN       ALA1129  26.350   4.529   2.791
  182    HA   ALA1129           HA       ALA1129  28.407   3.573   2.517
  183   1HB   ALA1129           HB1      ALA1129  28.165   3.353   4.966
  184   2HB   ALA1129           HB3      ALA1129  27.514   1.732   4.730
  185   3HB   ALA1129           HB2      ALA1129  29.174   2.093   4.256
  186    HA   PRO1130           HA       PRO1130  27.878   0.282  -0.380
  187   1HB   PRO1130           HB2      PRO1130  30.435  -0.707  -0.448
  188   2HB   PRO1130           HB1      PRO1130  29.912   0.751  -1.298
  189   1HG   PRO1130           HG2      PRO1130  31.349   0.481   1.312
  190   2HG   PRO1130           HG1      PRO1130  31.607   1.653   0.007
  191   1HD   PRO1130           HD2      PRO1130  30.270   2.287   2.262
  192   2HD   PRO1130           HD1      PRO1130  29.848   2.987   0.685
  193    H    ALA1131           HN       ALA1131  27.715  -1.960  -0.551
  194    HA   ALA1131           HA       ALA1131  27.382  -4.094   0.149
  195   1HB   ALA1131           HB2      ALA1131  29.806  -4.065   0.492
  196   2HB   ALA1131           HB3      ALA1131  28.991  -5.078   1.683
  197   3HB   ALA1131           HB1      ALA1131  29.564  -3.473   2.136
  198    H    SER1132           HN       SER1132  25.738  -2.011   1.272
  199    HA   SER1132           HA       SER1132  25.164  -3.159   3.927
  200   1HB   SER1132           HB2      SER1132  24.509  -0.409   2.848
  201   2HB   SER1132           HB1      SER1132  24.004  -1.019   4.425
  202    HG   SER1132           HG       SER1132  26.527  -1.449   4.421
  203    H    SER1133           HN       SER1133  22.829  -3.083   4.560
  204    HA   SER1133           HA       SER1133  20.974  -3.354   2.310
  205   1HB   SER1133           HB2      SER1133  20.897  -5.440   4.467
  206   2HB   SER1133           HB1      SER1133  20.301  -5.523   2.810
  207    HG   SER1133           HG       SER1133  22.979  -5.666   3.708
  208    H    VAL1134           HN       VAL1134  18.696  -3.320   2.991
  209    HA   VAL1134           HA       VAL1134  18.209  -2.441   5.730
  210    HB   VAL1134           HB       VAL1134  16.839  -0.498   4.952
  211   1HG1  VAL1134          3HG1      VAL1134  19.022  -0.185   5.960
  212   2HG1  VAL1134          2HG1      VAL1134  19.793  -0.364   4.383
  213   3HG1  VAL1134          1HG1      VAL1134  18.736   1.013   4.699
  214   1HG2  VAL1134          1HG2      VAL1134  18.298  -0.969   2.360
  215   2HG2  VAL1134          3HG2      VAL1134  16.563  -1.125   2.633
  216   3HG2  VAL1134          2HG2      VAL1134  17.336   0.456   2.750
  217    H    GLU1135           HN       GLU1135  15.876  -2.041   6.119
  218    HA   GLU1135           HA       GLU1135  14.180  -3.843   4.523
  219   1HB   GLU1135           HB2      GLU1135  14.737  -4.963   6.599
  220   2HB   GLU1135           HB1      GLU1135  14.295  -3.540   7.531
  221   1HG   GLU1135           HG2      GLU1135  11.968  -3.806   6.821
  222   2HG   GLU1135           HG1      GLU1135  12.420  -5.247   5.910
  223    H    TYR1136           HN       TYR1136  12.796  -2.532   3.486
  224    HA   TYR1136           HA       TYR1136  11.652  -0.280   4.995
  225   1HB   TYR1136           HB2      TYR1136  11.135   0.618   2.645
  226   2HB   TYR1136           HB1      TYR1136  12.799   0.682   3.213
  227    HD1  TYR1136           HD1      TYR1136  14.504  -0.271   1.984
  228    HD2  TYR1136           HD2      TYR1136  10.480  -1.337   1.133
  229    HE1  TYR1136           HE1      TYR1136  15.255  -1.479  -0.011
  230    HE2  TYR1136           HE2      TYR1136  11.219  -2.555  -0.868
  231    HH   TYR1136           HH       TYR1136  13.216  -2.453  -2.444
  232    H    GLN1137           HN       GLN1137   9.631   0.383   3.267
  233    HA   GLN1137           HA       GLN1137   7.900  -1.679   2.507
  234   1HB   GLN1137           HB2      GLN1137   7.959  -1.983   5.052
  235   2HB   GLN1137           HB1      GLN1137   7.110  -0.447   5.148
  236   1HG   GLN1137           HG2      GLN1137   5.314  -1.428   3.733
  237   2HG   GLN1137           HG1      GLN1137   6.141  -2.981   3.855
  238   1HE2  GLN1137          1HE2      GLN1137   7.001  -2.425   6.610
  239   2HE2  GLN1137          2HE2      GLN1137   5.601  -2.656   7.593
  240    H    CYS1138           HN       CYS1138   5.505  -0.683   2.499
  241    HA   CYS1138           HA       CYS1138   5.831   1.982   1.361
  242   1HB   CYS1138           HB2      CYS1138   3.743  -0.152   1.107
  243   2HB   CYS1138           HB1      CYS1138   3.347   1.513   0.694
  244    H    GLN1139           HN       GLN1139   4.519   3.721   1.918
  245    HA   GLN1139           HA       GLN1139   4.207   4.385   4.513
  246   1HB   GLN1139           HB2      GLN1139   2.366   5.224   2.268
  247   2HB   GLN1139           HB1      GLN1139   2.529   6.053   3.810
  248   1HG   GLN1139           HG2      GLN1139   4.873   6.527   3.307
  249   2HG   GLN1139           HG1      GLN1139   4.703   5.702   1.758
  250   1HE2  GLN1139          1HE2      GLN1139   3.515   6.666   0.114
  251   2HE2  GLN1139          2HE2      GLN1139   3.103   8.345   0.141
  252    H    ASN1140           HN       ASN1140   2.347   4.686   5.904
  253    HA   ASN1140           HA       ASN1140   1.085   2.415   6.687
  254   1HB   ASN1140           HB2      ASN1140   1.136   4.626   7.902
  255   2HB   ASN1140           HB1      ASN1140  -0.205   5.137   6.878
  256   1HD2  ASN1140          1HD2      ASN1140  -2.207   4.258   7.137
  257   2HD2  ASN1140          2HD2      ASN1140  -2.647   3.360   8.544
  258    H    LEU1141           HN       LEU1141  -1.077   1.630   6.554
  259    HA   LEU1141           HA       LEU1141  -3.065   1.110   5.569
  260   1HB   LEU1141           HB2      LEU1141  -2.590   3.761   4.576
  261   2HB   LEU1141           HB1      LEU1141  -3.259   2.769   3.296
  262    HG   LEU1141           HG       LEU1141  -5.123   2.152   4.864
  263   1HD1  LEU1141          3HD1      LEU1141  -3.944   4.369   6.528
  264   2HD1  LEU1141          2HD1      LEU1141  -5.500   3.586   6.804
  265   3HD1  LEU1141          1HD1      LEU1141  -4.008   2.661   6.965
  266   1HD2  LEU1141          3HD2      LEU1141  -4.783   5.075   4.210
  267   2HD2  LEU1141          2HD2      LEU1141  -5.419   3.833   3.131
  268   3HD2  LEU1141          1HD2      LEU1141  -6.309   4.276   4.587
  269    H    TYR1142           HN       TYR1142  -0.418   1.890   3.329
  270    HA   TYR1142           HA       TYR1142  -1.261   0.216   1.233
  271   1HB   TYR1142           HB2      TYR1142   1.517   1.129   2.006
  272   2HB   TYR1142           HB1      TYR1142   1.129   0.305   0.499
  273    HD1  TYR1142           HD1      TYR1142   0.263   3.336   2.478
  274    HD2  TYR1142           HD2      TYR1142   0.486   1.545  -1.372
  275    HE1  TYR1142           HE1      TYR1142  -0.282   5.500   1.453
  276    HE2  TYR1142           HE2      TYR1142  -0.057   3.707  -2.414
  277    HH   TYR1142           HH       TYR1142  -1.172   5.817  -1.804
  278    H    GLN1143           HN       GLN1143  -0.938  -1.907   0.765
  279    HA   GLN1143           HA       GLN1143   0.173  -3.540   2.944
  280   1HB   GLN1143           HB2      GLN1143  -2.197  -3.955   2.422
  281   2HB   GLN1143           HB1      GLN1143  -1.767  -4.316   0.755
  282   1HG   GLN1143           HG2      GLN1143  -2.112  -6.373   1.889
  283   2HG   GLN1143           HG1      GLN1143  -0.382  -6.205   1.589
  284   1HE2  GLN1143          1HE2      GLN1143   1.004  -5.796   3.319
  285   2HE2  GLN1143          2HE2      GLN1143   0.529  -6.081   4.954
  286    H    LEU1144           HN       LEU1144   2.347  -3.403   2.282
  287    HA   LEU1144           HA       LEU1144   3.346  -3.769  -0.270
  288   1HB   LEU1144           HB2      LEU1144   4.674  -3.039   1.680
  289   2HB   LEU1144           HB1      LEU1144   4.619  -4.672   2.314
  290    HG   LEU1144           HG       LEU1144   5.730  -4.385  -0.427
  291   1HD1  LEU1144          2HD1      LEU1144   6.676  -2.427   0.683
  292   2HD1  LEU1144          1HD1      LEU1144   7.218  -3.439   2.022
  293   3HD1  LEU1144          3HD1      LEU1144   7.904  -3.663   0.412
  294   1HD2  LEU1144          2HD2      LEU1144   6.578  -5.898   2.045
  295   2HD2  LEU1144          1HD2      LEU1144   5.629  -6.544   0.706
  296   3HD2  LEU1144          3HD2      LEU1144   7.301  -6.048   0.444
  297    H    GLU1145           HN       GLU1145   4.512  -5.603  -1.164
  298    HA   GLU1145           HA       GLU1145   3.619  -8.244  -0.324
  299   1HB   GLU1145           HB2      GLU1145   1.914  -7.357  -1.927
  300   2HB   GLU1145           HB1      GLU1145   3.178  -7.227  -3.139
  301   1HG   GLU1145           HG2      GLU1145   2.415  -9.811  -1.807
  302   2HG   GLU1145           HG1      GLU1145   1.710  -9.239  -3.319
  303    H    GLY1146           HN       GLY1146   5.294  -9.590  -0.400
  304   1HA   GLY1146           HA1      GLY1146   7.375  -9.149  -2.438
  305   2HA   GLY1146           HA2      GLY1146   7.033 -10.685  -1.660
  306    H    ASN1147           HN       ASN1147   9.573  -9.269  -1.911
  307    HA   ASN1147           HA       ASN1147  10.270  -9.259   0.929
  308   1HB   ASN1147           HB2      ASN1147  12.629  -9.409   0.066
  309   2HB   ASN1147           HB1      ASN1147  11.598 -10.771  -0.362
  310   1HD2  ASN1147          1HD2      ASN1147  13.370  -8.044  -1.519
  311   2HD2  ASN1147          2HD2      ASN1147  13.206  -8.386  -3.204
  312    H    LYS1148           HN       LYS1148  10.034  -7.314   1.805
  313    HA   LYS1148           HA       LYS1148  10.549  -4.865   0.379
  314   1HB   LYS1148           HB2      LYS1148  10.168  -3.907   2.747
  315   2HB   LYS1148           HB1      LYS1148   8.821  -4.650   1.892
  316   1HG   LYS1148           HG2      LYS1148   8.863  -5.317   4.232
  317   2HG   LYS1148           HG1      LYS1148   9.126  -6.702   3.172
  318   1HD   LYS1148           HD2      LYS1148  11.556  -6.500   3.564
  319   2HD   LYS1148           HD1      LYS1148  11.240  -5.181   4.694
  320   1HE   LYS1148           HE2      LYS1148  11.572  -7.287   5.879
  321   2HE   LYS1148           HE1      LYS1148   9.928  -6.685   6.098
  322   1HZ   LYS1148           HZ3      LYS1148  10.749  -8.809   4.192
  323   2HZ   LYS1148           HZ2      LYS1148   9.950  -9.059   5.661
  324   3HZ   LYS1148           HZ1      LYS1148   9.172  -8.233   4.406
  325    H    ARG1149           HN       ARG1149  12.566  -7.094   1.728
  326    HA   ARG1149           HA       ARG1149  14.527  -5.109   2.640
  327   1HB   ARG1149           HB2      ARG1149  14.102  -7.002   4.152
  328   2HB   ARG1149           HB1      ARG1149  14.567  -8.124   2.879
  329   1HG   ARG1149           HG2      ARG1149  16.587  -8.042   3.847
  330   2HG   ARG1149           HG1      ARG1149  16.749  -6.512   2.978
  331   1HD   ARG1149           HD2      ARG1149  17.369  -6.196   5.286
  332   2HD   ARG1149           HD1      ARG1149  15.867  -5.333   4.955
  333    HE   ARG1149           HE       ARG1149  14.995  -7.696   5.916
  334   1HH1  ARG1149          1HH1      ARG1149  17.328  -5.384   7.083
  335   2HH1  ARG1149          2HH1      ARG1149  17.048  -5.752   8.752
  336   1HH2  ARG1149          1HH2      ARG1149  14.620  -8.186   8.110
  337   2HH2  ARG1149          2HH2      ARG1149  15.510  -7.345   9.336
  338    H    ILE1150           HN       ILE1150  16.512  -4.869   1.667
  339    HA   ILE1150           HA       ILE1150  17.233  -6.594  -0.566
  340    HB   ILE1150           HB       ILE1150  17.585  -4.698  -2.098
  341   1HG1  ILE1150          2HG1      ILE1150  16.035  -3.098  -0.052
  342   2HG1  ILE1150          1HG1      ILE1150  17.771  -2.972  -0.307
  343   1HG2  ILE1150          2HG2      ILE1150  14.763  -5.034  -1.085
  344   2HG2  ILE1150          1HG2      ILE1150  15.200  -4.305  -2.631
  345   3HG2  ILE1150          3HG2      ILE1150  15.566  -6.001  -2.322
  346   1HD1  ILE1150          1HD1      ILE1150  15.657  -2.352  -2.349
  347   2HD1  ILE1150          3HD1      ILE1150  16.552  -1.171  -1.393
  348   3HD1  ILE1150          2HD1      ILE1150  17.400  -2.181  -2.565
  349    H    THR1151           HN       THR1151  19.293  -5.380  -1.652
  350    HA   THR1151           HA       THR1151  21.055  -4.290   0.387
  351    HB   THR1151           HB       THR1151  21.748  -6.848  -1.073
  352    HG1  THR1151           HG1      THR1151  20.292  -7.149   0.697
  353   1HG2  THR1151          2HG2      THR1151  23.685  -5.395  -0.729
  354   2HG2  THR1151          1HG2      THR1151  23.296  -5.271   0.986
  355   3HG2  THR1151          3HG2      THR1151  23.776  -6.824   0.301
  356    H    CYS1152           HN       CYS1152  21.929  -2.579  -0.575
  357    HA   CYS1152           HA       CYS1152  21.927  -2.047  -3.303
  358   1HB   CYS1152           HB2      CYS1152  23.677  -0.316  -2.725
  359   2HB   CYS1152           HB1      CYS1152  22.186  -0.229  -1.796
  360    H    ARG1153           HN       ARG1153  23.752  -1.756  -4.743
  361    HA   ARG1153           HA       ARG1153  26.158  -3.268  -4.218
  362   1HB   ARG1153           HB2      ARG1153  25.923  -4.735  -6.167
  363   2HB   ARG1153           HB1      ARG1153  24.663  -5.034  -4.979
  364   1HG   ARG1153           HG2      ARG1153  24.249  -3.295  -7.395
  365   2HG   ARG1153           HG1      ARG1153  23.942  -5.032  -7.389
  366   1HD   ARG1153           HD2      ARG1153  22.368  -4.695  -5.498
  367   2HD   ARG1153           HD1      ARG1153  22.611  -2.953  -5.654
  368    HE   ARG1153           HE       ARG1153  21.385  -2.974  -7.633
  369   1HH1  ARG1153          1HH1      ARG1153  21.785  -6.195  -6.363
  370   2HH1  ARG1153          2HH1      ARG1153  20.564  -6.885  -7.378
  371   1HH2  ARG1153          1HH2      ARG1153  19.776  -3.876  -8.973
  372   2HH2  ARG1153          2HH2      ARG1153  19.422  -5.567  -8.863
  373    H    ASN1154           HN       ASN1154  27.753  -2.042  -4.936
  374    HA   ASN1154           HA       ASN1154  28.964  -0.547  -6.147
  375   1HB   ASN1154           HB2      ASN1154  27.165  -1.481  -8.397
  376   2HB   ASN1154           HB1      ASN1154  28.659  -0.569  -8.599
  377   1HD2  ASN1154          1HD2      ASN1154  27.258  -3.633  -7.761
  378   2HD2  ASN1154          2HD2      ASN1154  28.714  -4.556  -7.862
  379    H    GLY1155           HN       GLY1155  26.927   0.560  -4.654
  380   1HA   GLY1155           HA1      GLY1155  26.690   3.116  -5.760
  381   2HA   GLY1155           HA2      GLY1155  25.792   2.527  -4.372
  382    H    GLN1156           HN       GLN1156  24.234   0.557  -5.460
  383    HA   GLN1156           HA       GLN1156  22.194   2.092  -6.729
  384   1HB   GLN1156           HB2      GLN1156  23.704   1.592  -8.653
  385   2HB   GLN1156           HB1      GLN1156  23.429  -0.122  -8.374
  386   1HG   GLN1156           HG2      GLN1156  21.045   0.189  -8.804
  387   2HG   GLN1156           HG1      GLN1156  21.323   1.906  -9.094
  388   1HE2  GLN1156          1HE2      GLN1156  21.745  -1.316 -10.319
  389   2HE2  GLN1156          2HE2      GLN1156  22.176  -0.867 -11.930
  390    H    TRP1157           HN       TRP1157  20.912   1.368  -5.046
  391    HA   TRP1157           HA       TRP1157  20.676  -1.238  -4.107
  392   1HB   TRP1157           HB2      TRP1157  18.683   1.024  -4.168
  393   2HB   TRP1157           HB1      TRP1157  18.374  -0.502  -3.347
  394    HD1  TRP1157           HD1      TRP1157  20.555   2.627  -3.107
  395    HE1  TRP1157           HE1      TRP1157  21.486   2.789  -0.712
  396    HE3  TRP1157           HE3      TRP1157  19.000  -1.897  -1.344
  397    HZ2  TRP1157           HZ2      TRP1157  21.566   1.179   1.619
  398    HZ3  TRP1157           HZ3      TRP1157  19.546  -2.523   0.968
  399    HH2  TRP1157           HH2      TRP1157  20.803  -1.021   2.416
  400    H    SER1158           HN       SER1158  18.744  -2.629  -4.257
  401    HA   SER1158           HA       SER1158  17.913  -2.922  -7.060
  402   1HB   SER1158           HB2      SER1158  17.385  -5.277  -6.406
  403   2HB   SER1158           HB1      SER1158  19.089  -4.861  -6.221
  404    HG   SER1158           HG       SER1158  18.809  -4.721  -4.029
  405    H    GLU1159           HN       GLU1159  15.882  -2.471  -7.583
  406    HA   GLU1159           HA       GLU1159  13.962  -1.527  -5.801
  407   1HB   GLU1159           HB2      GLU1159  13.931  -1.048  -8.209
  408   2HB   GLU1159           HB1      GLU1159  13.551  -2.731  -8.546
  409   1HG   GLU1159           HG2      GLU1159  11.425  -2.491  -7.375
  410   2HG   GLU1159           HG1      GLU1159  11.806  -0.805  -7.028
  411    HA   PRO1160           HA       PRO1160  12.336  -5.358  -4.205
  412   1HB   PRO1160           HB2      PRO1160  10.403  -4.396  -2.668
  413   2HB   PRO1160           HB1      PRO1160  12.091  -4.000  -2.317
  414   1HG   PRO1160           HG2      PRO1160  10.023  -2.367  -3.746
  415   2HG   PRO1160           HG1      PRO1160  11.148  -1.863  -2.474
  416   1HD   PRO1160           HD2      PRO1160  11.580  -1.459  -5.156
  417   2HD   PRO1160           HD1      PRO1160  12.873  -1.583  -3.946
  418    HA   PRO1161           HA       PRO1161   8.799  -6.886  -6.372
  419   1HB   PRO1161           HB2      PRO1161   6.924  -7.331  -4.349
  420   2HB   PRO1161           HB1      PRO1161   8.153  -8.473  -4.898
  421   1HG   PRO1161           HG2      PRO1161   8.195  -6.615  -2.562
  422   2HG   PRO1161           HG1      PRO1161   8.827  -8.267  -2.697
  423   1HD   PRO1161           HD2      PRO1161  10.465  -6.166  -2.765
  424   2HD   PRO1161           HD1      PRO1161  10.744  -7.571  -3.816
  425    H    LYS1162           HN       LYS1162   6.667  -5.599  -3.861
  426    HA   LYS1162           HA       LYS1162   6.107  -3.082  -4.865
  427   1HB   LYS1162           HB2      LYS1162   5.586  -4.443  -6.944
  428   2HB   LYS1162           HB1      LYS1162   4.211  -5.091  -6.064
  429   1HG   LYS1162           HG2      LYS1162   3.461  -3.306  -7.461
  430   2HG   LYS1162           HG1      LYS1162   3.356  -2.796  -5.775
  431   1HD   LYS1162           HD2      LYS1162   5.472  -1.583  -6.014
  432   2HD   LYS1162           HD1      LYS1162   5.564  -2.082  -7.704
  433   1HE   LYS1162           HE2      LYS1162   4.713   0.194  -7.507
  434   2HE   LYS1162           HE1      LYS1162   3.492  -0.887  -8.179
  435   1HZ   LYS1162           HZ1      LYS1162   3.634   0.013  -5.351
  436   2HZ   LYS1162           HZ3      LYS1162   2.549   0.587  -6.517
  437   3HZ   LYS1162           HZ2      LYS1162   2.461  -1.020  -5.998
  438    H    CYS1163           HN       CYS1163   3.894  -2.281  -4.236
  439    HA   CYS1163           HA       CYS1163   2.879  -3.812  -1.926
  440   1HB   CYS1163           HB2      CYS1163   2.712  -0.820  -2.247
  441   2HB   CYS1163           HB1      CYS1163   2.418  -1.771  -0.796
  442    H    LEU1164           HN       LEU1164   0.766  -4.257  -1.840
  443    HA   LEU1164           HA       LEU1164  -0.886  -3.669  -4.108
  444   1HB   LEU1164           HB2      LEU1164  -1.186  -5.253  -1.597
  445   2HB   LEU1164           HB1      LEU1164  -2.634  -4.790  -2.468
  446    HG   LEU1164           HG       LEU1164  -1.840  -7.066  -3.029
  447   1HD1  LEU1164          2HD1      LEU1164  -3.178  -5.805  -4.625
  448   2HD1  LEU1164          1HD1      LEU1164  -1.714  -5.091  -5.303
  449   3HD1  LEU1164          3HD1      LEU1164  -2.000  -6.825  -5.454
  450   1HD2  LEU1164          1HD2      LEU1164   0.555  -6.694  -2.795
  451   2HD2  LEU1164          3HD2      LEU1164   0.168  -7.342  -4.388
  452   3HD2  LEU1164          2HD2      LEU1164   0.535  -5.628  -4.201
  453    H    HIS1165           HN       HIS1165  -1.835  -1.764  -4.352
  454    HA   HIS1165           HA       HIS1165  -2.099   0.295  -2.612
  455   1HB   HIS1165           HB2      HIS1165  -4.122  -0.495  -4.721
  456   2HB   HIS1165           HB1      HIS1165  -3.996   1.097  -3.977
  457    HD1  HIS1165           HD1      HIS1165  -2.629  -0.968  -6.686
  458    HD2  HIS1165           HD2      HIS1165  -1.593   2.527  -4.690
  459    HE1  HIS1165           HE1      HIS1165  -0.900   0.145  -8.132
  460    HE2  HIS1165           HE2      HIS1165  -0.347   2.297  -6.943
  461    HA   PRO1166           HA       PRO1166  -4.577  -1.288   0.737
  462   1HB   PRO1166           HB2      PRO1166  -5.342   1.280   1.575
  463   2HB   PRO1166           HB1      PRO1166  -3.949   0.362   2.150
  464   1HG   PRO1166           HG2      PRO1166  -4.087   2.509   0.089
  465   2HG   PRO1166           HG1      PRO1166  -2.807   2.157   1.264
  466   1HD   PRO1166           HD2      PRO1166  -2.531   1.509  -1.313
  467   2HD   PRO1166           HD1      PRO1166  -1.918   0.444  -0.034
  468    H    CYS1167           HN       CYS1167  -6.768  -0.864   1.641
  469    HA   CYS1167           HA       CYS1167  -8.719  -1.191  -0.352
  470   1HB   CYS1167           HB2      CYS1167  -9.349  -0.373   2.473
  471   2HB   CYS1167           HB1      CYS1167 -10.245  -1.459   1.414
  472    H    VAL1168           HN       VAL1168  -8.534   0.647  -1.712
  473    HA   VAL1168           HA       VAL1168  -9.270   3.229  -0.571
  474    HB   VAL1168           HB       VAL1168  -8.416   2.501  -3.373
  475   1HG1  VAL1168          2HG1      VAL1168  -9.867   4.460  -3.374
  476   2HG1  VAL1168          1HG1      VAL1168  -8.872   5.212  -2.128
  477   3HG1  VAL1168          3HG1      VAL1168  -8.201   4.917  -3.732
  478   1HG2  VAL1168          2HG2      VAL1168  -6.924   3.854  -1.130
  479   2HG2  VAL1168          1HG2      VAL1168  -6.626   2.233  -1.758
  480   3HG2  VAL1168          3HG2      VAL1168  -6.325   3.642  -2.776
  481    H    ILE1169           HN       ILE1169 -11.447   3.112  -0.149
  482    HA   ILE1169           HA       ILE1169 -13.259   2.397  -2.337
  483    HB   ILE1169           HB       ILE1169 -13.548   2.599   0.622
  484   1HG1  ILE1169          2HG1      ILE1169 -13.251   0.472  -0.800
  485   2HG1  ILE1169          1HG1      ILE1169 -14.509   0.468   0.431
  486   1HG2  ILE1169          2HG2      ILE1169 -15.870   2.975  -1.267
  487   2HG2  ILE1169          1HG2      ILE1169 -15.998   2.680   0.467
  488   3HG2  ILE1169          3HG2      ILE1169 -15.246   4.163  -0.121
  489   1HD1  ILE1169          2HD1      ILE1169 -14.984   1.001  -2.492
  490   2HD1  ILE1169          1HD1      ILE1169 -15.218  -0.553  -1.695
  491   3HD1  ILE1169          3HD1      ILE1169 -16.208   0.831  -1.232
  492    H    SER1170           HN       SER1170 -14.801   3.831  -3.142
  493    HA   SER1170           HA       SER1170 -14.006   6.587  -3.089
  494   1HB   SER1170           HB2      SER1170 -14.796   5.541  -5.165
  495   2HB   SER1170           HB1      SER1170 -16.378   5.273  -4.432
  496    HG   SER1170           HG       SER1170 -16.819   7.372  -4.560
  497    H    ARG1171           HN       ARG1171 -14.485   7.791  -1.374
  498    HA   ARG1171           HA       ARG1171 -16.861   7.375   0.207
  499   1HB   ARG1171           HB2      ARG1171 -16.026   9.460   1.394
  500   2HB   ARG1171           HB1      ARG1171 -14.944   8.076   1.413
  501   1HG   ARG1171           HG2      ARG1171 -13.559   9.899   0.988
  502   2HG   ARG1171           HG1      ARG1171 -13.797   9.151  -0.592
  503   1HD   ARG1171           HD2      ARG1171 -13.972  11.584  -0.723
  504   2HD   ARG1171           HD1      ARG1171 -15.500  10.806  -1.134
  505    HE   ARG1171           HE       ARG1171 -15.472  11.452   1.608
  506   1HH1  ARG1171          1HH1      ARG1171 -15.683  12.957  -1.528
  507   2HH1  ARG1171          2HH1      ARG1171 -16.597  14.314  -0.957
  508   1HH2  ARG1171          1HH2      ARG1171 -16.675  13.234   2.367
  509   2HH2  ARG1171          2HH2      ARG1171 -17.160  14.471   1.257
  510    H    GLU1172           HN       GLU1172 -16.722   8.404  -2.738
  511    HA   GLU1172           HA       GLU1172 -18.694  10.549  -2.337
  512   1HB   GLU1172           HB2      GLU1172 -16.515  11.379  -3.255
  513   2HB   GLU1172           HB1      GLU1172 -16.755  10.338  -4.651
  514   1HG   GLU1172           HG2      GLU1172 -18.790  11.556  -5.217
  515   2HG   GLU1172           HG1      GLU1172 -18.559  12.597  -3.812
  516    H    ILE1173           HN       ILE1173 -18.162   7.460  -3.362
  517    HA   ILE1173           HA       ILE1173 -20.417   7.559  -5.253
  518    HB   ILE1173           HB       ILE1173 -17.876   6.058  -5.301
  519   1HG1  ILE1173          2HG1      ILE1173 -18.897   6.067  -7.825
  520   2HG1  ILE1173          1HG1      ILE1173 -19.689   7.480  -7.129
  521   1HG2  ILE1173          2HG2      ILE1173 -20.445   4.741  -6.145
  522   2HG2  ILE1173          1HG2      ILE1173 -18.828   4.183  -6.571
  523   3HG2  ILE1173          3HG2      ILE1173 -19.339   4.195  -4.884
  524   1HD1  ILE1173          1HD1      ILE1173 -16.732   6.972  -7.191
  525   2HD1  ILE1173          3HD1      ILE1173 -17.621   8.077  -8.241
  526   3HD1  ILE1173          2HD1      ILE1173 -17.526   8.391  -6.507
  527    H    MET1174           HN       MET1174 -18.957   5.874  -2.528
  528    HA   MET1174           HA       MET1174 -21.123   4.009  -2.271
  529   1HB   MET1174           HB2      MET1174 -18.952   3.267  -1.592
  530   2HB   MET1174           HB1      MET1174 -18.731   4.667  -0.553
  531   1HG   MET1174           HG2      MET1174 -21.053   2.984   0.077
  532   2HG   MET1174           HG1      MET1174 -19.476   2.232   0.308
  533   1HE   MET1174           HE2      MET1174 -17.633   4.646   1.090
  534   2HE   MET1174           HE1      MET1174 -17.760   4.631   2.849
  535   3HE   MET1174           HE3      MET1174 -17.633   3.113   1.961
  536    H    GLU1175           HN       GLU1175 -19.820   6.403   0.029
  537    HA   GLU1175           HA       GLU1175 -22.201   6.512   1.549
  538   1HB   GLU1175           HB2      GLU1175 -21.106   8.059   2.895
  539   2HB   GLU1175           HB1      GLU1175 -19.762   7.162   2.196
  540   1HG   GLU1175           HG2      GLU1175 -19.393   8.920   0.576
  541   2HG   GLU1175           HG1      GLU1175 -20.781   9.811   1.197
  542    H    ASN1176           HN       ASN1176 -21.879   7.459  -1.513
  543    HA   ASN1176           HA       ASN1176 -23.381   9.957  -1.250
  544   1HB   ASN1176           HB2      ASN1176 -21.346   9.874  -2.691
  545   2HB   ASN1176           HB1      ASN1176 -22.210   8.743  -3.725
  546   1HD2  ASN1176          1HD2      ASN1176 -22.119  10.118  -5.490
  547   2HD2  ASN1176          2HD2      ASN1176 -23.091  11.541  -5.599
  548    H    TYR1177           HN       TYR1177 -23.472   7.115  -3.416
  549    HA   TYR1177           HA       TYR1177 -25.988   7.529  -4.473
  550   1HB   TYR1177           HB2      TYR1177 -24.657   4.879  -3.872
  551   2HB   TYR1177           HB1      TYR1177 -26.041   5.097  -4.935
  552    HD1  TYR1177           HD1      TYR1177 -24.803   7.814  -6.053
  553    HD2  TYR1177           HD2      TYR1177 -23.403   3.814  -5.663
  554    HE1  TYR1177           HE1      TYR1177 -23.286   8.163  -7.956
  555    HE2  TYR1177           HE2      TYR1177 -21.879   4.154  -7.556
  556    HH   TYR1177           HH       TYR1177 -21.690   5.620  -9.529
  557    H    ASN1178           HN       ASN1178 -25.328   5.046  -2.031
  558    HA   ASN1178           HA       ASN1178 -27.236   5.841  -0.183
  559   1HB   ASN1178           HB2      ASN1178 -28.809   3.741  -0.813
  560   2HB   ASN1178           HB1      ASN1178 -29.120   5.382  -1.377
  561   1HD2  ASN1178          1HD2      ASN1178 -30.222   4.604  -3.175
  562   2HD2  ASN1178          2HD2      ASN1178 -29.394   3.911  -4.525
  563    H    ILE1179           HN       ILE1179 -24.604   4.689  -0.220
  564    HA   ILE1179           HA       ILE1179 -25.163   2.401   1.527
  565    HB   ILE1179           HB       ILE1179 -23.063   1.293   0.587
  566   1HG1  ILE1179          2HG1      ILE1179 -23.739   2.923  -1.861
  567   2HG1  ILE1179          1HG1      ILE1179 -22.449   3.376  -0.751
  568   1HG2  ILE1179          2HG2      ILE1179 -25.557   1.464  -1.097
  569   2HG2  ILE1179          1HG2      ILE1179 -24.342   0.190  -1.199
  570   3HG2  ILE1179          3HG2      ILE1179 -25.289   0.390   0.276
  571   1HD1  ILE1179          3HD1      ILE1179 -22.594   0.752  -2.207
  572   2HD1  ILE1179          2HD1      ILE1179 -21.660   2.149  -2.740
  573   3HD1  ILE1179          1HD1      ILE1179 -21.262   1.348  -1.220
  574    H    ALA1180           HN       ALA1180 -23.769   2.144   3.247
  575    HA   ALA1180           HA       ALA1180 -21.550   4.058   3.479
  576   1HB   ALA1180           HB1      ALA1180 -23.527   4.988   4.631
  577   2HB   ALA1180           HB3      ALA1180 -23.559   3.564   5.671
  578   3HB   ALA1180           HB2      ALA1180 -22.182   4.663   5.725
  579    H    LEU1181           HN       LEU1181 -21.959   2.747   6.466
  580    HA   LEU1181           HA       LEU1181 -20.816   0.149   5.928
  581   1HB   LEU1181           HB2      LEU1181 -19.200   2.414   6.983
  582   2HB   LEU1181           HB1      LEU1181 -18.906   0.810   7.626
  583    HG   LEU1181           HG       LEU1181 -18.941   0.450   4.862
  584   1HD1  LEU1181          3HD1      LEU1181 -17.444   2.962   5.583
  585   2HD1  LEU1181          2HD1      LEU1181 -17.271   2.076   4.067
  586   3HD1  LEU1181          1HD1      LEU1181 -18.813   2.826   4.481
  587   1HD2  LEU1181          3HD2      LEU1181 -16.646   0.753   6.790
  588   2HD2  LEU1181          2HD2      LEU1181 -17.503  -0.734   6.381
  589   3HD2  LEU1181          1HD2      LEU1181 -16.516   0.077   5.166
  590    H    ARG1182           HN       ARG1182 -20.943  -1.271   7.627
  591    HA   ARG1182           HA       ARG1182 -22.994  -0.812   9.508
  592   1HB   ARG1182           HB2      ARG1182 -20.919  -3.001   9.599
  593   2HB   ARG1182           HB1      ARG1182 -22.534  -3.034  10.294
  594   1HG   ARG1182           HG2      ARG1182 -23.532  -3.076   8.115
  595   2HG   ARG1182           HG1      ARG1182 -21.961  -2.839   7.346
  596   1HD   ARG1182           HD2      ARG1182 -21.222  -4.994   8.359
  597   2HD   ARG1182           HD1      ARG1182 -22.874  -5.239   8.923
  598    HE   ARG1182           HE       ARG1182 -22.212  -4.962   6.063
  599   1HH1  ARG1182          1HH1      ARG1182 -23.809  -6.603   8.691
  600   2HH1  ARG1182          2HH1      ARG1182 -24.635  -7.722   7.660
  601   1HH2  ARG1182          1HH2      ARG1182 -23.297  -6.433   4.699
  602   2HH2  ARG1182          2HH2      ARG1182 -24.343  -7.627   5.392
  603    H    TRP1183           HN       TRP1183 -20.221   0.695   9.611
  604    HA   TRP1183           HA       TRP1183 -20.084   0.670  12.544
  605   1HB   TRP1183           HB2      TRP1183 -17.687   0.694  10.704
  606   2HB   TRP1183           HB1      TRP1183 -17.651   0.733  12.466
  607    HD1  TRP1183           HD1      TRP1183 -18.356  -1.658   9.545
  608    HE1  TRP1183           HE1      TRP1183 -18.209  -4.077  10.415
  609    HE3  TRP1183           HE3      TRP1183 -17.841  -0.703  14.544
  610    HZ2  TRP1183           HZ2      TRP1183 -17.912  -5.399  12.873
  611    HZ3  TRP1183           HZ3      TRP1183 -17.629  -2.608  16.089
  612    HH2  TRP1183           HH2      TRP1183 -17.665  -4.908  15.270
  613    H    THR1184           HN       THR1184 -21.360   2.519  10.692
  614    HA   THR1184           HA       THR1184 -20.315   4.963  11.686
  615    HB   THR1184           HB       THR1184 -18.583   4.512   9.995
  616    HG1  THR1184           HG1      THR1184 -20.387   6.635   9.377
  617   1HG2  THR1184          1HG2      THR1184 -19.948   3.152   8.472
  618   2HG2  THR1184          3HG2      THR1184 -20.896   4.575   8.046
  619   3HG2  THR1184          2HG2      THR1184 -19.189   4.494   7.614
  620    H    ALA1185           HN       ALA1185 -22.194   3.342   9.237
  621    HA   ALA1185           HA       ALA1185 -24.272   3.702   8.399
  622   1HB   ALA1185           HB2      ALA1185 -24.920   4.257  10.714
  623   2HB   ALA1185           HB1      ALA1185 -24.476   5.937  10.416
  624   3HB   ALA1185           HB3      ALA1185 -25.807   5.204   9.518
  625    H    LYS1186           HN       LYS1186 -21.663   5.583   8.125
  626    HA   LYS1186           HA       LYS1186 -22.224   6.658   5.672
  627   1HB   LYS1186           HB2      LYS1186 -22.651   9.006   6.030
  628   2HB   LYS1186           HB1      LYS1186 -23.892   8.066   6.843
  629   1HG   LYS1186           HG2      LYS1186 -21.511   8.971   8.382
  630   2HG   LYS1186           HG1      LYS1186 -22.801  10.117   8.018
  631   1HD   LYS1186           HD2      LYS1186 -23.277   7.449   9.329
  632   2HD   LYS1186           HD1      LYS1186 -22.994   8.937  10.232
  633   1HE   LYS1186           HE2      LYS1186 -24.936   9.956   9.095
  634   2HE   LYS1186           HE1      LYS1186 -25.240   8.417   8.289
  635   1HZ   LYS1186           HZ3      LYS1186 -25.215   8.791  11.234
  636   2HZ   LYS1186           HZ2      LYS1186 -26.615   8.766  10.286
  637   3HZ   LYS1186           HZ1      LYS1186 -25.645   7.384  10.397
  638    H    GLN1187           HN       GLN1187 -20.273   6.467   4.956
  639    HA   GLN1187           HA       GLN1187 -18.087   6.876   4.555
  640   1HB   GLN1187           HB2      GLN1187 -18.610   9.229   4.854
  641   2HB   GLN1187           HB1      GLN1187 -18.426   9.072   6.597
  642   1HG   GLN1187           HG2      GLN1187 -16.093   8.685   6.399
  643   2HG   GLN1187           HG1      GLN1187 -16.208   8.518   4.648
  644   1HE2  GLN1187          1HE2      GLN1187 -17.937  10.952   6.453
  645   2HE2  GLN1187          2HE2      GLN1187 -17.040  12.307   5.866
  646    H    LYS1188           HN       LYS1188 -17.078   5.116   5.168
  647    HA   LYS1188           HA       LYS1188 -15.422   5.184   7.504
  648   1HB   LYS1188           HB2      LYS1188 -17.583   4.332   8.432
  649   2HB   LYS1188           HB1      LYS1188 -17.475   2.971   7.328
  650   1HG   LYS1188           HG2      LYS1188 -16.675   2.105   9.319
  651   2HG   LYS1188           HG1      LYS1188 -15.197   2.524   8.448
  652   1HD   LYS1188           HD2      LYS1188 -16.461   4.473  10.340
  653   2HD   LYS1188           HD1      LYS1188 -15.416   3.185  10.940
  654   1HE   LYS1188           HE2      LYS1188 -13.615   3.972   9.475
  655   2HE   LYS1188           HE1      LYS1188 -14.660   5.271   8.899
  656   1HZ   LYS1188           HZ2      LYS1188 -13.760   4.903  11.705
  657   2HZ   LYS1188           HZ1      LYS1188 -13.144   6.040  10.616
  658   3HZ   LYS1188           HZ3      LYS1188 -14.748   6.154  11.142
  659    H    LEU1189           HN       LEU1189 -15.044   5.143   4.745
  660    HA   LEU1189           HA       LEU1189 -14.405   2.495   3.851
  661   1HB   LEU1189           HB2      LEU1189 -13.274   3.921   1.981
  662   2HB   LEU1189           HB1      LEU1189 -15.017   3.798   2.074
  663    HG   LEU1189           HG       LEU1189 -13.999   6.100   1.611
  664   1HD1  LEU1189          3HD1      LEU1189 -16.001   5.690   3.813
  665   2HD1  LEU1189          2HD1      LEU1189 -15.701   7.234   3.016
  666   3HD1  LEU1189          1HD1      LEU1189 -16.322   5.869   2.089
  667   1HD2  LEU1189          1HD2      LEU1189 -12.261   6.059   3.313
  668   2HD2  LEU1189          3HD2      LEU1189 -13.359   7.418   3.551
  669   3HD2  LEU1189          2HD2      LEU1189 -13.491   5.987   4.574
  670    H    TYR1190           HN       TYR1190 -12.112   2.708   2.543
  671    HA   TYR1190           HA       TYR1190  -9.868   2.581   2.663
  672   1HB   TYR1190           HB2      TYR1190 -10.307   4.654   4.796
  673   2HB   TYR1190           HB1      TYR1190  -8.700   4.096   4.341
  674    HD1  TYR1190           HD1      TYR1190 -11.401   4.402   1.861
  675    HD2  TYR1190           HD2      TYR1190  -7.983   6.278   3.583
  676    HE1  TYR1190           HE1      TYR1190 -11.356   6.024   0.009
  677    HE2  TYR1190           HE2      TYR1190  -7.935   7.900   1.736
  678    HH   TYR1190           HH       TYR1190 -10.505   8.289  -0.439
  679    H    SER1191           HN       SER1191  -8.566   1.072   3.392
  680    HA   SER1191           HA       SER1191  -8.385   0.291   6.139
  681   1HB   SER1191           HB2      SER1191  -9.872  -1.447   4.170
  682   2HB   SER1191           HB1      SER1191  -9.066  -2.134   5.579
  683    HG   SER1191           HG       SER1191 -10.352  -0.511   6.798
  684    H    ARG1192           HN       ARG1192  -7.210  -2.092   6.030
  685    HA   ARG1192           HA       ARG1192  -4.851  -1.607   4.392
  686   1HB   ARG1192           HB2      ARG1192  -5.430  -3.306   6.806
  687   2HB   ARG1192           HB1      ARG1192  -3.990  -3.568   5.841
  688   1HG   ARG1192           HG2      ARG1192  -3.325  -1.228   6.248
  689   2HG   ARG1192           HG1      ARG1192  -4.741  -1.039   7.285
  690   1HD   ARG1192           HD2      ARG1192  -2.478  -2.987   7.710
  691   2HD   ARG1192           HD1      ARG1192  -2.731  -1.485   8.599
  692    HE   ARG1192           HE       ARG1192  -5.042  -3.033   8.840
  693   1HH1  ARG1192          1HH1      ARG1192  -1.698  -3.124   9.814
  694   2HH1  ARG1192          2HH1      ARG1192  -2.007  -4.043  11.249
  695   1HH2  ARG1192          1HH2      ARG1192  -5.459  -4.243  10.727
  696   2HH2  ARG1192          2HH2      ARG1192  -4.144  -4.680  11.767
  697    H    THR1193           HN       THR1193  -4.854  -2.543   2.443
  698    HA   THR1193           HA       THR1193  -6.585  -4.311   1.384
  699    HB   THR1193           HB       THR1193  -3.646  -3.992   0.834
  700    HG1  THR1193           HG1      THR1193  -4.387  -2.610  -0.582
  701   1HG2  THR1193          1HG2      THR1193  -5.542  -5.819  -0.645
  702   2HG2  THR1193          3HG2      THR1193  -3.914  -5.389  -1.171
  703   3HG2  THR1193          2HG2      THR1193  -4.146  -6.321   0.308
  704    H    GLY1194           HN       GLY1194  -7.318  -6.141   2.158
  705   1HA   GLY1194           HA1      GLY1194  -5.444  -7.963   3.513
  706   2HA   GLY1194           HA2      GLY1194  -6.541  -8.565   2.276
  707    H    GLU1195           HN       GLU1195  -7.960  -6.064   3.981
  708    HA   GLU1195           HA       GLU1195  -9.138  -7.884   5.970
  709   1HB   GLU1195           HB2      GLU1195  -9.141  -4.864   5.850
  710   2HB   GLU1195           HB1      GLU1195  -9.903  -5.826   7.110
  711   1HG   GLU1195           HG2      GLU1195  -6.960  -5.759   6.482
  712   2HG   GLU1195           HG1      GLU1195  -7.752  -4.941   7.827
  713    H    SER1196           HN       SER1196 -11.375  -8.030   6.231
  714    HA   SER1196           HA       SER1196 -12.871  -7.602   3.788
  715   1HB   SER1196           HB2      SER1196 -13.716  -8.864   6.408
  716   2HB   SER1196           HB1      SER1196 -14.647  -8.884   4.909
  717    HG   SER1196           HG       SER1196 -12.770  -9.970   3.975
  718    H    VAL1197           HN       VAL1197 -14.403  -6.091   3.456
  719    HA   VAL1197           HA       VAL1197 -15.098  -4.346   5.728
  720    HB   VAL1197           HB       VAL1197 -14.721  -3.509   2.848
  721   1HG1  VAL1197          3HG1      VAL1197 -16.505  -2.268   3.991
  722   2HG1  VAL1197          2HG1      VAL1197 -15.377  -1.846   5.280
  723   3HG1  VAL1197          1HG1      VAL1197 -15.112  -1.243   3.644
  724   1HG2  VAL1197          1HG2      VAL1197 -13.067  -2.914   5.301
  725   2HG2  VAL1197          3HG2      VAL1197 -12.599  -3.952   3.955
  726   3HG2  VAL1197          2HG2      VAL1197 -12.814  -2.220   3.700
  727    H    GLU1198           HN       GLU1198 -17.201  -3.678   5.917
  728    HA   GLU1198           HA       GLU1198 -19.102  -4.739   3.942
  729   1HB   GLU1198           HB2      GLU1198 -19.240  -4.867   6.944
  730   2HB   GLU1198           HB1      GLU1198 -20.678  -5.018   5.942
  731   1HG   GLU1198           HG2      GLU1198 -19.720  -6.942   4.819
  732   2HG   GLU1198           HG1      GLU1198 -18.247  -6.779   5.779
  733    H    PHE1199           HN       PHE1199 -20.517  -3.352   3.175
  734    HA   PHE1199           HA       PHE1199 -20.674  -0.693   4.419
  735   1HB   PHE1199           HB2      PHE1199 -21.284  -1.508   1.564
  736   2HB   PHE1199           HB1      PHE1199 -21.299   0.135   2.199
  737    HD1  PHE1199           HD1      PHE1199 -19.370   1.440   2.119
  738    HD2  PHE1199           HD2      PHE1199 -19.056  -2.781   1.668
  739    HE1  PHE1199           HE1      PHE1199 -16.986   1.687   1.538
  740    HE2  PHE1199           HE2      PHE1199 -16.679  -2.546   1.095
  741    HZ   PHE1199           HZ       PHE1199 -15.643  -0.316   1.031
  742    H    VAL1200           HN       VAL1200 -22.757   0.383   4.447
  743    HA   VAL1200           HA       VAL1200 -24.959  -1.545   4.735
  744    HB   VAL1200           HB       VAL1200 -26.067  -0.030   6.159
  745   1HG1  VAL1200          1HG1      VAL1200 -23.790  -1.046   6.943
  746   2HG1  VAL1200          3HG1      VAL1200 -23.274   0.644   6.962
  747   3HG1  VAL1200          2HG1      VAL1200 -24.641   0.124   7.950
  748   1HG2  VAL1200          2HG2      VAL1200 -24.143   2.099   5.238
  749   2HG2  VAL1200          1HG2      VAL1200 -25.853   1.979   4.829
  750   3HG2  VAL1200          3HG2      VAL1200 -25.366   2.303   6.492
  751    H    CYS1201           HN       CYS1201 -27.167  -0.088   4.430
  752    HA   CYS1201           HA       CYS1201 -27.030   0.744   1.618
  753   1HB   CYS1201           HB2      CYS1201 -29.410  -0.208   3.225
  754   2HB   CYS1201           HB1      CYS1201 -29.442   0.252   1.533
  755    H    LYS1202           HN       LYS1202 -26.217   2.559   3.560
  756    HA   LYS1202           HA       LYS1202 -26.509   4.692   4.296
  757   1HB   LYS1202           HB2      LYS1202 -26.727   5.145   1.924
  758   2HB   LYS1202           HB1      LYS1202 -28.436   4.736   1.972
  759   1HG   LYS1202           HG2      LYS1202 -28.826   6.647   3.473
  760   2HG   LYS1202           HG1      LYS1202 -27.119   7.074   3.336
  761   1HD   LYS1202           HD2      LYS1202 -27.373   7.382   0.934
  762   2HD   LYS1202           HD1      LYS1202 -29.072   6.907   1.040
  763   1HE   LYS1202           HE2      LYS1202 -27.813   9.307   2.369
  764   2HE   LYS1202           HE1      LYS1202 -28.824   9.338   0.925
  765   1HZ   LYS1202           HZ1      LYS1202 -29.688   8.431   3.617
  766   2HZ   LYS1202           HZ3      LYS1202 -30.085   9.912   2.901
  767   3HZ   LYS1202           HZ2      LYS1202 -30.659   8.468   2.233
  768    H    ARG1203           HN       ARG1203 -27.374   4.556   6.293
  769    HA   ARG1203           HA       ARG1203 -29.012   4.041   7.887
  770   1HB   ARG1203           HB2      ARG1203 -29.425   6.701   6.590
  771   2HB   ARG1203           HB1      ARG1203 -30.330   6.230   8.016
  772   1HG   ARG1203           HG2      ARG1203 -28.180   5.871   9.198
  773   2HG   ARG1203           HG1      ARG1203 -27.347   6.498   7.773
  774   1HD   ARG1203           HD2      ARG1203 -27.612   8.237   9.456
  775   2HD   ARG1203           HD1      ARG1203 -28.539   8.619   8.006
  776    HE   ARG1203           HE       ARG1203 -30.249   7.290   9.744
  777   1HH1  ARG1203          1HH1      ARG1203 -28.436  10.265   9.659
  778   2HH1  ARG1203          2HH1      ARG1203 -29.552  11.124  10.667
  779   1HH2  ARG1203          1HH2      ARG1203 -31.724   8.415  11.072
  780   2HH2  ARG1203          2HH2      ARG1203 -31.420  10.073  11.470
  781    H    GLY1204           HN       GLY1204 -29.887   2.450   5.861
  782   1HA   GLY1204           HA1      GLY1204 -32.708   3.188   5.453
  783   2HA   GLY1204           HA2      GLY1204 -32.311   1.655   6.212
  784    H    TYR1205           HN       TYR1205 -33.534   2.655   3.532
  785    HA   TYR1205           HA       TYR1205 -33.769   1.787   1.448
  786   1HB   TYR1205           HB2      TYR1205 -30.760   1.690   1.570
  787   2HB   TYR1205           HB1      TYR1205 -31.700   1.443   0.114
  788    HD1  TYR1205           HD1      TYR1205 -30.820   3.949   2.694
  789    HD2  TYR1205           HD2      TYR1205 -32.460   3.270  -1.168
  790    HE1  TYR1205           HE1      TYR1205 -30.753   6.365   2.247
  791    HE2  TYR1205           HE2      TYR1205 -32.401   5.684  -1.626
  792    HH   TYR1205           HH       TYR1205 -30.694   7.881   0.319
  793    H    ARG1206           HN       ARG1206 -33.514  -0.149   0.089
  794    HA   ARG1206           HA       ARG1206 -32.848  -2.519   1.704
  795   1HB   ARG1206           HB2      ARG1206 -34.720  -3.703   0.849
  796   2HB   ARG1206           HB1      ARG1206 -35.321  -2.141   1.384
  797   1HG   ARG1206           HG2      ARG1206 -35.415  -1.344  -0.883
  798   2HG   ARG1206           HG1      ARG1206 -34.666  -2.830  -1.471
  799   1HD   ARG1206           HD2      ARG1206 -36.586  -4.116  -0.669
  800   2HD   ARG1206           HD1      ARG1206 -37.336  -2.631  -0.082
  801    HE   ARG1206           HE       ARG1206 -36.796  -2.268  -2.783
  802   1HH1  ARG1206          1HH1      ARG1206 -38.780  -4.319  -0.782
  803   2HH1  ARG1206          2HH1      ARG1206 -40.009  -4.523  -1.985
  804   1HH2  ARG1206          1HH2      ARG1206 -38.410  -2.530  -4.373
  805   2HH2  ARG1206          2HH2      ARG1206 -39.798  -3.507  -4.026
  806    H    LEU1207           HN       LEU1207 -31.449  -3.867   0.841
  807    HA   LEU1207           HA       LEU1207 -29.951  -3.396  -1.404
  808   1HB   LEU1207           HB2      LEU1207 -29.455  -5.033   0.432
  809   2HB   LEU1207           HB1      LEU1207 -30.596  -6.135  -0.314
  810    HG   LEU1207           HG       LEU1207 -29.157  -6.033  -2.396
  811   1HD1  LEU1207          2HD1      LEU1207 -27.234  -4.733  -0.471
  812   2HD1  LEU1207          1HD1      LEU1207 -26.839  -5.313  -2.090
  813   3HD1  LEU1207          3HD1      LEU1207 -27.971  -3.973  -1.885
  814   1HD2  LEU1207          1HD2      LEU1207 -29.126  -7.933  -0.868
  815   2HD2  LEU1207          3HD2      LEU1207 -27.519  -7.615  -1.520
  816   3HD2  LEU1207          2HD2      LEU1207 -27.917  -7.122   0.126
  817    H    SER1208           HN       SER1208 -31.054  -2.891  -3.239
  818    HA   SER1208           HA       SER1208 -31.944  -4.988  -4.892
  819   1HB   SER1208           HB2      SER1208 -34.321  -4.408  -5.094
  820   2HB   SER1208           HB1      SER1208 -33.937  -4.906  -3.447
  821    HG   SER1208           HG       SER1208 -35.231  -2.985  -3.575
  822    H    SER1209           HN       SER1209 -30.108  -2.971  -5.160
  823    HA   SER1209           HA       SER1209 -31.193  -1.630  -7.516
  824   1HB   SER1209           HB2      SER1209 -31.517   0.027  -5.823
  825   2HB   SER1209           HB1      SER1209 -29.891  -0.221  -5.192
  826    HG   SER1209           HG       SER1209 -30.606   0.882  -7.708
  827    H    ARG1210           HN       ARG1210 -29.803  -3.403  -8.367
  828    HA   ARG1210           HA       ARG1210 -27.820  -4.292  -9.117
  829   1HB   ARG1210           HB2      ARG1210 -26.637  -2.760 -10.607
  830   2HB   ARG1210           HB1      ARG1210 -28.378  -2.586 -10.778
  831   1HG   ARG1210           HG2      ARG1210 -28.324  -0.580  -9.403
  832   2HG   ARG1210           HG1      ARG1210 -26.581  -0.759  -9.201
  833   1HD   ARG1210           HD2      ARG1210 -26.278  -0.522 -11.618
  834   2HD   ARG1210           HD1      ARG1210 -28.020  -0.343 -11.819
  835    HE   ARG1210           HE       ARG1210 -27.192   1.597 -10.009
  836   1HH1  ARG1210          1HH1      ARG1210 -26.686   0.776 -13.357
  837   2HH1  ARG1210          2HH1      ARG1210 -26.414   2.414 -13.851
  838   1HH2  ARG1210          1HH2      ARG1210 -26.836   3.755 -10.650
  839   2HH2  ARG1210          2HH2      ARG1210 -26.500   4.107 -12.312
  840    H    SER1211           HN       SER1211 -27.620  -3.871  -6.403
  841    HA   SER1211           HA       SER1211 -25.464  -2.331  -5.542
  842   1HB   SER1211           HB2      SER1211 -25.451  -3.787  -3.552
  843   2HB   SER1211           HB1      SER1211 -27.087  -3.305  -3.995
  844    HG   SER1211           HG       SER1211 -26.372  -5.698  -3.563
  845    H    HIS1212           HN       HIS1212 -23.599  -3.683  -4.297
  846    HA   HIS1212           HA       HIS1212 -22.384  -5.564  -6.183
  847   1HB   HIS1212           HB2      HIS1212 -21.029  -3.086  -5.097
  848   2HB   HIS1212           HB1      HIS1212 -20.214  -4.369  -5.987
  849    HD1  HIS1212           HD1      HIS1212 -22.449  -1.429  -6.439
  850    HD2  HIS1212           HD2      HIS1212 -20.740  -4.425  -8.755
  851    HE1  HIS1212           HE1      HIS1212 -22.770  -0.699  -8.824
  852    HE2  HIS1212           HE2      HIS1212 -21.802  -2.568 -10.210
  853    H    THR1213           HN       THR1213 -23.593  -6.260  -3.823
  854    HA   THR1213           HA       THR1213 -23.282  -7.510  -1.966
  855    HB   THR1213           HB       THR1213 -21.352  -8.834  -1.711
  856    HG1  THR1213           HG1      THR1213 -19.756  -7.227  -1.744
  857   1HG2  THR1213          3HG2      THR1213 -21.620  -8.189  -4.649
  858   2HG2  THR1213          2HG2      THR1213 -20.878  -9.643  -3.981
  859   3HG2  THR1213          1HG2      THR1213 -22.599  -9.344  -3.745
  860    H    LEU1214           HN       LEU1214 -23.229  -6.952   0.109
  861    HA   LEU1214           HA       LEU1214 -22.057  -4.478   0.917
  862   1HB   LEU1214           HB2      LEU1214 -23.319  -6.687   2.542
  863   2HB   LEU1214           HB1      LEU1214 -22.833  -5.134   3.193
  864    HG   LEU1214           HG       LEU1214 -25.162  -4.991   2.881
  865   1HD1  LEU1214          3HD1      LEU1214 -23.976  -3.017   2.097
  866   2HD1  LEU1214          2HD1      LEU1214 -23.871  -3.709   0.479
  867   3HD1  LEU1214          1HD1      LEU1214 -25.443  -3.285   1.156
  868   1HD2  LEU1214          3HD2      LEU1214 -25.445  -6.953   1.469
  869   2HD2  LEU1214          2HD2      LEU1214 -26.299  -5.561   0.803
  870   3HD2  LEU1214          1HD2      LEU1214 -24.766  -6.074   0.098
  871    H    ARG1215           HN       ARG1215 -21.368  -7.878   1.631
  872    HA   ARG1215           HA       ARG1215 -18.893  -7.107   2.981
  873   1HB   ARG1215           HB2      ARG1215 -20.273  -8.762   4.105
  874   2HB   ARG1215           HB1      ARG1215 -20.246  -9.794   2.681
  875   1HG   ARG1215           HG2      ARG1215 -17.834 -10.093   2.945
  876   2HG   ARG1215           HG1      ARG1215 -17.867  -9.063   4.378
  877   1HD   ARG1215           HD2      ARG1215 -19.382 -10.642   5.474
  878   2HD   ARG1215           HD1      ARG1215 -19.342 -11.672   4.045
  879    HE   ARG1215           HE       ARG1215 -16.714 -11.268   4.906
  880   1HH1  ARG1215          1HH1      ARG1215 -19.639 -12.828   5.978
  881   2HH1  ARG1215          2HH1      ARG1215 -18.808 -14.046   6.888
  882   1HH2  ARG1215          1HH2      ARG1215 -15.612 -12.867   6.100
  883   2HH2  ARG1215          2HH2      ARG1215 -16.519 -14.068   6.958
  884    H    THR1216           HN       THR1216 -16.951  -7.253   2.067
  885    HA   THR1216           HA       THR1216 -16.402  -9.116  -0.063
  886    HB   THR1216           HB       THR1216 -17.392  -7.330  -1.371
  887    HG1  THR1216           HG1      THR1216 -15.045  -6.639  -2.271
  888   1HG2  THR1216          3HG2      THR1216 -15.340  -5.536  -0.078
  889   2HG2  THR1216          2HG2      THR1216 -16.405  -5.076  -1.406
  890   3HG2  THR1216          1HG2      THR1216 -17.084  -5.474   0.172
  891    H    THR1217           HN       THR1217 -14.084  -8.327  -1.019
  892    HA   THR1217           HA       THR1217 -12.394  -7.766   1.330
  893    HB   THR1217           HB       THR1217 -11.928  -9.759  -0.890
  894    HG1  THR1217           HG1      THR1217 -11.877 -10.032   1.949
  895   1HG2  THR1217          1HG2      THR1217  -9.887  -8.367  -0.439
  896   2HG2  THR1217          3HG2      THR1217  -9.937  -8.943   1.228
  897   3HG2  THR1217          2HG2      THR1217  -9.688 -10.086  -0.091
  898    H    CYS1218           HN       CYS1218 -11.032  -6.115   1.118
  899    HA   CYS1218           HA       CYS1218 -10.877  -4.757  -1.429
  900   1HB   CYS1218           HB2      CYS1218  -9.476  -3.110  -0.095
  901   2HB   CYS1218           HB1      CYS1218 -11.151  -3.294   0.407
  902    H    TRP1219           HN       TRP1219  -9.042  -4.450  -2.646
  903    HA   TRP1219           HA       TRP1219  -6.473  -5.368  -1.848
  904   1HB   TRP1219           HB2      TRP1219  -8.120  -7.431  -2.537
  905   2HB   TRP1219           HB1      TRP1219  -7.379  -7.058  -4.091
  906    HD1  TRP1219           HD1      TRP1219  -4.583  -7.096  -4.071
  907    HE1  TRP1219           HE1      TRP1219  -3.033  -8.716  -2.814
  908    HE3  TRP1219           HE3      TRP1219  -7.858  -8.816  -0.543
  909    HZ2  TRP1219           HZ2      TRP1219  -3.162 -10.479  -0.636
  910    HZ3  TRP1219           HZ3      TRP1219  -7.063 -10.473   1.093
  911    HH2  TRP1219           HH2      TRP1219  -4.762 -11.289   1.047
  912    H    ASP1220           HN       ASP1220  -4.922  -4.541  -3.135
  913    HA   ASP1220           HA       ASP1220  -3.932  -3.302  -4.760
  914   1HB   ASP1220           HB2      ASP1220  -4.649  -5.254  -6.145
  915   2HB   ASP1220           HB1      ASP1220  -6.119  -4.373  -6.554
  916    H    GLY1221           HN       GLY1221  -6.671  -2.482  -3.373
  917   1HA   GLY1221           HA1      GLY1221  -6.644   0.175  -4.533
  918   2HA   GLY1221           HA2      GLY1221  -7.522  -0.331  -3.099
  919    H    LYS1222           HN       LYS1222  -9.040  -2.422  -4.101
  920    HA   LYS1222           HA       LYS1222 -11.016  -0.922  -5.598
  921   1HB   LYS1222           HB2      LYS1222  -9.269  -2.558  -6.999
  922   2HB   LYS1222           HB1      LYS1222 -10.700  -3.556  -6.782
  923   1HG   LYS1222           HG2      LYS1222 -10.707  -0.786  -7.959
  924   2HG   LYS1222           HG1      LYS1222 -10.711  -2.283  -8.893
  925   1HD   LYS1222           HD2      LYS1222 -12.834  -2.925  -7.856
  926   2HD   LYS1222           HD1      LYS1222 -12.831  -1.425  -6.924
  927   1HE   LYS1222           HE2      LYS1222 -12.906  -1.640  -9.932
  928   2HE   LYS1222           HE1      LYS1222 -14.275  -1.258  -8.890
  929   1HZ   LYS1222           HZ1      LYS1222 -11.811   0.376  -9.172
  930   2HZ   LYS1222           HZ3      LYS1222 -13.317   0.735  -9.857
  931   3HZ   LYS1222           HZ2      LYS1222 -13.128   0.745  -8.177
  932    H    LEU1223           HN       LEU1223 -13.067  -1.568  -5.193
  933    HA   LEU1223           HA       LEU1223 -13.568  -4.147  -3.943
  934   1HB   LEU1223           HB2      LEU1223 -14.222  -1.515  -2.631
  935   2HB   LEU1223           HB1      LEU1223 -14.947  -3.039  -2.163
  936    HG   LEU1223           HG       LEU1223 -12.298  -3.648  -2.000
  937   1HD1  LEU1223          1HD1      LEU1223 -11.679  -1.319  -2.477
  938   2HD1  LEU1223          3HD1      LEU1223 -12.610  -0.797  -1.074
  939   3HD1  LEU1223          2HD1      LEU1223 -11.190  -1.820  -0.859
  940   1HD2  LEU1223          1HD2      LEU1223 -14.069  -2.469   0.139
  941   2HD2  LEU1223          3HD2      LEU1223 -14.016  -4.161  -0.356
  942   3HD2  LEU1223          2HD2      LEU1223 -12.614  -3.426   0.419
  943    H    GLU1224           HN       GLU1224 -16.064  -4.151  -3.357
  944    HA   GLU1224           HA       GLU1224 -17.466  -3.170  -5.751
  945   1HB   GLU1224           HB2      GLU1224 -18.123  -5.553  -3.999
  946   2HB   GLU1224           HB1      GLU1224 -19.031  -5.047  -5.417
  947   1HG   GLU1224           HG2      GLU1224 -17.073  -5.475  -6.821
  948   2HG   GLU1224           HG1      GLU1224 -16.172  -5.994  -5.398
  949    H    TYR1225           HN       TYR1225 -17.894  -1.115  -4.688
  950    HA   TYR1225           HA       TYR1225 -19.285  -0.992  -2.227
  951   1HB   TYR1225           HB2      TYR1225 -20.025   1.341  -3.413
  952   2HB   TYR1225           HB1      TYR1225 -18.514   1.101  -2.546
  953    HD1  TYR1225           HD1      TYR1225 -16.468   1.386  -3.623
  954    HD2  TYR1225           HD2      TYR1225 -20.017   1.032  -5.937
  955    HE1  TYR1225           HE1      TYR1225 -15.209   2.027  -5.629
  956    HE2  TYR1225           HE2      TYR1225 -18.765   1.666  -7.960
  957    HH   TYR1225           HH       TYR1225 -15.379   1.754  -8.076
  958    HA   PRO1226           HA       PRO1226 -23.209  -2.612  -3.606
  959   1HB   PRO1226           HB2      PRO1226 -24.546  -1.684  -1.348
  960   2HB   PRO1226           HB1      PRO1226 -23.725  -3.242  -1.487
  961   1HG   PRO1226           HG2      PRO1226 -22.743  -0.680  -0.291
  962   2HG   PRO1226           HG1      PRO1226 -22.523  -2.344   0.282
  963   1HD   PRO1226           HD2      PRO1226 -20.555  -1.053  -0.961
  964   2HD   PRO1226           HD1      PRO1226 -20.846  -2.779  -1.270
  965    H    THR1227           HN       THR1227 -25.574  -1.354  -2.715
  966    HA   THR1227           HA       THR1227 -25.549   1.406  -3.533
  967    HB   THR1227           HB       THR1227 -27.072  -0.558  -5.248
  968    HG1  THR1227           HG1      THR1227 -24.896  -0.712  -5.779
  969   1HG2  THR1227          3HG2      THR1227 -28.134   1.637  -5.044
  970   2HG2  THR1227          2HG2      THR1227 -26.624   2.417  -5.518
  971   3HG2  THR1227          1HG2      THR1227 -27.489   1.396  -6.668
  972    H    CYS1228           HN       CYS1228 -27.940  -1.205  -3.626
  973    HA   CYS1228           HA       CYS1228 -29.871  -1.571  -2.472
  974   1HB   CYS1228           HB2      CYS1228 -28.792   0.475  -0.524
  975   2HB   CYS1228           HB1      CYS1228 -30.105  -0.656  -0.211
  976    H    ALA1229           HN       ALA1229 -31.910  -0.360  -1.674
  977    HA   ALA1229           HA       ALA1229 -32.326   2.333  -2.404
  978   1HB   ALA1229           HB2      ALA1229 -33.162   0.271  -4.427
  979   2HB   ALA1229           HB1      ALA1229 -33.709   1.950  -4.423
  980   3HB   ALA1229           HB3      ALA1229 -32.000   1.579  -4.657
  981    H    LYS1230           HN       LYS1230 -33.917   2.897  -1.070
  982    HA   LYS1230           HA       LYS1230 -36.475   1.811  -1.177
  983   1HB   LYS1230           HB2      LYS1230 -34.927   0.174   0.268
  984   2HB   LYS1230           HB1      LYS1230 -35.461   1.278   1.526
  985   1HG   LYS1230           HG2      LYS1230 -37.323  -0.163  -0.342
  986   2HG   LYS1230           HG1      LYS1230 -36.858  -0.755   1.252
  987   1HD   LYS1230           HD2      LYS1230 -37.790   1.254   2.284
  988   2HD   LYS1230           HD1      LYS1230 -38.238   1.867   0.690
  989   1HE   LYS1230           HE2      LYS1230 -39.273  -0.663   1.965
  990   2HE   LYS1230           HE1      LYS1230 -40.149   0.863   1.843
  991   1HZ   LYS1230           HZ3      LYS1230 -40.063   0.676  -0.565
  992   2HZ   LYS1230           HZ2      LYS1230 -39.227  -0.789  -0.447
  993   3HZ   LYS1230           HZ1      LYS1230 -40.819  -0.678   0.112
  994    H    ARG1231           HN       ARG1231 -34.375   3.184   1.268
  995    HA   ARG1231           HA       ARG1231 -36.228   4.831   2.486
  996   1HB   ARG1231           HB2      ARG1231 -33.324   4.577   2.457
  997   2HB   ARG1231           HB1      ARG1231 -33.852   6.226   2.730
  998   1HG   ARG1231           HG2      ARG1231 -34.762   3.835   4.318
  999   2HG   ARG1231           HG1      ARG1231 -33.494   4.960   4.811
 1000   1HD   ARG1231           HD2      ARG1231 -36.382   5.664   4.300
 1001   2HD   ARG1231           HD1      ARG1231 -35.628   5.488   5.883
 1002    HE   ARG1231           HE       ARG1231 -34.202   7.386   4.376
 1003   1HH1  ARG1231          1HH1      ARG1231 -37.257   6.978   6.001
 1004   2HH1  ARG1231          2HH1      ARG1231 -37.453   8.666   6.333
 1005   1HH2  ARG1231          1HH2      ARG1231 -34.451   9.611   4.809
 1006   2HH2  ARG1231          2HH2      ARG1231 -35.858  10.163   5.655

  No H/Q in entry =        1006
  Start of MODEL   24
    1    H1   GLU1103           HT1      GLU1103  40.308  -9.481   2.981
    2    H2   GLU1103           HT3      GLU1103  40.580 -11.037   2.376
    3    H3   GLU1103           HT2      GLU1103  41.081  -9.686   1.491
    4    HA   GLU1103           HA       GLU1103  39.095 -10.618   0.532
    5   1HB   GLU1103           HB2      GLU1103  37.880 -10.019   3.237
    6   2HB   GLU1103           HB1      GLU1103  36.991 -10.561   1.820
    7   1HG   GLU1103           HG2      GLU1103  38.248 -12.655   1.833
    8   2HG   GLU1103           HG1      GLU1103  39.135 -12.111   3.255
    9    H    ALA1104           HN       ALA1104  37.532  -9.266  -0.472
   10    HA   ALA1104           HA       ALA1104  37.842  -6.406   0.172
   11   1HB   ALA1104           HB1      ALA1104  37.508  -7.630  -2.565
   12   2HB   ALA1104           HB2      ALA1104  39.013  -6.998  -1.896
   13   3HB   ALA1104           HB3      ALA1104  37.659  -5.910  -2.206
   14    H    GLU1105           HN       GLU1105  36.012  -5.645   0.990
   15    HA   GLU1105           HA       GLU1105  33.481  -6.373  -0.312
   16   1HB   GLU1105           HB2      GLU1105  33.935  -6.218   2.674
   17   2HB   GLU1105           HB1      GLU1105  32.374  -6.443   1.896
   18   1HG   GLU1105           HG2      GLU1105  33.141  -8.563   0.963
   19   2HG   GLU1105           HG1      GLU1105  34.708  -8.338   1.740
   20    H    PHE1106           HN       PHE1106  35.521  -3.994   0.119
   21    HA   PHE1106           HA       PHE1106  34.067  -1.902   1.318
   22   1HB   PHE1106           HB2      PHE1106  36.496  -1.803   0.913
   23   2HB   PHE1106           HB1      PHE1106  36.200  -1.738  -0.822
   24    HD1  PHE1106           HD1      PHE1106  35.775   0.092   2.352
   25    HD2  PHE1106           HD2      PHE1106  35.649   0.288  -1.897
   26    HE1  PHE1106           HE1      PHE1106  35.633   2.546   2.473
   27    HE2  PHE1106           HE2      PHE1106  35.509   2.743  -1.784
   28    HZ   PHE1106           HZ       PHE1106  35.501   3.874   0.403
   29    H    GLY1107           HN       GLY1107  32.160  -1.165   0.665
   30   1HA   GLY1107           HA1      GLY1107  30.908  -1.636  -1.741
   31   2HA   GLY1107           HA2      GLY1107  31.774  -0.123  -1.945
   32    H    LYS1108           HN       LYS1108  31.462   1.327   0.184
   33    HA   LYS1108           HA       LYS1108  29.151   1.254   1.678
   34   1HB   LYS1108           HB2      LYS1108  30.614   3.666   0.591
   35   2HB   LYS1108           HB1      LYS1108  29.365   3.742   1.827
   36   1HG   LYS1108           HG2      LYS1108  30.776   2.243   3.237
   37   2HG   LYS1108           HG1      LYS1108  32.052   2.407   2.029
   38   1HD   LYS1108           HD2      LYS1108  32.069   4.825   2.364
   39   2HD   LYS1108           HD1      LYS1108  30.777   4.673   3.556
   40   1HE   LYS1108           HE2      LYS1108  33.537   3.478   3.770
   41   2HE   LYS1108           HE1      LYS1108  32.956   4.900   4.635
   42   1HZ   LYS1108           HZ1      LYS1108  31.309   3.514   5.734
   43   2HZ   LYS1108           HZ3      LYS1108  31.871   2.149   4.907
   44   3HZ   LYS1108           HZ2      LYS1108  32.870   2.931   6.025
   45    H    CYS1109           HN       CYS1109  27.081   1.490   1.296
   46    HA   CYS1109           HA       CYS1109  26.202   2.015  -1.413
   47   1HB   CYS1109           HB2      CYS1109  24.414   1.439   0.937
   48   2HB   CYS1109           HB1      CYS1109  24.132   1.094  -0.768
   49    H    GLY1110           HN       GLY1110  24.136   3.348  -1.627
   50   1HA   GLY1110           HA1      GLY1110  24.078   5.829  -1.748
   51   2HA   GLY1110           HA2      GLY1110  24.425   5.816  -0.024
   52    HA   PRO1111           HA       PRO1111  20.051   6.384   0.540
   53   1HB   PRO1111           HB2      PRO1111  18.960   7.698  -1.665
   54   2HB   PRO1111           HB1      PRO1111  19.659   8.476  -0.242
   55   1HG   PRO1111           HG2      PRO1111  20.875   7.962  -2.916
   56   2HG   PRO1111           HG1      PRO1111  21.083   9.351  -1.833
   57   1HD   PRO1111           HD2      PRO1111  22.969   7.454  -2.070
   58   2HD   PRO1111           HD1      PRO1111  22.641   8.250  -0.517
   59    HA   PRO1112           HA       PRO1112  18.825   2.604  -1.586
   60   1HB   PRO1112           HB2      PRO1112  16.549   2.257  -0.058
   61   2HB   PRO1112           HB1      PRO1112  18.159   1.673   0.372
   62   1HG   PRO1112           HG2      PRO1112  16.714   4.112   1.302
   63   2HG   PRO1112           HG1      PRO1112  17.776   3.019   2.207
   64   1HD   PRO1112           HD2      PRO1112  18.614   5.427   1.342
   65   2HD   PRO1112           HD1      PRO1112  19.699   4.026   1.420
   66    HA   PRO1113           HA       PRO1113  15.730   4.806  -4.105
   67   1HB   PRO1113           HB2      PRO1113  16.482   3.818  -6.478
   68   2HB   PRO1113           HB1      PRO1113  17.411   5.093  -5.679
   69   1HG   PRO1113           HG2      PRO1113  17.961   2.162  -5.851
   70   2HG   PRO1113           HG1      PRO1113  19.094   3.522  -5.941
   71   1HD   PRO1113           HD2      PRO1113  18.633   1.981  -3.683
   72   2HD   PRO1113           HD1      PRO1113  19.330   3.611  -3.678
   73    HA   PRO1114           HA       PRO1114  13.358   0.914  -4.197
   74   1HB   PRO1114           HB2      PRO1114  11.398   1.625  -2.592
   75   2HB   PRO1114           HB1      PRO1114  13.022   1.402  -1.932
   76   1HG   PRO1114           HG2      PRO1114  11.539   3.916  -2.514
   77   2HG   PRO1114           HG1      PRO1114  12.705   3.573  -1.224
   78   1HD   PRO1114           HD2      PRO1114  13.206   4.839  -3.738
   79   2HD   PRO1114           HD1      PRO1114  14.392   4.399  -2.494
   80    H    ILE1115           HN       ILE1115  10.620   1.155  -3.935
   81    HA   ILE1115           HA       ILE1115   9.643   1.426  -6.476
   82    HB   ILE1115           HB       ILE1115   7.410   1.956  -5.166
   83   1HG1  ILE1115          2HG1      ILE1115   9.400   1.216  -3.012
   84   2HG1  ILE1115          1HG1      ILE1115   8.355   2.630  -3.071
   85   1HG2  ILE1115          2HG2      ILE1115   8.981  -0.607  -4.989
   86   2HG2  ILE1115          1HG2      ILE1115   7.262  -0.471  -4.611
   87   3HG2  ILE1115          3HG2      ILE1115   7.834  -0.138  -6.246
   88   1HD1  ILE1115          1HD1      ILE1115   7.392  -0.199  -2.737
   89   2HD1  ILE1115          3HD1      ILE1115   7.633   0.957  -1.424
   90   3HD1  ILE1115          2HD1      ILE1115   6.415   1.267  -2.664
   91    H    ASP1116           HN       ASP1116   8.541   3.031  -7.619
   92    HA   ASP1116           HA       ASP1116   9.403   5.717  -7.068
   93   1HB   ASP1116           HB2      ASP1116   9.217   4.691  -9.378
   94   2HB   ASP1116           HB1      ASP1116   7.469   4.826  -9.211
   95    H    ASN1117           HN       ASN1117   7.650   4.524  -5.135
   96    HA   ASN1117           HA       ASN1117   5.814   6.671  -4.789
   97   1HB   ASN1117           HB2      ASN1117   4.808   3.964  -5.610
   98   2HB   ASN1117           HB1      ASN1117   3.844   4.970  -4.534
   99   1HD2  ASN1117          1HD2      ASN1117   4.619   7.467  -5.691
  100   2HD2  ASN1117          2HD2      ASN1117   3.845   7.574  -7.232
  101    H    GLY1118           HN       GLY1118   7.955   4.655  -3.592
  102   1HA   GLY1118           HA1      GLY1118   7.473   3.202  -1.528
  103   2HA   GLY1118           HA2      GLY1118   6.695   4.655  -0.928
  104    H    ASP1119           HN       ASP1119   9.036   3.040  -0.012
  105    HA   ASP1119           HA       ASP1119  11.500   4.152  -0.271
  106   1HB   ASP1119           HB2      ASP1119  10.403   6.345   0.263
  107   2HB   ASP1119           HB1      ASP1119   9.985   5.703   1.848
  108    H    ILE1120           HN       ILE1120  12.784   4.019   2.002
  109    HA   ILE1120           HA       ILE1120  12.367   1.401   2.947
  110    HB   ILE1120           HB       ILE1120  13.991   1.976   4.740
  111   1HG1  ILE1120          2HG1      ILE1120  13.971   4.705   3.432
  112   2HG1  ILE1120          1HG1      ILE1120  13.321   4.334   5.024
  113   1HG2  ILE1120          2HG2      ILE1120  14.751   1.165   2.581
  114   2HG2  ILE1120          1HG2      ILE1120  14.763   2.812   1.949
  115   3HG2  ILE1120          3HG2      ILE1120  15.885   2.352   3.230
  116   1HD1  ILE1120          2HD1      ILE1120  16.199   4.071   4.208
  117   2HD1  ILE1120          1HD1      ILE1120  15.507   5.375   5.173
  118   3HD1  ILE1120          3HD1      ILE1120  15.537   3.730   5.807
  119    H    THR1121           HN       THR1121  12.096   0.920   5.362
  120    HA   THR1121           HA       THR1121   9.696   2.349   6.252
  121    HB   THR1121           HB       THR1121   9.152   0.378   7.560
  122    HG1  THR1121           HG1      THR1121  11.764  -0.129   7.313
  123   1HG2  THR1121          3HG2      THR1121   8.479   0.403   5.199
  124   2HG2  THR1121          2HG2      THR1121  10.003  -0.362   4.753
  125   3HG2  THR1121          1HG2      THR1121   8.834  -1.237   5.742
  126    H    SER1122           HN       SER1122  11.707   3.883   6.841
  127    HA   SER1122           HA       SER1122  11.737   3.957   9.688
  128   1HB   SER1122           HB2      SER1122  13.511   2.274   9.334
  129   2HB   SER1122           HB1      SER1122  14.381   3.416   8.312
  130    HG   SER1122           HG       SER1122  15.213   3.504  10.393
  131    H    PHE1123           HN       PHE1123  14.407   5.060   7.700
  132    HA   PHE1123           HA       PHE1123  13.322   7.666   7.212
  133   1HB   PHE1123           HB2      PHE1123  13.917   7.778   9.637
  134   2HB   PHE1123           HB1      PHE1123  15.588   7.443   9.201
  135    HD1  PHE1123           HD1      PHE1123  17.000   9.131   8.311
  136    HD2  PHE1123           HD2      PHE1123  12.866   9.905   8.956
  137    HE1  PHE1123           HE1      PHE1123  17.401  11.534   7.969
  138    HE2  PHE1123           HE2      PHE1123  13.258  12.309   8.615
  139    HZ   PHE1123           HZ       PHE1123  15.529  13.127   8.121
  140    HA   PRO1124           HA       PRO1124  16.004   6.696   3.712
  141   1HB   PRO1124           HB2      PRO1124  15.680   9.672   3.562
  142   2HB   PRO1124           HB1      PRO1124  15.624   8.472   2.266
  143   1HG   PRO1124           HG2      PRO1124  13.381   9.494   3.301
  144   2HG   PRO1124           HG1      PRO1124  13.478   7.797   2.803
  145   1HD   PRO1124           HD2      PRO1124  13.363   8.956   5.517
  146   2HD   PRO1124           HD1      PRO1124  12.914   7.333   4.962
  147    H    LEU1125           HN       LEU1125  18.135   6.416   3.864
  148    HA   LEU1125           HA       LEU1125  19.712   8.401   5.353
  149   1HB   LEU1125           HB2      LEU1125  20.530   5.553   4.760
  150   2HB   LEU1125           HB1      LEU1125  21.305   6.688   5.849
  151    HG   LEU1125           HG       LEU1125  19.052   6.633   7.144
  152   1HD1  LEU1125          2HD1      LEU1125  17.811   5.399   5.403
  153   2HD1  LEU1125          1HD1      LEU1125  18.884   4.019   5.652
  154   3HD1  LEU1125          3HD1      LEU1125  17.824   4.555   6.954
  155   1HD2  LEU1125          1HD2      LEU1125  21.165   5.771   8.001
  156   2HD2  LEU1125          3HD2      LEU1125  19.827   4.706   8.433
  157   3HD2  LEU1125          2HD2      LEU1125  20.917   4.263   7.120
  158    H    SER1126           HN       SER1126  21.603   9.205   4.472
  159    HA   SER1126           HA       SER1126  21.721   9.116   1.581
  160   1HB   SER1126           HB2      SER1126  23.428  10.881   1.815
  161   2HB   SER1126           HB1      SER1126  21.960  11.273   2.708
  162    HG   SER1126           HG       SER1126  24.200  11.464   3.741
  163    H    VAL1127           HN       VAL1127  23.855   8.345   4.309
  164    HA   VAL1127           HA       VAL1127  25.575   6.857   2.446
  165    HB   VAL1127           HB       VAL1127  26.803   8.524   3.718
  166   1HG1  VAL1127          2HG1      VAL1127  25.325   8.694   5.651
  167   2HG1  VAL1127          1HG1      VAL1127  25.820   7.085   6.180
  168   3HG1  VAL1127          3HG1      VAL1127  26.991   8.403   6.152
  169   1HG2  VAL1127          1HG2      VAL1127  27.942   6.443   3.160
  170   2HG2  VAL1127          3HG2      VAL1127  28.512   7.071   4.707
  171   3HG2  VAL1127          2HG2      VAL1127  27.381   5.718   4.666
  172    H    TYR1128           HN       TYR1128  25.382   4.744   2.421
  173    HA   TYR1128           HA       TYR1128  24.257   3.398   4.785
  174   1HB   TYR1128           HB2      TYR1128  23.480   3.332   2.022
  175   2HB   TYR1128           HB1      TYR1128  23.992   1.724   2.525
  176    HD1  TYR1128           HD1      TYR1128  21.321   4.031   2.463
  177    HD2  TYR1128           HD2      TYR1128  22.957   0.837   4.745
  178    HE1  TYR1128           HE1      TYR1128  19.132   3.676   3.520
  179    HE2  TYR1128           HE2      TYR1128  20.771   0.469   5.810
  180    HH   TYR1128           HH       TYR1128  18.711   1.729   6.269
  181    H    ALA1129           HN       ALA1129  24.928   1.177   5.107
  182    HA   ALA1129           HA       ALA1129  27.782   0.885   4.658
  183   1HB   ALA1129           HB1      ALA1129  26.901   0.495   6.902
  184   2HB   ALA1129           HB2      ALA1129  27.634  -0.969   6.247
  185   3HB   ALA1129           HB3      ALA1129  25.880  -0.802   6.283
  186    HA   PRO1130           HA       PRO1130  27.504  -1.846   1.212
  187   1HB   PRO1130           HB2      PRO1130  29.694  -3.396   2.452
  188   2HB   PRO1130           HB1      PRO1130  29.632  -2.595   0.880
  189   1HG   PRO1130           HG2      PRO1130  31.077  -1.611   2.927
  190   2HG   PRO1130           HG1      PRO1130  30.281  -0.560   1.742
  191   1HD   PRO1130           HD2      PRO1130  29.496  -1.181   4.550
  192   2HD   PRO1130           HD1      PRO1130  29.305   0.319   3.624
  193    H    ALA1131           HN       ALA1131  26.454  -3.683   0.707
  194    HA   ALA1131           HA       ALA1131  25.300  -5.625   0.910
  195   1HB   ALA1131           HB3      ALA1131  27.491  -6.546   1.497
  196   2HB   ALA1131           HB1      ALA1131  26.184  -7.365   2.355
  197   3HB   ALA1131           HB2      ALA1131  27.185  -6.180   3.195
  198    H    SER1132           HN       SER1132  24.691  -3.167   2.677
  199    HA   SER1132           HA       SER1132  23.385  -4.320   4.974
  200   1HB   SER1132           HB2      SER1132  23.370  -1.539   3.799
  201   2HB   SER1132           HB1      SER1132  22.428  -1.983   5.223
  202    HG   SER1132           HG       SER1132  25.066  -2.744   5.328
  203    H    SER1133           HN       SER1133  21.106  -4.278   5.375
  204    HA   SER1133           HA       SER1133  19.455  -4.241   2.938
  205   1HB   SER1133           HB2      SER1133  18.835  -6.180   5.133
  206   2HB   SER1133           HB1      SER1133  18.464  -6.277   3.414
  207    HG   SER1133           HG       SER1133  21.058  -6.517   4.537
  208    H    VAL1134           HN       VAL1134  17.184  -3.855   3.296
  209    HA   VAL1134           HA       VAL1134  16.315  -2.962   5.899
  210    HB   VAL1134           HB       VAL1134  17.437  -0.953   5.123
  211   1HG1  VAL1134          2HG1      VAL1134  15.606  -1.147   2.747
  212   2HG1  VAL1134          1HG1      VAL1134  16.570   0.275   3.148
  213   3HG1  VAL1134          3HG1      VAL1134  17.368  -1.246   2.744
  214   1HG2  VAL1134          1HG2      VAL1134  14.450  -0.669   5.062
  215   2HG2  VAL1134          3HG2      VAL1134  15.476  -0.656   6.497
  216   3HG2  VAL1134          2HG2      VAL1134  15.599   0.645   5.312
  217    H    GLU1135           HN       GLU1135  14.062  -2.166   5.817
  218    HA   GLU1135           HA       GLU1135  12.527  -3.848   3.981
  219   1HB   GLU1135           HB2      GLU1135  11.738  -2.458   6.546
  220   2HB   GLU1135           HB1      GLU1135  10.677  -3.469   5.584
  221   1HG   GLU1135           HG2      GLU1135  12.091  -5.394   5.987
  222   2HG   GLU1135           HG1      GLU1135  13.221  -4.389   6.894
  223    H    TYR1136           HN       TYR1136  11.119  -3.037   2.516
  224    HA   TYR1136           HA       TYR1136  11.040  -0.121   2.244
  225   1HB   TYR1136           HB2      TYR1136  10.627  -2.394   0.336
  226   2HB   TYR1136           HB1      TYR1136   9.965  -0.808  -0.034
  227    HD1  TYR1136           HD1      TYR1136  11.868  -2.092  -1.818
  228    HD2  TYR1136           HD2      TYR1136  12.586   0.376   1.568
  229    HE1  TYR1136           HE1      TYR1136  14.011  -1.407  -2.789
  230    HE2  TYR1136           HE2      TYR1136  14.743   1.068   0.611
  231    HH   TYR1136           HH       TYR1136  15.603   0.460  -2.616
  232    H    GLN1137           HN       GLN1137   8.972   0.770   1.329
  233    HA   GLN1137           HA       GLN1137   6.505  -0.550   1.825
  234   1HB   GLN1137           HB2      GLN1137   7.135  -0.115   4.160
  235   2HB   GLN1137           HB1      GLN1137   7.319   1.595   3.796
  236   1HG   GLN1137           HG2      GLN1137   4.943   1.744   3.265
  237   2HG   GLN1137           HG1      GLN1137   4.755   0.027   3.619
  238   1HE2  GLN1137          1HE2      GLN1137   6.848   2.131   5.450
  239   2HE2  GLN1137          2HE2      GLN1137   5.911   2.124   6.902
  240    H    CYS1138           HN       CYS1138   4.930   0.399   0.686
  241    HA   CYS1138           HA       CYS1138   5.588   2.707  -0.896
  242   1HB   CYS1138           HB2      CYS1138   3.974   0.515  -1.269
  243   2HB   CYS1138           HB1      CYS1138   2.800   1.786  -0.951
  244    H    GLN1139           HN       GLN1139   4.908   4.765  -0.639
  245    HA   GLN1139           HA       GLN1139   3.622   5.451   1.869
  246   1HB   GLN1139           HB2      GLN1139   4.508   7.373  -0.274
  247   2HB   GLN1139           HB1      GLN1139   4.307   7.680   1.445
  248   1HG   GLN1139           HG2      GLN1139   6.209   6.224   1.927
  249   2HG   GLN1139           HG1      GLN1139   6.410   5.927   0.201
  250   1HE2  GLN1139          1HE2      GLN1139   5.727   8.681  -0.501
  251   2HE2  GLN1139          2HE2      GLN1139   7.110   9.633  -0.095
  252    H    ASN1140           HN       ASN1140   2.312   7.764   1.287
  253    HA   ASN1140           HA       ASN1140   0.187   8.463   0.864
  254   1HB   ASN1140           HB2      ASN1140   1.537   8.624  -1.346
  255   2HB   ASN1140           HB1      ASN1140   0.509   7.296  -1.879
  256   1HD2  ASN1140          1HD2      ASN1140  -1.759   8.274  -0.269
  257   2HD2  ASN1140          2HD2      ASN1140  -2.394   9.622  -1.140
  258    H    LEU1141           HN       LEU1141   0.034   6.126   2.208
  259    HA   LEU1141           HA       LEU1141  -1.518   4.570   2.811
  260   1HB   LEU1141           HB2      LEU1141  -3.035   5.381   0.334
  261   2HB   LEU1141           HB1      LEU1141  -3.661   4.466   1.691
  262    HG   LEU1141           HG       LEU1141  -2.666   7.302   1.943
  263   1HD1  LEU1141          2HD1      LEU1141  -5.487   6.321   1.519
  264   2HD1  LEU1141          1HD1      LEU1141  -5.018   7.977   1.903
  265   3HD1  LEU1141          3HD1      LEU1141  -4.525   7.253   0.371
  266   1HD2  LEU1141          2HD2      LEU1141  -2.726   5.992   4.009
  267   2HD2  LEU1141          1HD2      LEU1141  -3.939   7.273   4.016
  268   3HD2  LEU1141          3HD2      LEU1141  -4.422   5.606   3.712
  269    H    TYR1142           HN       TYR1142  -0.220   4.578  -0.412
  270    HA   TYR1142           HA       TYR1142  -1.013   2.148  -1.423
  271   1HB   TYR1142           HB2      TYR1142   1.657   3.542  -1.614
  272   2HB   TYR1142           HB1      TYR1142   1.290   2.071  -2.507
  273    HD1  TYR1142           HD1      TYR1142  -0.401   2.092  -4.297
  274    HD2  TYR1142           HD2      TYR1142   0.765   5.657  -2.287
  275    HE1  TYR1142           HE1      TYR1142  -1.400   3.431  -6.103
  276    HE2  TYR1142           HE2      TYR1142  -0.231   7.005  -4.087
  277    HH   TYR1142           HH       TYR1142  -0.832   6.757  -6.458
  278    H    GLN1143           HN       GLN1143  -0.400   0.036  -1.211
  279    HA   GLN1143           HA       GLN1143   1.486  -0.587   0.969
  280   1HB   GLN1143           HB2      GLN1143  -1.082  -0.977   1.344
  281   2HB   GLN1143           HB1      GLN1143  -0.825  -2.391   0.331
  282   1HG   GLN1143           HG2      GLN1143   0.572  -1.780   2.926
  283   2HG   GLN1143           HG1      GLN1143  -0.700  -2.974   2.676
  284   1HE2  GLN1143          1HE2      GLN1143  -0.231  -4.877   1.577
  285   2HE2  GLN1143          2HE2      GLN1143   1.391  -5.417   1.330
  286    H    LEU1144           HN       LEU1144   3.251  -1.241  -0.120
  287    HA   LEU1144           HA       LEU1144   3.134  -2.537  -2.636
  288   1HB   LEU1144           HB2      LEU1144   5.285  -2.017  -2.737
  289   2HB   LEU1144           HB1      LEU1144   5.092  -1.254  -1.171
  290    HG   LEU1144           HG       LEU1144   5.876  -4.149  -1.458
  291   1HD1  LEU1144          3HD1      LEU1144   7.680  -1.744  -1.267
  292   2HD1  LEU1144          2HD1      LEU1144   8.193  -3.427  -1.156
  293   3HD1  LEU1144          1HD1      LEU1144   7.509  -2.811  -2.661
  294   1HD2  LEU1144          1HD2      LEU1144   5.035  -3.461   0.730
  295   2HD2  LEU1144          3HD2      LEU1144   6.757  -3.838   0.792
  296   3HD2  LEU1144          2HD2      LEU1144   6.220  -2.156   0.777
  297    H    GLU1145           HN       GLU1145   3.233  -4.602  -3.225
  298    HA   GLU1145           HA       GLU1145   3.002  -6.610  -1.105
  299   1HB   GLU1145           HB2      GLU1145   1.184  -6.508  -2.772
  300   2HB   GLU1145           HB1      GLU1145   2.351  -6.806  -4.053
  301   1HG   GLU1145           HG2      GLU1145   2.846  -8.996  -3.093
  302   2HG   GLU1145           HG1      GLU1145   1.677  -8.695  -1.809
  303    H    GLY1146           HN       GLY1146   4.217  -8.537  -1.184
  304   1HA   GLY1146           HA1      GLY1146   6.506  -8.553  -3.030
  305   2HA   GLY1146           HA2      GLY1146   5.901  -9.942  -2.139
  306    H    ASN1147           HN       ASN1147   8.575  -9.430  -2.118
  307    HA   ASN1147           HA       ASN1147   9.026  -8.967   0.698
  308   1HB   ASN1147           HB2      ASN1147  11.411  -9.582   0.093
  309   2HB   ASN1147           HB1      ASN1147  10.200 -10.823  -0.215
  310   1HD2  ASN1147          1HD2      ASN1147  12.468  -8.626  -1.605
  311   2HD2  ASN1147          2HD2      ASN1147  12.353  -9.205  -3.230
  312    H    LYS1148           HN       LYS1148   8.780  -6.801   1.090
  313    HA   LYS1148           HA       LYS1148   9.886  -4.747  -0.511
  314   1HB   LYS1148           HB2      LYS1148   9.519  -3.369   1.641
  315   2HB   LYS1148           HB1      LYS1148   8.123  -4.045   0.814
  316   1HG   LYS1148           HG2      LYS1148   7.767  -4.418   3.107
  317   2HG   LYS1148           HG1      LYS1148   8.252  -5.976   2.437
  318   1HD   LYS1148           HD2      LYS1148  10.528  -5.624   3.248
  319   2HD   LYS1148           HD1      LYS1148  10.061  -4.052   3.901
  320   1HE   LYS1148           HE2      LYS1148   8.940  -6.725   4.741
  321   2HE   LYS1148           HE1      LYS1148  10.112  -5.766   5.643
  322   1HZ   LYS1148           HZ3      LYS1148   7.340  -4.932   4.987
  323   2HZ   LYS1148           HZ2      LYS1148   7.879  -5.461   6.500
  324   3HZ   LYS1148           HZ1      LYS1148   8.465  -4.012   5.854
  325    H    ARG1149           HN       ARG1149  11.223  -6.810   1.876
  326    HA   ARG1149           HA       ARG1149  13.403  -5.123   2.640
  327   1HB   ARG1149           HB2      ARG1149  12.722  -6.873   4.146
  328   2HB   ARG1149           HB1      ARG1149  12.966  -8.101   2.911
  329   1HG   ARG1149           HG2      ARG1149  15.371  -7.647   2.945
  330   2HG   ARG1149           HG1      ARG1149  15.117  -6.427   4.194
  331   1HD   ARG1149           HD2      ARG1149  14.217  -8.144   5.687
  332   2HD   ARG1149           HD1      ARG1149  14.470  -9.363   4.438
  333    HE   ARG1149           HE       ARG1149  16.904  -8.064   4.943
  334   1HH1  ARG1149          1HH1      ARG1149  14.667 -10.245   6.487
  335   2HH1  ARG1149          2HH1      ARG1149  15.883 -11.013   7.453
  336   1HH2  ARG1149          1HH2      ARG1149  18.510  -9.068   6.210
  337   2HH2  ARG1149          2HH2      ARG1149  18.067 -10.343   7.296
  338    H    ILE1150           HN       ILE1150  15.147  -4.658   1.487
  339    HA   ILE1150           HA       ILE1150  16.061  -6.585  -0.538
  340    HB   ILE1150           HB       ILE1150  16.436  -4.936  -2.160
  341   1HG1  ILE1150          2HG1      ILE1150  17.450  -3.190  -0.857
  342   2HG1  ILE1150          1HG1      ILE1150  16.082  -2.494  -1.717
  343   1HG2  ILE1150          1HG2      ILE1150  13.830  -4.255  -0.809
  344   2HG2  ILE1150          3HG2      ILE1150  14.254  -3.861  -2.474
  345   3HG2  ILE1150          2HG2      ILE1150  14.098  -5.546  -1.979
  346   1HD1  ILE1150          1HD1      ILE1150  14.745  -2.628   0.329
  347   2HD1  ILE1150          3HD1      ILE1150  16.141  -3.285   1.184
  348   3HD1  ILE1150          2HD1      ILE1150  16.195  -1.645   0.536
  349    H    THR1151           HN       THR1151  18.293  -5.248  -1.426
  350    HA   THR1151           HA       THR1151  19.924  -4.456   0.819
  351    HB   THR1151           HB       THR1151  20.490  -7.046  -0.637
  352    HG1  THR1151           HG1      THR1151  19.777  -7.974   1.136
  353   1HG2  THR1151          1HG2      THR1151  22.539  -5.737  -0.275
  354   2HG2  THR1151          3HG2      THR1151  22.154  -5.623   1.442
  355   3HG2  THR1151          2HG2      THR1151  22.507  -7.193   0.719
  356    H    CYS1152           HN       CYS1152  21.685  -3.266   0.185
  357    HA   CYS1152           HA       CYS1152  21.777  -2.458  -2.570
  358   1HB   CYS1152           HB2      CYS1152  23.633  -0.971  -1.799
  359   2HB   CYS1152           HB1      CYS1152  22.129  -0.761  -0.912
  360    H    ARG1153           HN       ARG1153  23.125  -3.087  -4.112
  361    HA   ARG1153           HA       ARG1153  25.274  -4.953  -3.373
  362   1HB   ARG1153           HB2      ARG1153  25.080  -5.646  -5.831
  363   2HB   ARG1153           HB1      ARG1153  23.798  -6.148  -4.739
  364   1HG   ARG1153           HG2      ARG1153  23.490  -3.622  -6.289
  365   2HG   ARG1153           HG1      ARG1153  23.223  -5.176  -7.083
  366   1HD   ARG1153           HD2      ARG1153  21.823  -4.163  -4.608
  367   2HD   ARG1153           HD1      ARG1153  21.129  -4.287  -6.225
  368    HE   ARG1153           HE       ARG1153  22.080  -6.811  -5.435
  369   1HH1  ARG1153          1HH1      ARG1153  19.538  -4.548  -4.679
  370   2HH1  ARG1153          2HH1      ARG1153  18.433  -5.773  -4.149
  371   1HH2  ARG1153          1HH2      ARG1153  20.631  -8.426  -4.740
  372   2HH2  ARG1153          2HH2      ARG1153  19.054  -7.974  -4.183
  373    H    ASN1154           HN       ASN1154  27.145  -3.920  -3.309
  374    HA   ASN1154           HA       ASN1154  28.902  -2.580  -3.844
  375   1HB   ASN1154           HB2      ASN1154  27.803  -2.922  -6.645
  376   2HB   ASN1154           HB1      ASN1154  29.408  -2.314  -6.249
  377   1HD2  ASN1154          1HD2      ASN1154  27.340  -5.100  -6.349
  378   2HD2  ASN1154          2HD2      ASN1154  28.583  -6.283  -6.147
  379    H    GLY1155           HN       GLY1155  27.122  -1.108  -2.700
  380   1HA   GLY1155           HA1      GLY1155  27.470   1.479  -3.651
  381   2HA   GLY1155           HA2      GLY1155  26.263   1.003  -2.469
  382    H    GLN1156           HN       GLN1156  24.508  -0.506  -3.799
  383    HA   GLN1156           HA       GLN1156  23.035   1.369  -5.318
  384   1HB   GLN1156           HB2      GLN1156  24.632   0.851  -7.071
  385   2HB   GLN1156           HB1      GLN1156  24.355  -0.872  -6.858
  386   1HG   GLN1156           HG2      GLN1156  22.044  -0.588  -7.613
  387   2HG   GLN1156           HG1      GLN1156  22.334   1.137  -7.835
  388   1HE2  GLN1156          1HE2      GLN1156  24.715  -1.305  -8.559
  389   2HE2  GLN1156          2HE2      GLN1156  24.680  -1.112 -10.276
  390    H    TRP1157           HN       TRP1157  21.216   0.855  -4.195
  391    HA   TRP1157           HA       TRP1157  20.443  -1.846  -3.625
  392   1HB   TRP1157           HB2      TRP1157  18.790   0.681  -3.477
  393   2HB   TRP1157           HB1      TRP1157  18.376  -0.866  -2.757
  394    HD1  TRP1157           HD1      TRP1157  21.007   1.934  -2.377
  395    HE1  TRP1157           HE1      TRP1157  21.754   1.977   0.086
  396    HE3  TRP1157           HE3      TRP1157  18.476  -2.164  -0.710
  397    HZ2  TRP1157           HZ2      TRP1157  21.331   0.438   2.432
  398    HZ3  TRP1157           HZ3      TRP1157  18.697  -2.823   1.645
  399    HH2  TRP1157           HH2      TRP1157  20.095  -1.553   3.181
  400    H    SER1158           HN       SER1158  18.134  -2.529  -4.184
  401    HA   SER1158           HA       SER1158  17.588  -1.938  -7.018
  402   1HB   SER1158           HB2      SER1158  17.088  -4.531  -5.543
  403   2HB   SER1158           HB1      SER1158  16.709  -4.221  -7.234
  404    HG   SER1158           HG       SER1158  19.117  -3.646  -7.264
  405    H    GLU1159           HN       GLU1159  15.235  -2.558  -7.584
  406    HA   GLU1159           HA       GLU1159  13.516  -1.106  -5.738
  407   1HB   GLU1159           HB2      GLU1159  13.502  -0.543  -8.139
  408   2HB   GLU1159           HB1      GLU1159  12.970  -2.175  -8.516
  409   1HG   GLU1159           HG2      GLU1159  10.894  -1.786  -7.294
  410   2HG   GLU1159           HG1      GLU1159  11.429  -0.150  -6.909
  411    HA   PRO1160           HA       PRO1160  11.693  -4.816  -4.107
  412   1HB   PRO1160           HB2      PRO1160   9.392  -3.815  -3.109
  413   2HB   PRO1160           HB1      PRO1160  10.963  -3.492  -2.364
  414   1HG   PRO1160           HG2      PRO1160   9.367  -1.779  -4.236
  415   2HG   PRO1160           HG1      PRO1160  10.189  -1.322  -2.733
  416   1HD   PRO1160           HD2      PRO1160  11.275  -0.868  -5.167
  417   2HD   PRO1160           HD1      PRO1160  12.263  -1.248  -3.742
  418    HA   PRO1161           HA       PRO1161   8.800  -6.852  -6.741
  419   1HB   PRO1161           HB2      PRO1161   6.752  -6.634  -4.573
  420   2HB   PRO1161           HB1      PRO1161   7.194  -8.029  -5.563
  421   1HG   PRO1161           HG2      PRO1161   8.088  -7.811  -3.069
  422   2HG   PRO1161           HG1      PRO1161   9.137  -8.433  -4.355
  423   1HD   PRO1161           HD2      PRO1161   9.178  -5.793  -2.988
  424   2HD   PRO1161           HD1      PRO1161  10.515  -6.722  -3.695
  425    H    LYS1162           HN       LYS1162   6.296  -5.053  -4.936
  426    HA   LYS1162           HA       LYS1162   6.050  -2.971  -6.853
  427   1HB   LYS1162           HB2      LYS1162   4.067  -3.665  -8.025
  428   2HB   LYS1162           HB1      LYS1162   5.308  -4.893  -8.227
  429   1HG   LYS1162           HG2      LYS1162   4.233  -6.226  -6.450
  430   2HG   LYS1162           HG1      LYS1162   2.949  -5.019  -6.364
  431   1HD   LYS1162           HD2      LYS1162   3.677  -6.610  -8.823
  432   2HD   LYS1162           HD1      LYS1162   2.326  -6.967  -7.744
  433   1HE   LYS1162           HE2      LYS1162   2.693  -4.433  -9.339
  434   2HE   LYS1162           HE1      LYS1162   1.589  -5.750  -9.733
  435   1HZ   LYS1162           HZ3      LYS1162   1.469  -4.089  -7.274
  436   2HZ   LYS1162           HZ2      LYS1162   0.458  -3.922  -8.619
  437   3HZ   LYS1162           HZ1      LYS1162   0.395  -5.330  -7.686
  438    H    CYS1163           HN       CYS1163   3.733  -1.949  -6.686
  439    HA   CYS1163           HA       CYS1163   2.969  -1.983  -3.842
  440   1HB   CYS1163           HB2      CYS1163   2.997   0.269  -5.849
  441   2HB   CYS1163           HB1      CYS1163   2.142   0.377  -4.314
  442    H    LEU1164           HN       LEU1164   0.721  -1.481  -3.364
  443    HA   LEU1164           HA       LEU1164  -1.113  -2.220  -5.547
  444   1HB   LEU1164           HB2      LEU1164  -1.556  -2.967  -2.667
  445   2HB   LEU1164           HB1      LEU1164  -2.420  -3.547  -4.076
  446    HG   LEU1164           HG       LEU1164   0.429  -4.212  -3.343
  447   1HD1  LEU1164          3HD1      LEU1164  -2.075  -5.884  -3.331
  448   2HD1  LEU1164          2HD1      LEU1164  -0.445  -6.469  -3.002
  449   3HD1  LEU1164          1HD1      LEU1164  -1.200  -5.306  -1.914
  450   1HD2  LEU1164          1HD2      LEU1164   0.136  -4.099  -5.765
  451   2HD2  LEU1164          3HD2      LEU1164   0.352  -5.764  -5.227
  452   3HD2  LEU1164          2HD2      LEU1164  -1.255  -5.176  -5.651
  453    H    HIS1165           HN       HIS1165  -2.565  -0.691  -5.950
  454    HA   HIS1165           HA       HIS1165  -2.818   1.710  -4.649
  455   1HB   HIS1165           HB2      HIS1165  -4.982   0.219  -6.151
  456   2HB   HIS1165           HB1      HIS1165  -5.027   1.934  -5.753
  457    HD1  HIS1165           HD1      HIS1165  -3.829   3.512  -7.305
  458    HD2  HIS1165           HD2      HIS1165  -2.973  -0.477  -8.093
  459    HE1  HIS1165           HE1      HIS1165  -2.547   3.514  -9.468
  460    HE2  HIS1165           HE2      HIS1165  -1.967   1.097  -9.882
  461    HA   PRO1166           HA       PRO1166  -4.566   0.668  -0.714
  462   1HB   PRO1166           HB2      PRO1166  -5.520   3.472  -0.742
  463   2HB   PRO1166           HB1      PRO1166  -4.492   2.642   0.430
  464   1HG   PRO1166           HG2      PRO1166  -3.477   4.431  -1.274
  465   2HG   PRO1166           HG1      PRO1166  -2.574   2.974  -0.820
  466   1HD   PRO1166           HD2      PRO1166  -4.092   3.560  -3.328
  467   2HD   PRO1166           HD1      PRO1166  -2.542   2.718  -3.117
  468    H    CYS1167           HN       CYS1167  -6.719   1.654   0.471
  469    HA   CYS1167           HA       CYS1167  -8.883   0.427  -0.973
  470   1HB   CYS1167           HB2      CYS1167  -8.300   0.476   1.615
  471   2HB   CYS1167           HB1      CYS1167  -9.291   1.928   1.576
  472    H    VAL1168           HN       VAL1168  -7.976   2.674  -2.334
  473    HA   VAL1168           HA       VAL1168  -9.578   4.969  -1.744
  474    HB   VAL1168           HB       VAL1168  -8.064   4.268  -4.264
  475   1HG1  VAL1168          1HG1      VAL1168  -9.818   5.907  -4.688
  476   2HG1  VAL1168          3HG1      VAL1168  -9.226   6.900  -3.356
  477   3HG1  VAL1168          2HG1      VAL1168  -8.224   6.655  -4.787
  478   1HG2  VAL1168          2HG2      VAL1168  -7.299   6.003  -1.918
  479   2HG2  VAL1168          1HG2      VAL1168  -6.607   4.433  -2.324
  480   3HG2  VAL1168          3HG2      VAL1168  -6.363   5.810  -3.399
  481    H    ILE1169           HN       ILE1169 -11.712   4.176  -1.659
  482    HA   ILE1169           HA       ILE1169 -12.815   3.305  -4.246
  483    HB   ILE1169           HB       ILE1169 -13.061   1.928  -2.027
  484   1HG1  ILE1169          2HG1      ILE1169 -15.418   2.445  -3.851
  485   2HG1  ILE1169          1HG1      ILE1169 -14.074   1.359  -4.199
  486   1HG2  ILE1169          3HG2      ILE1169 -13.954   3.768  -0.699
  487   2HG2  ILE1169          2HG2      ILE1169 -15.352   3.864  -1.769
  488   3HG2  ILE1169          1HG2      ILE1169 -15.090   2.422  -0.789
  489   1HD1  ILE1169          3HD1      ILE1169 -15.981   1.057  -1.893
  490   2HD1  ILE1169          2HD1      ILE1169 -16.081   0.179  -3.422
  491   3HD1  ILE1169          1HD1      ILE1169 -14.697  -0.060  -2.354
  492    H    SER1170           HN       SER1170 -15.463   3.896  -3.926
  493    HA   SER1170           HA       SER1170 -15.390   6.807  -4.158
  494   1HB   SER1170           HB2      SER1170 -17.561   4.831  -4.885
  495   2HB   SER1170           HB1      SER1170 -17.617   6.565  -5.201
  496    HG   SER1170           HG       SER1170 -15.406   5.945  -6.247
  497    H    ARG1171           HN       ARG1171 -16.677   8.223  -3.039
  498    HA   ARG1171           HA       ARG1171 -17.860   7.212  -0.539
  499   1HB   ARG1171           HB2      ARG1171 -17.678   9.535   0.247
  500   2HB   ARG1171           HB1      ARG1171 -16.121   8.911  -0.280
  501   1HG   ARG1171           HG2      ARG1171 -15.960  10.365  -1.996
  502   2HG   ARG1171           HG1      ARG1171 -17.696  10.356  -2.311
  503   1HD   ARG1171           HD2      ARG1171 -16.963  12.536  -1.507
  504   2HD   ARG1171           HD1      ARG1171 -18.065  11.775  -0.362
  505    HE   ARG1171           HE       ARG1171 -15.446  11.144   0.384
  506   1HH1  ARG1171          1HH1      ARG1171 -17.559  13.907   0.191
  507   2HH1  ARG1171          2HH1      ARG1171 -16.791  14.749   1.494
  508   1HH2  ARG1171          1HH2      ARG1171 -14.426  12.248   2.104
  509   2HH2  ARG1171          2HH2      ARG1171 -15.011  13.807   2.581
  510    H    GLU1172           HN       GLU1172 -18.504   9.351  -3.289
  511    HA   GLU1172           HA       GLU1172 -21.197   9.900  -2.478
  512   1HB   GLU1172           HB2      GLU1172 -19.835  10.310  -5.148
  513   2HB   GLU1172           HB1      GLU1172 -21.405  10.960  -4.697
  514   1HG   GLU1172           HG2      GLU1172 -20.357  12.278  -2.930
  515   2HG   GLU1172           HG1      GLU1172 -18.781  11.625  -3.381
  516    H    ILE1173           HN       ILE1173 -20.020   7.085  -3.175
  517    HA   ILE1173           HA       ILE1173 -22.358   6.236  -4.739
  518    HB   ILE1173           HB       ILE1173 -19.605   5.010  -4.912
  519   1HG1  ILE1173          2HG1      ILE1173 -19.800   7.291  -5.904
  520   2HG1  ILE1173          1HG1      ILE1173 -19.416   6.040  -7.083
  521   1HG2  ILE1173          2HG2      ILE1173 -21.394   3.401  -5.286
  522   2HG2  ILE1173          1HG2      ILE1173 -22.116   4.468  -6.490
  523   3HG2  ILE1173          3HG2      ILE1173 -20.537   3.743  -6.789
  524   1HD1  ILE1173          1HD1      ILE1173 -21.767   6.005  -7.778
  525   2HD1  ILE1173          3HD1      ILE1173 -22.118   7.283  -6.614
  526   3HD1  ILE1173          2HD1      ILE1173 -21.037   7.599  -7.972
  527    H    MET1174           HN       MET1174 -20.476   5.884  -1.920
  528    HA   MET1174           HA       MET1174 -21.865   3.377  -1.259
  529   1HB   MET1174           HB2      MET1174 -20.009   2.649  -0.238
  530   2HB   MET1174           HB1      MET1174 -19.169   3.982  -1.017
  531   1HG   MET1174           HG2      MET1174 -18.552   4.178   1.201
  532   2HG   MET1174           HG1      MET1174 -19.860   5.349   1.042
  533   1HE   MET1174           HE1      MET1174 -20.245   5.494   3.635
  534   2HE   MET1174           HE3      MET1174 -20.423   4.086   4.681
  535   3HE   MET1174           HE2      MET1174 -18.886   4.395   3.874
  536    H    GLU1175           HN       GLU1175 -21.072   6.616  -0.185
  537    HA   GLU1175           HA       GLU1175 -22.817   6.401   2.121
  538   1HB   GLU1175           HB2      GLU1175 -21.803   8.305   2.903
  539   2HB   GLU1175           HB1      GLU1175 -20.532   7.774   1.804
  540   1HG   GLU1175           HG2      GLU1175 -21.396   9.289   0.086
  541   2HG   GLU1175           HG1      GLU1175 -22.648   9.834   1.201
  542    H    ASN1176           HN       ASN1176 -23.377   6.583  -1.015
  543    HA   ASN1176           HA       ASN1176 -25.698   8.368  -0.742
  544   1HB   ASN1176           HB2      ASN1176 -23.632   8.146  -2.862
  545   2HB   ASN1176           HB1      ASN1176 -25.283   8.433  -3.379
  546   1HD2  ASN1176          1HD2      ASN1176 -22.540   9.704  -1.711
  547   2HD2  ASN1176          2HD2      ASN1176 -23.102  11.331  -1.588
  548    H    TYR1177           HN       TYR1177 -24.381   5.422  -2.182
  549    HA   TYR1177           HA       TYR1177 -26.786   4.652  -3.514
  550   1HB   TYR1177           HB2      TYR1177 -24.188   3.320  -2.902
  551   2HB   TYR1177           HB1      TYR1177 -25.552   2.320  -3.385
  552    HD1  TYR1177           HD1      TYR1177 -25.223   5.699  -4.748
  553    HD2  TYR1177           HD2      TYR1177 -24.363   1.579  -5.373
  554    HE1  TYR1177           HE1      TYR1177 -24.726   6.166  -7.108
  555    HE2  TYR1177           HE2      TYR1177 -23.862   2.032  -7.734
  556    HH   TYR1177           HH       TYR1177 -24.409   3.723  -9.442
  557    H    ASN1178           HN       ASN1178 -27.141   5.292  -0.694
  558    HA   ASN1178           HA       ASN1178 -28.389   4.590   1.045
  559   1HB   ASN1178           HB2      ASN1178 -29.173   1.982  -0.082
  560   2HB   ASN1178           HB1      ASN1178 -30.172   3.273   0.575
  561   1HD2  ASN1178          1HD2      ASN1178 -30.259   1.568  -1.897
  562   2HD2  ASN1178          2HD2      ASN1178 -30.481   2.695  -3.186
  563    H    ILE1179           HN       ILE1179 -25.552   3.425   0.374
  564    HA   ILE1179           HA       ILE1179 -25.700   1.199   2.284
  565    HB   ILE1179           HB       ILE1179 -23.143   1.073   1.395
  566   1HG1  ILE1179          2HG1      ILE1179 -24.806   1.933  -0.985
  567   2HG1  ILE1179          1HG1      ILE1179 -23.535   2.897  -0.241
  568   1HG2  ILE1179          3HG2      ILE1179 -24.709  -0.776   1.560
  569   2HG2  ILE1179          2HG2      ILE1179 -25.569  -0.198   0.133
  570   3HG2  ILE1179          1HG2      ILE1179 -23.912  -0.783  -0.014
  571   1HD1  ILE1179          1HD1      ILE1179 -23.159   0.225  -1.569
  572   2HD1  ILE1179          3HD1      ILE1179 -22.757   1.794  -2.263
  573   3HD1  ILE1179          2HD1      ILE1179 -21.889   1.211  -0.843
  574    H    ALA1180           HN       ALA1180 -23.702   0.984   3.679
  575    HA   ALA1180           HA       ALA1180 -22.660   3.566   4.569
  576   1HB   ALA1180           HB1      ALA1180 -24.605   3.137   5.965
  577   2HB   ALA1180           HB3      ALA1180 -23.984   1.533   6.372
  578   3HB   ALA1180           HB2      ALA1180 -23.125   2.977   6.915
  579    H    LEU1181           HN       LEU1181 -21.480   2.375   6.937
  580    HA   LEU1181           HA       LEU1181 -19.774   0.241   5.976
  581   1HB   LEU1181           HB2      LEU1181 -18.899   2.682   5.369
  582   2HB   LEU1181           HB1      LEU1181 -18.317   2.613   7.021
  583    HG   LEU1181           HG       LEU1181 -17.595   0.181   5.712
  584   1HD1  LEU1181          1HD1      LEU1181 -16.888   2.695   4.208
  585   2HD1  LEU1181          3HD1      LEU1181 -16.090   1.137   3.988
  586   3HD1  LEU1181          2HD1      LEU1181 -17.803   1.311   3.608
  587   1HD2  LEU1181          3HD2      LEU1181 -15.964   2.532   6.662
  588   2HD2  LEU1181          2HD2      LEU1181 -16.452   1.139   7.630
  589   3HD2  LEU1181          1HD2      LEU1181 -15.334   0.929   6.282
  590    H    ARG1182           HN       ARG1182 -18.482  -0.707   7.665
  591    HA   ARG1182           HA       ARG1182 -19.798  -0.979  10.095
  592   1HB   ARG1182           HB2      ARG1182 -17.949  -2.436   8.991
  593   2HB   ARG1182           HB1      ARG1182 -16.833  -1.393   9.862
  594   1HG   ARG1182           HG2      ARG1182 -17.615  -2.111  11.949
  595   2HG   ARG1182           HG1      ARG1182 -19.070  -2.826  11.251
  596   1HD   ARG1182           HD2      ARG1182 -17.560  -4.591  11.817
  597   2HD   ARG1182           HD1      ARG1182 -17.625  -4.458  10.063
  598    HE   ARG1182           HE       ARG1182 -15.496  -2.925  10.721
  599   1HH1  ARG1182          1HH1      ARG1182 -16.417  -6.200  11.474
  600   2HH1  ARG1182          2HH1      ARG1182 -14.785  -6.768  11.590
  601   1HH2  ARG1182          1HH2      ARG1182 -13.344  -3.665  10.871
  602   2HH2  ARG1182          2HH2      ARG1182 -13.039  -5.327  11.248
  603    H    TRP1183           HN       TRP1183 -17.758   1.488   8.979
  604    HA   TRP1183           HA       TRP1183 -17.908   2.864  11.551
  605   1HB   TRP1183           HB2      TRP1183 -15.322   3.063  10.072
  606   2HB   TRP1183           HB1      TRP1183 -15.640   3.231  11.795
  607    HD1  TRP1183           HD1      TRP1183 -15.123   0.519   9.114
  608    HE1  TRP1183           HE1      TRP1183 -14.408  -1.658  10.287
  609    HE3  TRP1183           HE3      TRP1183 -15.669   1.994  13.981
  610    HZ2  TRP1183           HZ2      TRP1183 -14.106  -2.618  12.907
  611    HZ3  TRP1183           HZ3      TRP1183 -15.142   0.380  15.764
  612    HH2  TRP1183           HH2      TRP1183 -14.377  -1.878  15.237
  613    H    THR1184           HN       THR1184 -19.235   3.062   8.948
  614    HA   THR1184           HA       THR1184 -18.311   4.934   7.204
  615    HB   THR1184           HB       THR1184 -20.301   3.927   6.571
  616    HG1  THR1184           HG1      THR1184 -21.856   5.969   6.947
  617   1HG2  THR1184          3HG2      THR1184 -21.459   4.814   9.213
  618   2HG2  THR1184          2HG2      THR1184 -22.406   4.097   7.911
  619   3HG2  THR1184          1HG2      THR1184 -21.129   3.163   8.689
  620    H    ALA1185           HN       ALA1185 -20.966   6.128   9.091
  621    HA   ALA1185           HA       ALA1185 -21.353   8.079  10.183
  622   1HB   ALA1185           HB3      ALA1185 -18.361   8.260  10.485
  623   2HB   ALA1185           HB1      ALA1185 -19.429   7.360  11.560
  624   3HB   ALA1185           HB2      ALA1185 -19.579   9.113  11.434
  625    H    LYS1186           HN       LYS1186 -19.008   8.009   7.625
  626    HA   LYS1186           HA       LYS1186 -20.096   9.951   6.036
  627   1HB   LYS1186           HB2      LYS1186 -19.565  11.561   7.828
  628   2HB   LYS1186           HB1      LYS1186 -17.873  11.092   7.749
  629   1HG   LYS1186           HG2      LYS1186 -17.748  11.928   5.456
  630   2HG   LYS1186           HG1      LYS1186 -19.445  12.404   5.541
  631   1HD   LYS1186           HD2      LYS1186 -18.925  13.933   7.380
  632   2HD   LYS1186           HD1      LYS1186 -17.228  13.456   7.296
  633   1HE   LYS1186           HE2      LYS1186 -17.103  14.310   5.006
  634   2HE   LYS1186           HE1      LYS1186 -18.798  14.788   5.092
  635   1HZ   LYS1186           HZ1      LYS1186 -18.242  16.306   6.888
  636   2HZ   LYS1186           HZ3      LYS1186 -16.615  15.850   6.802
  637   3HZ   LYS1186           HZ2      LYS1186 -17.335  16.660   5.504
  638    H    GLN1187           HN       GLN1187 -19.435   8.626   4.378
  639    HA   GLN1187           HA       GLN1187 -18.060   7.863   2.739
  640   1HB   GLN1187           HB2      GLN1187 -16.953   9.990   2.655
  641   2HB   GLN1187           HB1      GLN1187 -16.045   9.639   4.120
  642   1HG   GLN1187           HG2      GLN1187 -15.046   7.684   2.796
  643   2HG   GLN1187           HG1      GLN1187 -15.689   8.504   1.373
  644   1HE2  GLN1187          1HE2      GLN1187 -13.390   8.663   3.978
  645   2HE2  GLN1187          2HE2      GLN1187 -12.422   9.931   3.315
  646    H    LYS1188           HN       LYS1188 -15.461   8.081   5.122
  647    HA   LYS1188           HA       LYS1188 -14.033   6.461   5.886
  648   1HB   LYS1188           HB2      LYS1188 -16.048   6.341   7.394
  649   2HB   LYS1188           HB1      LYS1188 -16.612   4.987   6.427
  650   1HG   LYS1188           HG2      LYS1188 -15.521   4.200   8.430
  651   2HG   LYS1188           HG1      LYS1188 -14.589   3.734   7.007
  652   1HD   LYS1188           HD2      LYS1188 -13.070   5.616   7.390
  653   2HD   LYS1188           HD1      LYS1188 -14.001   6.076   8.817
  654   1HE   LYS1188           HE2      LYS1188 -12.005   4.826   9.443
  655   2HE   LYS1188           HE1      LYS1188 -13.468   3.935   9.863
  656   1HZ   LYS1188           HZ1      LYS1188 -11.781   3.450   7.467
  657   2HZ   LYS1188           HZ3      LYS1188 -11.812   2.494   8.862
  658   3HZ   LYS1188           HZ2      LYS1188 -13.181   2.594   7.875
  659    H    LEU1189           HN       LEU1189 -13.046   5.830   3.940
  660    HA   LEU1189           HA       LEU1189 -13.883   3.190   2.945
  661   1HB   LEU1189           HB2      LEU1189 -13.011   5.359   1.073
  662   2HB   LEU1189           HB1      LEU1189 -13.797   3.839   0.697
  663    HG   LEU1189           HG       LEU1189 -15.186   6.015   2.241
  664   1HD1  LEU1189          1HD1      LEU1189 -14.468   6.943   0.104
  665   2HD1  LEU1189          3HD1      LEU1189 -15.186   5.572  -0.740
  666   3HD1  LEU1189          2HD1      LEU1189 -16.215   6.703   0.138
  667   1HD2  LEU1189          3HD2      LEU1189 -16.146   3.780   2.393
  668   2HD2  LEU1189          2HD2      LEU1189 -17.193   4.861   1.472
  669   3HD2  LEU1189          1HD2      LEU1189 -16.194   3.674   0.632
  670    H    TYR1190           HN       TYR1190 -11.519   5.653   2.102
  671    HA   TYR1190           HA       TYR1190  -9.455   4.160   1.231
  672   1HB   TYR1190           HB2      TYR1190  -9.361   6.678   2.883
  673   2HB   TYR1190           HB1      TYR1190  -7.966   6.008   2.044
  674    HD1  TYR1190           HD1      TYR1190 -11.356   5.853   0.562
  675    HD2  TYR1190           HD2      TYR1190  -7.647   7.969   0.692
  676    HE1  TYR1190           HE1      TYR1190 -11.975   7.081  -1.478
  677    HE2  TYR1190           HE2      TYR1190  -8.268   9.190  -1.345
  678    HH   TYR1190           HH       TYR1190 -11.418   9.192  -2.605
  679    H    SER1191           HN       SER1191  -7.867   2.950   1.965
  680    HA   SER1191           HA       SER1191  -7.159   2.802   4.766
  681   1HB   SER1191           HB2      SER1191  -8.546   0.542   3.322
  682   2HB   SER1191           HB1      SER1191  -7.483   0.244   4.695
  683    HG   SER1191           HG       SER1191  -8.902   1.168   6.019
  684    H    ARG1192           HN       ARG1192  -5.698   0.531   4.796
  685    HA   ARG1192           HA       ARG1192  -3.682   1.032   2.723
  686   1HB   ARG1192           HB2      ARG1192  -2.928   1.284   5.061
  687   2HB   ARG1192           HB1      ARG1192  -3.409  -0.373   5.391
  688   1HG   ARG1192           HG2      ARG1192  -1.743  -1.205   3.855
  689   2HG   ARG1192           HG1      ARG1192  -1.306   0.443   3.400
  690   1HD   ARG1192           HD2      ARG1192   0.291  -0.485   4.993
  691   2HD   ARG1192           HD1      ARG1192  -0.573   0.891   5.680
  692    HE   ARG1192           HE       ARG1192  -1.936  -1.440   6.396
  693   1HH1  ARG1192          1HH1      ARG1192   1.117   0.126   7.001
  694   2HH1  ARG1192          2HH1      ARG1192   1.302  -0.561   8.580
  695   1HH2  ARG1192          1HH2      ARG1192  -1.700  -2.349   8.474
  696   2HH2  ARG1192          2HH2      ARG1192  -0.298  -1.968   9.417
  697    H    THR1193           HN       THR1193  -3.765  -0.334   1.072
  698    HA   THR1193           HA       THR1193  -5.300  -2.447   0.606
  699    HB   THR1193           HB       THR1193  -2.382  -2.294  -0.172
  700    HG1  THR1193           HG1      THR1193  -4.789  -1.449  -1.429
  701   1HG2  THR1193          2HG2      THR1193  -3.438  -4.587  -0.363
  702   2HG2  THR1193          1HG2      THR1193  -4.531  -3.885  -1.555
  703   3HG2  THR1193          3HG2      THR1193  -2.792  -3.909  -1.858
  704    H    GLY1194           HN       GLY1194  -5.798  -4.189   1.700
  705   1HA   GLY1194           HA1      GLY1194  -3.710  -5.491   3.325
  706   2HA   GLY1194           HA2      GLY1194  -4.806  -6.429   2.318
  707    H    GLU1195           HN       GLU1195  -6.114  -3.630   3.777
  708    HA   GLU1195           HA       GLU1195  -7.076  -5.051   6.131
  709   1HB   GLU1195           HB2      GLU1195  -7.519  -2.195   5.237
  710   2HB   GLU1195           HB1      GLU1195  -8.032  -2.871   6.777
  711   1HG   GLU1195           HG2      GLU1195  -5.186  -2.611   5.833
  712   2HG   GLU1195           HG1      GLU1195  -5.992  -1.557   6.994
  713    H    SER1196           HN       SER1196  -9.292  -5.292   6.632
  714    HA   SER1196           HA       SER1196 -10.949  -5.687   4.269
  715   1HB   SER1196           HB2      SER1196 -12.445  -6.919   5.793
  716   2HB   SER1196           HB1      SER1196 -10.789  -7.520   5.889
  717    HG   SER1196           HG       SER1196 -10.620  -5.982   7.737
  718    H    VAL1197           HN       VAL1197 -12.676  -4.490   3.747
  719    HA   VAL1197           HA       VAL1197 -13.674  -2.543   5.713
  720    HB   VAL1197           HB       VAL1197 -13.105  -2.012   2.794
  721   1HG1  VAL1197          1HG1      VAL1197 -14.495  -0.263   4.821
  722   2HG1  VAL1197          3HG1      VAL1197 -14.002   0.240   3.205
  723   3HG1  VAL1197          2HG1      VAL1197 -15.233  -1.008   3.403
  724   1HG2  VAL1197          3HG2      VAL1197 -11.151  -1.853   4.238
  725   2HG2  VAL1197          2HG2      VAL1197 -11.636  -0.257   3.666
  726   3HG2  VAL1197          1HG2      VAL1197 -12.019  -0.756   5.312
  727    H    GLU1198           HN       GLU1198 -15.701  -3.007   6.145
  728    HA   GLU1198           HA       GLU1198 -17.351  -4.329   4.118
  729   1HB   GLU1198           HB2      GLU1198 -17.779  -5.633   5.899
  730   2HB   GLU1198           HB1      GLU1198 -17.140  -4.447   7.027
  731   1HG   GLU1198           HG2      GLU1198 -19.247  -3.271   7.049
  732   2HG   GLU1198           HG1      GLU1198 -19.900  -4.367   5.828
  733    H    PHE1199           HN       PHE1199 -18.725  -3.120   2.962
  734    HA   PHE1199           HA       PHE1199 -19.510  -0.502   3.963
  735   1HB   PHE1199           HB2      PHE1199 -20.196  -1.835   1.331
  736   2HB   PHE1199           HB1      PHE1199 -20.483  -0.149   1.749
  737    HD1  PHE1199           HD1      PHE1199 -18.752   1.474   1.605
  738    HD2  PHE1199           HD2      PHE1199 -17.916  -2.652   0.995
  739    HE1  PHE1199           HE1      PHE1199 -16.523   2.067   0.703
  740    HE2  PHE1199           HE2      PHE1199 -15.707  -2.082   0.102
  741    HZ   PHE1199           HZ       PHE1199 -15.000   0.275  -0.041
  742    H    VAL1200           HN       VAL1200 -21.048  -0.742   5.522
  743    HA   VAL1200           HA       VAL1200 -23.079  -2.677   5.554
  744    HB   VAL1200           HB       VAL1200 -23.263   0.056   6.828
  745   1HG1  VAL1200          1HG1      VAL1200 -24.379  -2.650   7.444
  746   2HG1  VAL1200          3HG1      VAL1200 -24.272  -1.389   8.671
  747   3HG1  VAL1200          2HG1      VAL1200 -25.233  -1.122   7.218
  748   1HG2  VAL1200          1HG2      VAL1200 -21.011  -0.956   7.198
  749   2HG2  VAL1200          3HG2      VAL1200 -21.946  -0.718   8.672
  750   3HG2  VAL1200          2HG2      VAL1200 -21.809  -2.329   7.966
  751    H    CYS1201           HN       CYS1201 -25.467  -1.250   5.903
  752    HA   CYS1201           HA       CYS1201 -25.857   0.189   3.389
  753   1HB   CYS1201           HB2      CYS1201 -27.683  -2.029   4.341
  754   2HB   CYS1201           HB1      CYS1201 -27.889  -1.054   2.893
  755    H    LYS1202           HN       LYS1202 -26.734   2.063   3.780
  756    HA   LYS1202           HA       LYS1202 -27.364   3.346   5.961
  757   1HB   LYS1202           HB2      LYS1202 -27.719   4.179   3.626
  758   2HB   LYS1202           HB1      LYS1202 -29.289   3.387   3.637
  759   1HG   LYS1202           HG2      LYS1202 -30.036   4.801   5.440
  760   2HG   LYS1202           HG1      LYS1202 -28.437   5.539   5.560
  761   1HD   LYS1202           HD2      LYS1202 -28.700   6.304   3.197
  762   2HD   LYS1202           HD1      LYS1202 -30.367   5.721   3.252
  763   1HE   LYS1202           HE2      LYS1202 -30.856   7.242   5.083
  764   2HE   LYS1202           HE1      LYS1202 -29.178   7.785   5.104
  765   1HZ   LYS1202           HZ1      LYS1202 -29.471   8.655   2.868
  766   2HZ   LYS1202           HZ3      LYS1202 -31.081   8.134   2.849
  767   3HZ   LYS1202           HZ2      LYS1202 -30.596   9.344   3.926
  768    H    ARG1203           HN       ARG1203 -28.217   2.576   7.757
  769    HA   ARG1203           HA       ARG1203 -29.784   0.639   8.475
  770   1HB   ARG1203           HB2      ARG1203 -30.283   3.482   9.352
  771   2HB   ARG1203           HB1      ARG1203 -30.831   2.051  10.211
  772   1HG   ARG1203           HG2      ARG1203 -28.505   1.363  10.544
  773   2HG   ARG1203           HG1      ARG1203 -27.965   2.816   9.701
  774   1HD   ARG1203           HD2      ARG1203 -29.039   4.205  11.402
  775   2HD   ARG1203           HD1      ARG1203 -29.589   2.756  12.242
  776    HE   ARG1203           HE       ARG1203 -26.802   2.634  11.950
  777   1HH1  ARG1203          1HH1      ARG1203 -29.235   4.434  13.677
  778   2HH1  ARG1203          2HH1      ARG1203 -28.201   4.791  15.020
  779   1HH2  ARG1203          1HH2      ARG1203 -25.435   3.098  13.714
  780   2HH2  ARG1203          2HH2      ARG1203 -26.041   4.031  15.042
  781    H    GLY1204           HN       GLY1204 -31.281  -0.252   7.173
  782   1HA   GLY1204           HA1      GLY1204 -33.512   1.426   6.250
  783   2HA   GLY1204           HA2      GLY1204 -33.851  -0.024   7.184
  784    H    TYR1205           HN       TYR1205 -31.864   0.912   4.367
  785    HA   TYR1205           HA       TYR1205 -33.216  -0.709   2.533
  786   1HB   TYR1205           HB2      TYR1205 -30.332   0.156   2.398
  787   2HB   TYR1205           HB1      TYR1205 -31.326  -0.358   1.045
  788    HD1  TYR1205           HD1      TYR1205 -30.857   2.317   3.558
  789    HD2  TYR1205           HD2      TYR1205 -32.766   1.164  -0.064
  790    HE1  TYR1205           HE1      TYR1205 -31.547   4.646   3.186
  791    HE2  TYR1205           HE2      TYR1205 -33.460   3.491  -0.446
  792    HH   TYR1205           HH       TYR1205 -33.852   5.535   0.863
  793    H    ARG1206           HN       ARG1206 -33.016  -2.763   1.870
  794    HA   ARG1206           HA       ARG1206 -31.190  -4.480   3.411
  795   1HB   ARG1206           HB2      ARG1206 -32.766  -6.288   3.023
  796   2HB   ARG1206           HB1      ARG1206 -33.592  -4.914   3.745
  797   1HG   ARG1206           HG2      ARG1206 -34.397  -4.263   1.501
  798   2HG   ARG1206           HG1      ARG1206 -33.640  -5.717   0.844
  799   1HD   ARG1206           HD2      ARG1206 -35.038  -7.106   2.287
  800   2HD   ARG1206           HD1      ARG1206 -35.795  -5.659   2.951
  801    HE   ARG1206           HE       ARG1206 -36.097  -5.606   0.174
  802   1HH1  ARG1206          1HH1      ARG1206 -37.175  -7.468   2.915
  803   2HH1  ARG1206          2HH1      ARG1206 -38.675  -7.925   2.179
  804   1HH2  ARG1206          1HH2      ARG1206 -38.070  -6.203  -0.803
  805   2HH2  ARG1206          2HH2      ARG1206 -39.183  -7.205   0.066
  806    H    LEU1207           HN       LEU1207 -29.800  -5.810   2.400
  807    HA   LEU1207           HA       LEU1207 -28.825  -5.328  -0.110
  808   1HB   LEU1207           HB2      LEU1207 -27.770  -6.712   1.711
  809   2HB   LEU1207           HB1      LEU1207 -28.803  -8.038   1.214
  810    HG   LEU1207           HG       LEU1207 -27.743  -7.829  -1.088
  811   1HD1  LEU1207          3HD1      LEU1207 -26.838  -5.572  -0.794
  812   2HD1  LEU1207          2HD1      LEU1207 -25.748  -6.176   0.458
  813   3HD1  LEU1207          1HD1      LEU1207 -25.574  -6.734  -1.205
  814   1HD2  LEU1207          1HD2      LEU1207 -27.178  -9.617   0.467
  815   2HD2  LEU1207          3HD2      LEU1207 -25.754  -9.087  -0.429
  816   3HD2  LEU1207          2HD2      LEU1207 -25.983  -8.576   1.243
  817    H    SER1208           HN       SER1208 -30.258  -5.168  -1.748
  818    HA   SER1208           HA       SER1208 -31.212  -7.591  -2.927
  819   1HB   SER1208           HB2      SER1208 -33.235  -5.563  -1.952
  820   2HB   SER1208           HB1      SER1208 -33.601  -6.921  -3.018
  821    HG   SER1208           HG       SER1208 -32.697  -8.254  -1.255
  822    H    SER1209           HN       SER1209 -29.387  -5.815  -3.784
  823    HA   SER1209           HA       SER1209 -30.751  -4.619  -6.102
  824   1HB   SER1209           HB2      SER1209 -30.152  -2.839  -4.562
  825   2HB   SER1209           HB1      SER1209 -28.495  -3.429  -4.487
  826    HG   SER1209           HG       SER1209 -28.087  -2.377  -6.256
  827    H    ARG1210           HN       ARG1210 -29.546  -7.193  -5.942
  828    HA   ARG1210           HA       ARG1210 -28.104  -8.560  -7.042
  829   1HB   ARG1210           HB2      ARG1210 -28.116  -6.158  -8.854
  830   2HB   ARG1210           HB1      ARG1210 -27.235  -7.626  -9.255
  831   1HG   ARG1210           HG2      ARG1210 -30.198  -7.476  -8.731
  832   2HG   ARG1210           HG1      ARG1210 -29.446  -7.502 -10.327
  833   1HD   ARG1210           HD2      ARG1210 -29.243  -9.665  -8.235
  834   2HD   ARG1210           HD1      ARG1210 -30.242  -9.719  -9.687
  835    HE   ARG1210           HE       ARG1210 -27.617  -9.256 -10.489
  836   1HH1  ARG1210          1HH1      ARG1210 -29.473 -11.763  -8.937
  837   2HH1  ARG1210          2HH1      ARG1210 -28.476 -13.049  -9.534
  838   1HH2  ARG1210          1HH2      ARG1210 -26.300 -10.941 -11.280
  839   2HH2  ARG1210          2HH2      ARG1210 -26.673 -12.580 -10.865
  840    H    SER1211           HN       SER1211 -27.098  -6.420  -5.087
  841    HA   SER1211           HA       SER1211 -24.477  -5.703  -5.850
  842   1HB   SER1211           HB2      SER1211 -25.627  -6.060  -3.071
  843   2HB   SER1211           HB1      SER1211 -24.130  -5.213  -3.461
  844    HG   SER1211           HG       SER1211 -26.651  -4.297  -3.520
  845    H    HIS1212           HN       HIS1212 -22.507  -6.469  -4.615
  846    HA   HIS1212           HA       HIS1212 -22.361  -9.354  -4.879
  847   1HB   HIS1212           HB2      HIS1212 -20.216  -7.300  -4.299
  848   2HB   HIS1212           HB1      HIS1212 -19.923  -9.015  -4.565
  849    HD1  HIS1212           HD1      HIS1212 -20.234  -9.905  -7.000
  850    HD2  HIS1212           HD2      HIS1212 -20.640  -5.791  -6.589
  851    HE1  HIS1212           HE1      HIS1212 -20.125  -8.983  -9.337
  852    HE2  HIS1212           HE2      HIS1212 -20.282  -6.485  -9.056
  853    H    THR1213           HN       THR1213 -20.382  -7.676  -2.551
  854    HA   THR1213           HA       THR1213 -21.867  -8.844  -0.316
  855    HB   THR1213           HB       THR1213 -19.939  -9.869   0.664
  856    HG1  THR1213           HG1      THR1213 -18.605  -8.252  -1.097
  857   1HG2  THR1213          1HG2      THR1213 -20.118 -10.546  -2.272
  858   2HG2  THR1213          3HG2      THR1213 -19.308 -11.542  -1.061
  859   3HG2  THR1213          2HG2      THR1213 -21.048 -11.272  -0.959
  860    H    LEU1214           HN       LEU1214 -21.751  -7.673   1.561
  861    HA   LEU1214           HA       LEU1214 -20.936  -4.968   1.388
  862   1HB   LEU1214           HB2      LEU1214 -21.668  -6.624   3.807
  863   2HB   LEU1214           HB1      LEU1214 -21.468  -4.883   3.813
  864    HG   LEU1214           HG       LEU1214 -23.790  -5.235   3.726
  865   1HD1  LEU1214          1HD1      LEU1214 -22.684  -4.649   0.995
  866   2HD1  LEU1214          3HD1      LEU1214 -24.407  -4.546   1.363
  867   3HD1  LEU1214          2HD1      LEU1214 -23.258  -3.513   2.215
  868   1HD2  LEU1214          2HD2      LEU1214 -23.307  -7.225   1.516
  869   2HD2  LEU1214          1HD2      LEU1214 -23.762  -7.605   3.177
  870   3HD2  LEU1214          3HD2      LEU1214 -24.884  -6.730   2.134
  871    H    ARG1215           HN       ARG1215 -19.706  -7.641   3.383
  872    HA   ARG1215           HA       ARG1215 -17.351  -6.156   4.121
  873   1HB   ARG1215           HB2      ARG1215 -18.434  -7.813   5.632
  874   2HB   ARG1215           HB1      ARG1215 -17.954  -9.092   4.525
  875   1HG   ARG1215           HG2      ARG1215 -15.596  -8.509   4.904
  876   2HG   ARG1215           HG1      ARG1215 -16.105  -7.272   6.056
  877   1HD   ARG1215           HD2      ARG1215 -15.429  -9.309   7.208
  878   2HD   ARG1215           HD1      ARG1215 -17.147  -8.990   7.445
  879    HE   ARG1215           HE       ARG1215 -16.962 -10.676   5.264
  880   1HH1  ARG1215          1HH1      ARG1215 -16.115 -10.765   8.644
  881   2HH1  ARG1215          2HH1      ARG1215 -16.322 -12.479   8.782
  882   1HH2  ARG1215          1HH2      ARG1215 -17.237 -12.933   5.439
  883   2HH2  ARG1215          2HH2      ARG1215 -16.958 -13.711   6.961
  884    H    THR1216           HN       THR1216 -15.539  -6.008   2.973
  885    HA   THR1216           HA       THR1216 -14.736  -8.224   1.247
  886    HB   THR1216           HB       THR1216 -16.014  -6.734  -0.222
  887    HG1  THR1216           HG1      THR1216 -13.869  -6.098  -1.486
  888   1HG2  THR1216          2HG2      THR1216 -15.695  -4.634   0.982
  889   2HG2  THR1216          1HG2      THR1216 -13.985  -4.638   0.549
  890   3HG2  THR1216          3HG2      THR1216 -15.213  -4.468  -0.706
  891    H    THR1217           HN       THR1217 -12.594  -7.167   0.013
  892    HA   THR1217           HA       THR1217 -10.886  -6.109   2.167
  893    HB   THR1217           HB       THR1217 -10.366  -8.442   0.342
  894    HG1  THR1217           HG1      THR1217 -10.784  -9.318   2.227
  895   1HG2  THR1217          1HG2      THR1217  -8.477  -6.827   0.113
  896   2HG2  THR1217          3HG2      THR1217  -8.232  -6.930   1.857
  897   3HG2  THR1217          2HG2      THR1217  -8.007  -8.360   0.849
  898    H    CYS1218           HN       CYS1218  -9.558  -4.472   1.596
  899    HA   CYS1218           HA       CYS1218  -9.853  -3.330  -1.015
  900   1HB   CYS1218           HB2      CYS1218  -7.753  -2.438   0.934
  901   2HB   CYS1218           HB1      CYS1218  -8.691  -1.481  -0.213
  902    H    TRP1219           HN       TRP1219  -8.495  -3.439  -2.716
  903    HA   TRP1219           HA       TRP1219  -5.776  -4.232  -2.509
  904   1HB   TRP1219           HB2      TRP1219  -7.439  -6.371  -2.316
  905   2HB   TRP1219           HB1      TRP1219  -7.235  -6.284  -4.063
  906    HD1  TRP1219           HD1      TRP1219  -4.634  -6.458  -4.966
  907    HE1  TRP1219           HE1      TRP1219  -2.664  -7.787  -3.985
  908    HE3  TRP1219           HE3      TRP1219  -6.415  -7.215  -0.233
  909    HZ2  TRP1219           HZ2      TRP1219  -1.952  -8.995  -1.556
  910    HZ3  TRP1219           HZ3      TRP1219  -5.024  -8.471   1.361
  911    HH2  TRP1219           HH2      TRP1219  -2.836  -9.344   0.712
  912    H    ASP1220           HN       ASP1220  -4.747  -3.386  -4.200
  913    HA   ASP1220           HA       ASP1220  -4.342  -2.411  -6.212
  914   1HB   ASP1220           HB2      ASP1220  -5.067  -4.641  -7.069
  915   2HB   ASP1220           HB1      ASP1220  -6.712  -4.022  -7.190
  916    H    GLY1221           HN       GLY1221  -6.821  -1.712  -4.320
  917   1HA   GLY1221           HA1      GLY1221  -7.507   0.676  -5.841
  918   2HA   GLY1221           HA2      GLY1221  -7.838   0.393  -4.143
  919    H    LYS1222           HN       LYS1222  -8.763  -2.319  -5.841
  920    HA   LYS1222           HA       LYS1222 -11.440  -1.290  -6.373
  921   1HB   LYS1222           HB2      LYS1222 -11.742  -3.349  -7.656
  922   2HB   LYS1222           HB1      LYS1222 -10.363  -2.425  -8.217
  923   1HG   LYS1222           HG2      LYS1222  -9.341  -4.417  -8.185
  924   2HG   LYS1222           HG1      LYS1222  -9.167  -4.085  -6.461
  925   1HD   LYS1222           HD2      LYS1222 -11.233  -5.323  -6.015
  926   2HD   LYS1222           HD1      LYS1222 -11.402  -5.659  -7.739
  927   1HE   LYS1222           HE2      LYS1222 -10.449  -7.566  -6.541
  928   2HE   LYS1222           HE1      LYS1222  -9.314  -6.906  -7.719
  929   1HZ   LYS1222           HZ2      LYS1222  -9.274  -6.364  -4.799
  930   2HZ   LYS1222           HZ1      LYS1222  -8.230  -7.412  -5.620
  931   3HZ   LYS1222           HZ3      LYS1222  -8.179  -5.750  -5.932
  932    H    LEU1223           HN       LEU1223 -13.019  -1.659  -4.989
  933    HA   LEU1223           HA       LEU1223 -12.833  -4.006  -3.215
  934   1HB   LEU1223           HB2      LEU1223 -14.076  -1.305  -2.739
  935   2HB   LEU1223           HB1      LEU1223 -14.305  -2.679  -1.677
  936    HG   LEU1223           HG       LEU1223 -11.497  -2.255  -2.101
  937   1HD1  LEU1223          3HD1      LEU1223 -12.158   0.053  -2.590
  938   2HD1  LEU1223          2HD1      LEU1223 -13.022   0.124  -1.054
  939   3HD1  LEU1223          1HD1      LEU1223 -11.270  -0.071  -1.071
  940   1HD2  LEU1223          2HD2      LEU1223 -12.531  -3.465  -0.238
  941   2HD2  LEU1223          1HD2      LEU1223 -11.502  -2.149   0.326
  942   3HD2  LEU1223          3HD2      LEU1223 -13.254  -1.960   0.331
  943    H    GLU1224           HN       GLU1224 -15.014  -4.728  -2.405
  944    HA   GLU1224           HA       GLU1224 -16.763  -5.149  -4.665
  945   1HB   GLU1224           HB2      GLU1224 -16.888  -6.147  -1.811
  946   2HB   GLU1224           HB1      GLU1224 -18.021  -6.611  -3.072
  947   1HG   GLU1224           HG2      GLU1224 -15.058  -7.141  -3.066
  948   2HG   GLU1224           HG1      GLU1224 -16.331  -8.317  -2.740
  949    H    TYR1225           HN       TYR1225 -18.013  -3.450  -5.153
  950    HA   TYR1225           HA       TYR1225 -19.106  -1.752  -3.080
  951   1HB   TYR1225           HB2      TYR1225 -18.387  -1.398  -5.757
  952   2HB   TYR1225           HB1      TYR1225 -20.143  -1.252  -5.742
  953    HD1  TYR1225           HD1      TYR1225 -21.098   0.286  -3.825
  954    HD2  TYR1225           HD2      TYR1225 -17.127   0.477  -5.326
  955    HE1  TYR1225           HE1      TYR1225 -20.912   2.598  -3.019
  956    HE2  TYR1225           HE2      TYR1225 -16.929   2.793  -4.527
  957    HH   TYR1225           HH       TYR1225 -19.188   4.201  -2.406
  958    HA   PRO1226           HA       PRO1226 -22.999  -3.981  -3.196
  959   1HB   PRO1226           HB2      PRO1226 -23.870  -3.201  -0.807
  960   2HB   PRO1226           HB1      PRO1226 -22.503  -4.312  -0.947
  961   1HG   PRO1226           HG2      PRO1226 -22.529  -1.408  -0.292
  962   2HG   PRO1226           HG1      PRO1226 -21.445  -2.682   0.290
  963   1HD   PRO1226           HD2      PRO1226 -20.930  -0.838  -1.789
  964   2HD   PRO1226           HD1      PRO1226 -19.963  -2.264  -1.368
  965    H    THR1227           HN       THR1227 -25.214  -2.824  -1.874
  966    HA   THR1227           HA       THR1227 -25.645  -0.145  -2.794
  967    HB   THR1227           HB       THR1227 -27.206  -2.340  -4.161
  968    HG1  THR1227           HG1      THR1227 -25.557  -0.478  -5.492
  969   1HG2  THR1227          1HG2      THR1227 -27.288   0.662  -4.494
  970   2HG2  THR1227          3HG2      THR1227 -28.183  -0.504  -5.467
  971   3HG2  THR1227          2HG2      THR1227 -28.538  -0.334  -3.747
  972    H    CYS1228           HN       CYS1228 -27.686  -2.994  -2.318
  973    HA   CYS1228           HA       CYS1228 -29.303  -3.505  -0.807
  974   1HB   CYS1228           HB2      CYS1228 -27.860  -1.350   0.708
  975   2HB   CYS1228           HB1      CYS1228 -29.358  -2.028   1.339
  976    H    ALA1229           HN       ALA1229 -31.426  -2.793  -0.109
  977    HA   ALA1229           HA       ALA1229 -32.354  -0.178  -0.787
  978   1HB   ALA1229           HB1      ALA1229 -33.081  -2.479  -2.582
  979   2HB   ALA1229           HB3      ALA1229 -33.887  -0.910  -2.582
  980   3HB   ALA1229           HB2      ALA1229 -32.184  -1.026  -3.025
  981    H    LYS1230           HN       LYS1230 -33.957   0.272   0.520
  982    HA   LYS1230           HA       LYS1230 -36.274  -1.106   0.925
  983   1HB   LYS1230           HB2      LYS1230 -34.355  -2.567   2.123
  984   2HB   LYS1230           HB1      LYS1230 -34.831  -1.517   3.448
  985   1HG   LYS1230           HG2      LYS1230 -36.836  -3.067   1.853
  986   2HG   LYS1230           HG1      LYS1230 -35.994  -3.756   3.237
  987   1HD   LYS1230           HD2      LYS1230 -37.863  -2.952   4.282
  988   2HD   LYS1230           HD1      LYS1230 -36.817  -1.537   4.406
  989   1HE   LYS1230           HE2      LYS1230 -39.038  -0.889   3.670
  990   2HE   LYS1230           HE1      LYS1230 -37.855  -0.601   2.395
  991   1HZ   LYS1230           HZ3      LYS1230 -38.552  -2.657   1.335
  992   2HZ   LYS1230           HZ2      LYS1230 -39.690  -2.930   2.555
  993   3HZ   LYS1230           HZ1      LYS1230 -39.863  -1.605   1.518
  994    H    ARG1231           HN       ARG1231 -35.102  -0.313   3.943
  995    HA   ARG1231           HA       ARG1231 -35.846   1.263   5.421
  996   1HB   ARG1231           HB2      ARG1231 -33.722   2.138   4.573
  997   2HB   ARG1231           HB1      ARG1231 -34.578   2.985   3.292
  998   1HG   ARG1231           HG2      ARG1231 -35.665   4.418   4.877
  999   2HG   ARG1231           HG1      ARG1231 -35.014   3.488   6.228
 1000   1HD   ARG1231           HD2      ARG1231 -32.749   4.141   5.593
 1001   2HD   ARG1231           HD1      ARG1231 -33.390   5.056   4.228
 1002    HE   ARG1231           HE       ARG1231 -34.649   6.295   6.138
 1003   1HH1  ARG1231          1HH1      ARG1231 -31.381   5.088   6.224
 1004   2HH1  ARG1231          2HH1      ARG1231 -30.829   6.293   7.339
 1005   1HH2  ARG1231          1HH2      ARG1231 -33.930   7.885   7.605
 1006   2HH2  ARG1231          2HH2      ARG1231 -32.278   7.883   8.123

  No H/Q in entry =        1006
  Start of MODEL   25
    1    H1   GLU1103           HT1      GLU1103  39.678   1.319   2.051
    2    H2   GLU1103           HT3      GLU1103  40.452   1.991   3.397
    3    H3   GLU1103           HT2      GLU1103  41.320   1.014   2.322
    4    HA   GLU1103           HA       GLU1103  39.979  -0.893   2.916
    5   1HB   GLU1103           HB2      GLU1103  41.189   0.536   5.292
    6   2HB   GLU1103           HB1      GLU1103  40.837  -1.185   5.211
    7   1HG   GLU1103           HG2      GLU1103  42.797   0.296   3.471
    8   2HG   GLU1103           HG1      GLU1103  43.199  -0.732   4.846
    9    H    ALA1104           HN       ALA1104  38.925   2.122   4.264
   10    HA   ALA1104           HA       ALA1104  36.818   0.887   5.838
   11   1HB   ALA1104           HB1      ALA1104  36.263   3.159   6.520
   12   2HB   ALA1104           HB2      ALA1104  37.418   3.803   5.352
   13   3HB   ALA1104           HB3      ALA1104  37.987   2.848   6.722
   14    H    GLU1105           HN       GLU1105  37.138   2.912   2.947
   15    HA   GLU1105           HA       GLU1105  34.273   2.645   2.426
   16   1HB   GLU1105           HB2      GLU1105  35.265   4.882   2.224
   17   2HB   GLU1105           HB1      GLU1105  36.382   4.283   1.006
   18   1HG   GLU1105           HG2      GLU1105  34.505   3.788  -0.476
   19   2HG   GLU1105           HG1      GLU1105  33.385   4.386   0.746
   20    H    PHE1106           HN       PHE1106  33.680   0.873   1.369
   21    HA   PHE1106           HA       PHE1106  34.809   0.252  -1.190
   22   1HB   PHE1106           HB2      PHE1106  36.440  -0.863   0.284
   23   2HB   PHE1106           HB1      PHE1106  35.134  -1.767   1.041
   24    HD1  PHE1106           HD1      PHE1106  37.011  -1.286  -2.096
   25    HD2  PHE1106           HD2      PHE1106  34.252  -3.717   0.044
   26    HE1  PHE1106           HE1      PHE1106  37.255  -3.049  -3.794
   27    HE2  PHE1106           HE2      PHE1106  34.491  -5.486  -1.650
   28    HZ   PHE1106           HZ       PHE1106  35.994  -5.152  -3.572
   29    H    GLY1107           HN       GLY1107  32.955   0.076  -2.276
   30   1HA   GLY1107           HA1      GLY1107  31.132  -2.043  -1.666
   31   2HA   GLY1107           HA2      GLY1107  31.020  -0.930  -3.014
   32    H    LYS1108           HN       LYS1108  31.389   0.682  -0.049
   33    HA   LYS1108           HA       LYS1108  28.884   0.661   1.080
   34   1HB   LYS1108           HB2      LYS1108  30.745   3.018   0.743
   35   2HB   LYS1108           HB1      LYS1108  29.326   3.015   1.783
   36   1HG   LYS1108           HG2      LYS1108  30.401   0.973   2.906
   37   2HG   LYS1108           HG1      LYS1108  31.879   1.481   2.084
   38   1HD   LYS1108           HD2      LYS1108  30.238   3.245   3.896
   39   2HD   LYS1108           HD1      LYS1108  31.675   2.352   4.403
   40   1HE   LYS1108           HE2      LYS1108  33.012   3.569   2.756
   41   2HE   LYS1108           HE1      LYS1108  31.577   4.458   2.245
   42   1HZ   LYS1108           HZ2      LYS1108  31.414   5.394   4.469
   43   2HZ   LYS1108           HZ1      LYS1108  32.794   4.546   4.953
   44   3HZ   LYS1108           HZ3      LYS1108  32.913   5.755   3.775
   45    H    CYS1109           HN       CYS1109  26.971   1.027   0.301
   46    HA   CYS1109           HA       CYS1109  26.663   2.236  -2.285
   47   1HB   CYS1109           HB2      CYS1109  24.118   1.845  -1.482
   48   2HB   CYS1109           HB1      CYS1109  25.119   0.585  -2.195
   49    H    GLY1110           HN       GLY1110  24.607   3.710  -2.478
   50   1HA   GLY1110           HA1      GLY1110  24.575   6.134  -2.267
   51   2HA   GLY1110           HA2      GLY1110  25.013   5.931  -0.576
   52    HA   PRO1111           HA       PRO1111  20.704   6.682   0.269
   53   1HB   PRO1111           HB2      PRO1111  20.066   8.162  -2.235
   54   2HB   PRO1111           HB1      PRO1111  19.781   8.617  -0.550
   55   1HG   PRO1111           HG2      PRO1111  21.744   9.749  -1.963
   56   2HG   PRO1111           HG1      PRO1111  21.956   9.360  -0.246
   57   1HD   PRO1111           HD2      PRO1111  23.014   7.951  -2.655
   58   2HD   PRO1111           HD1      PRO1111  23.768   8.194  -1.067
   59    HA   PRO1112           HA       PRO1112  19.088   3.189  -2.039
   60   1HB   PRO1112           HB2      PRO1112  16.944   2.734  -0.420
   61   2HB   PRO1112           HB1      PRO1112  18.585   2.205  -0.035
   62   1HG   PRO1112           HG2      PRO1112  17.096   4.618   0.926
   63   2HG   PRO1112           HG1      PRO1112  18.116   3.495   1.845
   64   1HD   PRO1112           HD2      PRO1112  19.017   5.901   1.026
   65   2HD   PRO1112           HD1      PRO1112  20.076   4.479   1.111
   66    HA   PRO1113           HA       PRO1113  15.754   5.440  -4.111
   67   1HB   PRO1113           HB2      PRO1113  16.599   4.998  -6.605
   68   2HB   PRO1113           HB1      PRO1113  17.439   6.144  -5.556
   69   1HG   PRO1113           HG2      PRO1113  18.276   3.459  -6.457
   70   2HG   PRO1113           HG1      PRO1113  19.266   4.815  -5.898
   71   1HD   PRO1113           HD2      PRO1113  18.359   2.512  -4.400
   72   2HD   PRO1113           HD1      PRO1113  19.438   3.818  -3.871
   73    HA   PRO1114           HA       PRO1114  14.002   1.221  -4.918
   74   1HB   PRO1114           HB2      PRO1114  12.311   1.004  -2.897
   75   2HB   PRO1114           HB1      PRO1114  14.048   0.835  -2.619
   76   1HG   PRO1114           HG2      PRO1114  12.243   3.132  -2.021
   77   2HG   PRO1114           HG1      PRO1114  13.636   2.532  -1.107
   78   1HD   PRO1114           HD2      PRO1114  13.614   4.685  -2.940
   79   2HD   PRO1114           HD1      PRO1114  15.040   3.918  -2.218
   80    H    ILE1115           HN       ILE1115  11.323   0.880  -4.173
   81    HA   ILE1115           HA       ILE1115   9.829   1.541  -6.308
   82    HB   ILE1115           HB       ILE1115   7.876   1.731  -4.502
   83   1HG1  ILE1115          2HG1      ILE1115  10.059   0.295  -2.980
   84   2HG1  ILE1115          1HG1      ILE1115   9.593   1.962  -2.665
   85   1HG2  ILE1115          3HG2      ILE1115   9.412  -0.763  -5.195
   86   2HG2  ILE1115          2HG2      ILE1115   7.801  -0.746  -4.478
   87   3HG2  ILE1115          1HG2      ILE1115   8.060  -0.061  -6.083
   88   1HD1  ILE1115          1HD1      ILE1115   7.335   1.213  -2.098
   89   2HD1  ILE1115          3HD1      ILE1115   7.829  -0.456  -2.382
   90   3HD1  ILE1115          2HD1      ILE1115   8.563   0.471  -1.071
   91    H    ASP1116           HN       ASP1116   8.425   3.153  -6.963
   92    HA   ASP1116           HA       ASP1116   9.100   5.818  -6.249
   93   1HB   ASP1116           HB2      ASP1116   8.260   5.205  -8.498
   94   2HB   ASP1116           HB1      ASP1116   6.699   4.798  -7.793
   95    H    ASN1117           HN       ASN1117   8.174   7.162  -4.779
   96    HA   ASN1117           HA       ASN1117   6.809   7.919  -3.112
   97   1HB   ASN1117           HB2      ASN1117   4.893   5.725  -3.947
   98   2HB   ASN1117           HB1      ASN1117   4.518   7.110  -2.923
   99   1HD2  ASN1117          1HD2      ASN1117   3.404   6.203  -5.501
  100   2HD2  ASN1117          2HD2      ASN1117   3.542   7.562  -6.560
  101    H    GLY1118           HN       GLY1118   8.216   4.947  -3.317
  102   1HA   GLY1118           HA1      GLY1118   8.205   3.103  -1.774
  103   2HA   GLY1118           HA2      GLY1118   7.495   4.169  -0.570
  104    H    ASP1119           HN       ASP1119   9.470   2.848   0.412
  105    HA   ASP1119           HA       ASP1119  12.093   3.333   0.146
  106   1HB   ASP1119           HB2      ASP1119  11.501   5.798   0.060
  107   2HB   ASP1119           HB1      ASP1119  11.035   5.665   1.753
  108    H    ILE1120           HN       ILE1120  13.358   3.214   2.207
  109    HA   ILE1120           HA       ILE1120  12.598   1.183   3.824
  110    HB   ILE1120           HB       ILE1120  13.999   3.082   5.479
  111   1HG1  ILE1120          2HG1      ILE1120  15.177   2.578   2.738
  112   2HG1  ILE1120          1HG1      ILE1120  14.543   4.125   3.289
  113   1HG2  ILE1120          2HG2      ILE1120  14.801   0.511   4.126
  114   2HG2  ILE1120          1HG2      ILE1120  15.718   1.319   5.398
  115   3HG2  ILE1120          3HG2      ILE1120  14.110   0.679   5.741
  116   1HD1  ILE1120          1HD1      ILE1120  16.892   2.666   4.468
  117   2HD1  ILE1120          3HD1      ILE1120  16.961   4.075   3.410
  118   3HD1  ILE1120          2HD1      ILE1120  16.255   4.215   5.020
  119    H    THR1121           HN       THR1121  11.499   0.857   5.696
  120    HA   THR1121           HA       THR1121   9.403   2.715   6.295
  121    HB   THR1121           HB       THR1121   8.651   1.072   7.939
  122    HG1  THR1121           HG1      THR1121   9.888  -0.722   8.417
  123   1HG2  THR1121          3HG2      THR1121   8.159   0.735   5.516
  124   2HG2  THR1121          2HG2      THR1121   9.566  -0.324   5.420
  125   3HG2  THR1121          1HG2      THR1121   8.199  -0.766   6.442
  126    H    SER1122           HN       SER1122  12.535   2.855   7.092
  127    HA   SER1122           HA       SER1122  12.049   3.777   9.844
  128   1HB   SER1122           HB2      SER1122  13.795   2.057   9.609
  129   2HB   SER1122           HB1      SER1122  14.670   3.098   8.486
  130    HG   SER1122           HG       SER1122  14.044   4.313  10.863
  131    H    PHE1123           HN       PHE1123  14.756   4.734   7.846
  132    HA   PHE1123           HA       PHE1123  13.680   7.315   7.186
  133   1HB   PHE1123           HB2      PHE1123  14.287   7.570   9.589
  134   2HB   PHE1123           HB1      PHE1123  15.948   7.162   9.181
  135    HD1  PHE1123           HD1      PHE1123  13.292   9.675   8.750
  136    HD2  PHE1123           HD2      PHE1123  17.414   8.760   8.228
  137    HE1  PHE1123           HE1      PHE1123  13.752  12.044   8.269
  138    HE2  PHE1123           HE2      PHE1123  17.883  11.127   7.748
  139    HZ   PHE1123           HZ       PHE1123  16.050  12.772   7.768
  140    HA   PRO1124           HA       PRO1124  16.434   6.375   3.786
  141   1HB   PRO1124           HB2      PRO1124  16.241   9.339   3.480
  142   2HB   PRO1124           HB1      PRO1124  16.042   8.068   2.270
  143   1HG   PRO1124           HG2      PRO1124  13.924   9.321   3.284
  144   2HG   PRO1124           HG1      PRO1124  13.877   7.582   2.945
  145   1HD   PRO1124           HD2      PRO1124  14.096   9.000   5.555
  146   2HD   PRO1124           HD1      PRO1124  13.301   7.462   5.166
  147    H    LEU1125           HN       LEU1125  18.602   6.247   3.698
  148    HA   LEU1125           HA       LEU1125  20.157   8.149   5.319
  149   1HB   LEU1125           HB2      LEU1125  20.953   5.322   4.606
  150   2HB   LEU1125           HB1      LEU1125  21.804   6.423   5.673
  151    HG   LEU1125           HG       LEU1125  19.595   6.369   7.068
  152   1HD1  LEU1125          2HD1      LEU1125  18.304   5.124   5.371
  153   2HD1  LEU1125          1HD1      LEU1125  19.400   3.756   5.578
  154   3HD1  LEU1125          3HD1      LEU1125  18.384   4.280   6.919
  155   1HD2  LEU1125          3HD2      LEU1125  21.488   4.024   6.958
  156   2HD2  LEU1125          2HD2      LEU1125  21.751   5.531   7.835
  157   3HD2  LEU1125          1HD2      LEU1125  20.446   4.447   8.316
  158    H    SER1126           HN       SER1126  22.049   9.001   4.472
  159    HA   SER1126           HA       SER1126  22.141   9.114   1.589
  160   1HB   SER1126           HB2      SER1126  22.489  11.166   2.859
  161   2HB   SER1126           HB1      SER1126  23.869  10.447   3.689
  162    HG   SER1126           HG       SER1126  25.001  10.443   1.781
  163    H    VAL1127           HN       VAL1127  24.329   8.099   4.196
  164    HA   VAL1127           HA       VAL1127  25.945   6.672   2.199
  165    HB   VAL1127           HB       VAL1127  27.261   8.191   3.554
  166   1HG1  VAL1127          3HG1      VAL1127  25.808   8.318   5.507
  167   2HG1  VAL1127          2HG1      VAL1127  26.225   6.661   5.938
  168   3HG1  VAL1127          1HG1      VAL1127  27.460   7.920   5.977
  169   1HG2  VAL1127          1HG2      VAL1127  28.305   6.098   2.873
  170   2HG2  VAL1127          3HG2      VAL1127  28.912   6.614   4.446
  171   3HG2  VAL1127          2HG2      VAL1127  27.724   5.315   4.342
  172    H    TYR1128           HN       TYR1128  25.713   4.556   2.044
  173    HA   TYR1128           HA       TYR1128  24.560   3.102   4.332
  174   1HB   TYR1128           HB2      TYR1128  23.772   3.222   1.567
  175   2HB   TYR1128           HB1      TYR1128  24.209   1.571   1.995
  176    HD1  TYR1128           HD1      TYR1128  23.112   0.589   4.120
  177    HD2  TYR1128           HD2      TYR1128  21.664   4.037   2.092
  178    HE1  TYR1128           HE1      TYR1128  20.908   0.268   5.160
  179    HE2  TYR1128           HE2      TYR1128  19.457   3.728   3.125
  180    HH   TYR1128           HH       TYR1128  18.924   1.601   5.718
  181    H    ALA1129           HN       ALA1129  25.099   0.773   4.371
  182    HA   ALA1129           HA       ALA1129  27.962   0.424   3.856
  183   1HB   ALA1129           HB1      ALA1129  27.185   0.028   6.139
  184   2HB   ALA1129           HB3      ALA1129  26.085  -1.220   5.552
  185   3HB   ALA1129           HB2      ALA1129  27.829  -1.449   5.421
  186    HA   PRO1130           HA       PRO1130  27.277  -2.288   0.442
  187   1HB   PRO1130           HB2      PRO1130  29.461  -3.917   0.673
  188   2HB   PRO1130           HB1      PRO1130  29.524  -2.277   0.019
  189   1HG   PRO1130           HG2      PRO1130  30.204  -3.256   2.765
  190   2HG   PRO1130           HG1      PRO1130  31.054  -2.070   1.758
  191   1HD   PRO1130           HD2      PRO1130  29.433  -1.335   3.786
  192   2HD   PRO1130           HD1      PRO1130  29.591  -0.368   2.306
  193    H    ALA1131           HN       ALA1131  26.341  -4.224  -0.009
  194    HA   ALA1131           HA       ALA1131  25.268  -6.197   0.323
  195   1HB   ALA1131           HB3      ALA1131  27.541  -7.031   0.686
  196   2HB   ALA1131           HB1      ALA1131  26.366  -7.887   1.684
  197   3HB   ALA1131           HB2      ALA1131  27.403  -6.654   2.403
  198    H    SER1132           HN       SER1132  24.587  -3.781   1.970
  199    HA   SER1132           HA       SER1132  23.583  -4.970   4.435
  200   1HB   SER1132           HB2      SER1132  23.462  -2.147   3.361
  201   2HB   SER1132           HB1      SER1132  22.739  -2.650   4.889
  202    HG   SER1132           HG       SER1132  25.383  -3.368   4.531
  203    H    SER1133           HN       SER1133  21.432  -5.220   4.959
  204    HA   SER1133           HA       SER1133  19.547  -4.998   2.706
  205   1HB   SER1133           HB2      SER1133  18.309  -6.862   4.045
  206   2HB   SER1133           HB1      SER1133  19.697  -7.299   3.051
  207    HG   SER1133           HG       SER1133  19.873  -8.225   5.109
  208    H    VAL1134           HN       VAL1134  17.454  -4.278   3.108
  209    HA   VAL1134           HA       VAL1134  16.773  -3.447   5.819
  210    HB   VAL1134           HB       VAL1134  16.085  -1.177   5.022
  211   1HG1  VAL1134          1HG1      VAL1134  19.024  -1.826   4.898
  212   2HG1  VAL1134          3HG1      VAL1134  18.337  -0.220   5.141
  213   3HG1  VAL1134          2HG1      VAL1134  18.085  -1.478   6.351
  214   1HG2  VAL1134          2HG2      VAL1134  17.757  -1.921   2.628
  215   2HG2  VAL1134          1HG2      VAL1134  16.021  -1.607   2.644
  216   3HG2  VAL1134          3HG2      VAL1134  17.156  -0.303   2.991
  217    H    GLU1135           HN       GLU1135  14.580  -2.526   5.934
  218    HA   GLU1135           HA       GLU1135  12.767  -3.825   4.005
  219   1HB   GLU1135           HB2      GLU1135  12.653  -4.889   6.202
  220   2HB   GLU1135           HB1      GLU1135  12.374  -3.331   6.965
  221   1HG   GLU1135           HG2      GLU1135  10.248  -3.130   5.787
  222   2HG   GLU1135           HG1      GLU1135  10.528  -4.689   5.014
  223    H    TYR1136           HN       TYR1136  11.094  -2.633   3.182
  224    HA   TYR1136           HA       TYR1136  10.790   0.112   4.166
  225   1HB   TYR1136           HB2      TYR1136  10.651   0.777   1.675
  226   2HB   TYR1136           HB1      TYR1136  12.242   0.508   2.386
  227    HD1  TYR1136           HD1      TYR1136   9.601  -1.094   0.347
  228    HD2  TYR1136           HD2      TYR1136  13.683  -1.105   1.523
  229    HE1  TYR1136           HE1      TYR1136  10.077  -2.800  -1.348
  230    HE2  TYR1136           HE2      TYR1136  14.175  -2.803  -0.170
  231    HH   TYR1136           HH       TYR1136  11.937  -3.674  -2.611
  232    H    GLN1137           HN       GLN1137   9.101   1.124   2.424
  233    HA   GLN1137           HA       GLN1137   6.938  -0.351   1.505
  234   1HB   GLN1137           HB2      GLN1137   6.803  -0.828   4.036
  235   2HB   GLN1137           HB1      GLN1137   6.306   0.849   4.200
  236   1HG   GLN1137           HG2      GLN1137   4.431   0.370   2.630
  237   2HG   GLN1137           HG1      GLN1137   4.886  -1.331   2.696
  238   1HE2  GLN1137          1HE2      GLN1137   5.670  -1.129   5.517
  239   2HE2  GLN1137          2HE2      GLN1137   4.194  -1.087   6.413
  240    H    CYS1138           HN       CYS1138   4.840   1.243   1.598
  241    HA   CYS1138           HA       CYS1138   5.887   3.825   0.700
  242   1HB   CYS1138           HB2      CYS1138   3.525   2.185  -0.002
  243   2HB   CYS1138           HB1      CYS1138   3.283   3.929   0.000
  244    H    GLN1139           HN       GLN1139   5.375   5.712   1.623
  245    HA   GLN1139           HA       GLN1139   4.588   5.833   4.289
  246   1HB   GLN1139           HB2      GLN1139   4.475   8.029   2.218
  247   2HB   GLN1139           HB1      GLN1139   4.434   8.264   3.960
  248   1HG   GLN1139           HG2      GLN1139   6.673   7.331   4.152
  249   2HG   GLN1139           HG1      GLN1139   6.716   7.059   2.411
  250   1HE2  GLN1139          1HE2      GLN1139   8.503   8.372   2.126
  251   2HE2  GLN1139          2HE2      GLN1139   8.418  10.093   2.248
  252    H    ASN1140           HN       ASN1140   2.782   7.564   4.882
  253    HA   ASN1140           HA       ASN1140   0.573   7.639   5.427
  254   1HB   ASN1140           HB2      ASN1140  -0.783   8.513   3.670
  255   2HB   ASN1140           HB1      ASN1140   0.858   9.104   3.430
  256   1HD2  ASN1140          1HD2      ASN1140  -1.651   7.047   2.226
  257   2HD2  ASN1140          2HD2      ASN1140  -0.932   6.726   0.690
  258    H    LEU1141           HN       LEU1141  -1.692   6.866   3.935
  259    HA   LEU1141           HA       LEU1141  -2.072   4.265   4.892
  260   1HB   LEU1141           HB2      LEU1141  -3.620   5.934   2.930
  261   2HB   LEU1141           HB1      LEU1141  -4.136   4.324   3.389
  262    HG   LEU1141           HG       LEU1141  -4.220   5.092   5.768
  263   1HD1  LEU1141          1HD1      LEU1141  -3.774   7.806   4.532
  264   2HD1  LEU1141          3HD1      LEU1141  -4.237   7.500   6.206
  265   3HD1  LEU1141          2HD1      LEU1141  -2.667   6.958   5.612
  266   1HD2  LEU1141          3HD2      LEU1141  -5.928   6.615   3.806
  267   2HD2  LEU1141          2HD2      LEU1141  -6.233   4.985   4.407
  268   3HD2  LEU1141          1HD2      LEU1141  -6.297   6.357   5.512
  269    H    TYR1142           HN       TYR1142  -0.223   5.121   2.260
  270    HA   TYR1142           HA       TYR1142  -1.013   3.130   0.391
  271   1HB   TYR1142           HB2      TYR1142   1.537   4.702   0.746
  272   2HB   TYR1142           HB1      TYR1142   1.351   3.496  -0.522
  273    HD1  TYR1142           HD1      TYR1142  -1.751   4.328  -0.764
  274    HD2  TYR1142           HD2      TYR1142   1.966   6.383  -1.014
  275    HE1  TYR1142           HE1      TYR1142  -2.788   6.015  -2.221
  276    HE2  TYR1142           HE2      TYR1142   0.938   8.075  -2.470
  277    HH   TYR1142           HH       TYR1142  -0.983   8.276  -3.991
  278    H    GLN1143           HN       GLN1143  -0.580   1.012   0.311
  279    HA   GLN1143           HA       GLN1143   1.196  -0.074   2.380
  280   1HB   GLN1143           HB2      GLN1143  -1.208  -1.185   0.968
  281   2HB   GLN1143           HB1      GLN1143  -0.036  -2.268   1.705
  282   1HG   GLN1143           HG2      GLN1143  -1.510  -0.074   3.146
  283   2HG   GLN1143           HG1      GLN1143  -1.950  -1.782   3.165
  284   1HE2  GLN1143          1HE2      GLN1143   0.827  -2.666   3.198
  285   2HE2  GLN1143          2HE2      GLN1143   1.404  -2.378   4.800
  286    H    LEU1144           HN       LEU1144   1.943  -2.450   1.515
  287    HA   LEU1144           HA       LEU1144   3.194  -1.946  -1.103
  288   1HB   LEU1144           HB2      LEU1144   4.706  -1.776   0.927
  289   2HB   LEU1144           HB1      LEU1144   4.461  -3.498   1.143
  290    HG   LEU1144           HG       LEU1144   5.395  -3.833  -1.177
  291   1HD1  LEU1144          2HD1      LEU1144   6.134  -0.928  -0.861
  292   2HD1  LEU1144          1HD1      LEU1144   6.708  -2.008  -2.132
  293   3HD1  LEU1144          3HD1      LEU1144   4.997  -1.592  -2.034
  294   1HD2  LEU1144          1HD2      LEU1144   6.740  -4.212   0.821
  295   2HD2  LEU1144          3HD2      LEU1144   7.717  -3.534  -0.480
  296   3HD2  LEU1144          2HD2      LEU1144   7.189  -2.507   0.853
  297    H    GLU1145           HN       GLU1145   4.006  -3.954  -2.146
  298    HA   GLU1145           HA       GLU1145   2.613  -6.403  -1.480
  299   1HB   GLU1145           HB2      GLU1145   0.947  -5.321  -2.849
  300   2HB   GLU1145           HB1      GLU1145   2.142  -4.921  -4.074
  301   1HG   GLU1145           HG2      GLU1145   0.778  -6.775  -4.797
  302   2HG   GLU1145           HG1      GLU1145   2.441  -7.305  -4.548
  303    H    GLY1146           HN       GLY1146   3.908  -8.073  -1.828
  304   1HA   GLY1146           HA1      GLY1146   5.924  -7.957  -3.948
  305   2HA   GLY1146           HA2      GLY1146   5.440  -9.392  -3.051
  306    H    ASN1147           HN       ASN1147   8.130  -8.256  -3.582
  307    HA   ASN1147           HA       ASN1147   9.353  -8.782  -1.128
  308   1HB   ASN1147           HB2      ASN1147  10.187  -7.979  -3.761
  309   2HB   ASN1147           HB1      ASN1147  11.072  -7.055  -2.550
  310   1HD2  ASN1147          1HD2      ASN1147  13.011  -8.055  -2.912
  311   2HD2  ASN1147          2HD2      ASN1147  13.319  -9.701  -2.486
  312    H    LYS1148           HN       LYS1148  10.855  -7.194  -0.056
  313    HA   LYS1148           HA       LYS1148  10.206  -4.441   0.051
  314   1HB   LYS1148           HB2      LYS1148   9.253  -4.463   2.355
  315   2HB   LYS1148           HB1      LYS1148   8.209  -5.179   1.127
  316   1HG   LYS1148           HG2      LYS1148   8.062  -6.562   3.035
  317   2HG   LYS1148           HG1      LYS1148   9.055  -7.427   1.861
  318   1HD   LYS1148           HD2      LYS1148  11.075  -6.720   3.029
  319   2HD   LYS1148           HD1      LYS1148  10.099  -5.817   4.191
  320   1HE   LYS1148           HE2      LYS1148  10.029  -8.801   3.750
  321   2HE   LYS1148           HE1      LYS1148  10.793  -7.971   5.106
  322   1HZ   LYS1148           HZ3      LYS1148   8.624  -7.132   5.766
  323   2HZ   LYS1148           HZ2      LYS1148   7.892  -7.932   4.468
  324   3HZ   LYS1148           HZ1      LYS1148   8.619  -8.823   5.709
  325    H    ARG1149           HN       ARG1149  11.989  -7.132   0.650
  326    HA   ARG1149           HA       ARG1149  13.909  -5.685   2.370
  327   1HB   ARG1149           HB2      ARG1149  12.959  -7.768   3.369
  328   2HB   ARG1149           HB1      ARG1149  13.623  -8.677   2.019
  329   1HG   ARG1149           HG2      ARG1149  15.115  -8.963   3.817
  330   2HG   ARG1149           HG1      ARG1149  15.889  -7.839   2.698
  331   1HD   ARG1149           HD2      ARG1149  15.201  -5.961   4.083
  332   2HD   ARG1149           HD1      ARG1149  14.371  -7.059   5.185
  333    HE   ARG1149           HE       ARG1149  17.092  -7.788   4.933
  334   1HH1  ARG1149          1HH1      ARG1149  15.025  -5.384   6.379
  335   2HH1  ARG1149          2HH1      ARG1149  16.115  -5.044   7.681
  336   1HH2  ARG1149          1HH2      ARG1149  18.532  -7.348   6.644
  337   2HH2  ARG1149          2HH2      ARG1149  18.108  -6.160   7.832
  338    H    ILE1150           HN       ILE1150  15.587  -4.937   1.213
  339    HA   ILE1150           HA       ILE1150  16.592  -6.621  -0.989
  340    HB   ILE1150           HB       ILE1150  17.089  -4.621  -2.304
  341   1HG1  ILE1150          2HG1      ILE1150  15.575  -3.161  -0.124
  342   2HG1  ILE1150          1HG1      ILE1150  17.301  -3.027  -0.443
  343   1HG2  ILE1150          3HG2      ILE1150  14.214  -4.933  -1.456
  344   2HG2  ILE1150          2HG2      ILE1150  14.744  -4.053  -2.891
  345   3HG2  ILE1150          1HG2      ILE1150  15.041  -5.787  -2.759
  346   1HD1  ILE1150          3HD1      ILE1150  15.099  -2.190  -2.311
  347   2HD1  ILE1150          2HD1      ILE1150  16.087  -1.120  -1.316
  348   3HD1  ILE1150          1HD1      ILE1150  16.829  -2.048  -2.620
  349    H    THR1151           HN       THR1151  18.723  -5.351  -1.819
  350    HA   THR1151           HA       THR1151  20.402  -4.423   0.327
  351    HB   THR1151           HB       THR1151  20.861  -7.129  -0.929
  352    HG1  THR1151           HG1      THR1151  21.220  -6.740   1.780
  353   1HG2  THR1151          1HG2      THR1151  22.942  -5.825  -1.010
  354   2HG2  THR1151          3HG2      THR1151  22.799  -5.503   0.718
  355   3HG2  THR1151          2HG2      THR1151  23.048  -7.153   0.147
  356    H    CYS1152           HN       CYS1152  21.717  -2.934  -0.511
  357    HA   CYS1152           HA       CYS1152  21.816  -2.312  -3.229
  358   1HB   CYS1152           HB2      CYS1152  23.570  -0.744  -2.655
  359   2HB   CYS1152           HB1      CYS1152  22.342  -0.732  -1.395
  360    H    ARG1153           HN       ARG1153  23.494  -2.480  -4.767
  361    HA   ARG1153           HA       ARG1153  25.466  -4.599  -4.231
  362   1HB   ARG1153           HB2      ARG1153  24.202  -4.262  -6.933
  363   2HB   ARG1153           HB1      ARG1153  25.068  -5.648  -6.286
  364   1HG   ARG1153           HG2      ARG1153  22.886  -6.378  -6.255
  365   2HG   ARG1153           HG1      ARG1153  23.096  -5.781  -4.609
  366   1HD   ARG1153           HD2      ARG1153  20.969  -5.039  -5.545
  367   2HD   ARG1153           HD1      ARG1153  22.035  -3.669  -5.227
  368    HE   ARG1153           HE       ARG1153  22.407  -3.474  -7.579
  369   1HH1  ARG1153          1HH1      ARG1153  19.937  -5.765  -6.689
  370   2HH1  ARG1153          2HH1      ARG1153  19.184  -5.754  -8.248
  371   1HH2  ARG1153          1HH2      ARG1153  21.423  -3.454  -9.634
  372   2HH2  ARG1153          2HH2      ARG1153  20.029  -4.441  -9.923
  373    H    ASN1154           HN       ASN1154  27.417  -3.728  -4.328
  374    HA   ASN1154           HA       ASN1154  29.158  -2.360  -4.878
  375   1HB   ASN1154           HB2      ASN1154  27.951  -2.707  -7.633
  376   2HB   ASN1154           HB1      ASN1154  29.586  -2.139  -7.301
  377   1HD2  ASN1154          1HD2      ASN1154  27.439  -4.866  -7.287
  378   2HD2  ASN1154          2HD2      ASN1154  28.655  -6.080  -7.112
  379    H    GLY1155           HN       GLY1155  27.159  -0.903  -3.796
  380   1HA   GLY1155           HA1      GLY1155  27.661   1.697  -4.812
  381   2HA   GLY1155           HA2      GLY1155  26.526   1.289  -3.536
  382    H    GLN1156           HN       GLN1156  24.688  -0.280  -4.784
  383    HA   GLN1156           HA       GLN1156  23.131   1.625  -6.193
  384   1HB   GLN1156           HB2      GLN1156  24.647   1.038  -8.030
  385   2HB   GLN1156           HB1      GLN1156  24.236  -0.660  -7.836
  386   1HG   GLN1156           HG2      GLN1156  23.056   0.295  -9.716
  387   2HG   GLN1156           HG1      GLN1156  21.924  -0.173  -8.449
  388   1HE2  GLN1156          1HE2      GLN1156  20.846   1.417  -7.284
  389   2HE2  GLN1156          2HE2      GLN1156  20.760   3.055  -7.826
  390    H    TRP1157           HN       TRP1157  21.391   1.155  -4.965
  391    HA   TRP1157           HA       TRP1157  20.622  -1.456  -4.186
  392   1HB   TRP1157           HB2      TRP1157  19.074   1.137  -4.242
  393   2HB   TRP1157           HB1      TRP1157  18.479  -0.350  -3.512
  394    HD1  TRP1157           HD1      TRP1157  21.228   2.296  -3.043
  395    HE1  TRP1157           HE1      TRP1157  21.975   2.252  -0.579
  396    HE3  TRP1157           HE3      TRP1157  18.567  -1.768  -1.478
  397    HZ2  TRP1157           HZ2      TRP1157  21.503   0.677   1.720
  398    HZ3  TRP1157           HZ3      TRP1157  18.771  -2.487   0.865
  399    HH2  TRP1157           HH2      TRP1157  20.210  -1.291   2.430
  400    H    SER1158           HN       SER1158  18.438  -2.372  -4.666
  401    HA   SER1158           HA       SER1158  18.056  -2.447  -7.559
  402   1HB   SER1158           HB2      SER1158  16.608  -4.436  -7.034
  403   2HB   SER1158           HB1      SER1158  18.287  -4.604  -6.530
  404    HG   SER1158           HG       SER1158  15.985  -4.242  -4.976
  405    H    GLU1159           HN       GLU1159  15.506  -3.210  -7.863
  406    HA   GLU1159           HA       GLU1159  13.945  -0.897  -6.938
  407   1HB   GLU1159           HB2      GLU1159  14.482  -1.076  -9.404
  408   2HB   GLU1159           HB1      GLU1159  13.476  -2.515  -9.441
  409   1HG   GLU1159           HG2      GLU1159  12.226  -0.611 -10.221
  410   2HG   GLU1159           HG1      GLU1159  11.556  -1.193  -8.698
  411    HA   PRO1160           HA       PRO1160  11.702  -4.091  -4.662
  412   1HB   PRO1160           HB2      PRO1160   9.913  -1.753  -4.239
  413   2HB   PRO1160           HB1      PRO1160  10.594  -2.878  -3.061
  414   1HG   PRO1160           HG2      PRO1160  11.573  -0.427  -3.276
  415   2HG   PRO1160           HG1      PRO1160  12.662  -1.809  -3.048
  416   1HD   PRO1160           HD2      PRO1160  12.027  -0.281  -5.538
  417   2HD   PRO1160           HD1      PRO1160  13.592  -0.900  -4.967
  418    HA   PRO1161           HA       PRO1161   8.281  -5.302  -7.174
  419   1HB   PRO1161           HB2      PRO1161   6.268  -5.812  -5.415
  420   2HB   PRO1161           HB1      PRO1161   7.670  -6.870  -5.615
  421   1HG   PRO1161           HG2      PRO1161   7.183  -4.741  -3.558
  422   2HG   PRO1161           HG1      PRO1161   7.790  -6.391  -3.330
  423   1HD   PRO1161           HD2      PRO1161   9.455  -4.297  -3.382
  424   2HD   PRO1161           HD1      PRO1161   9.911  -5.852  -4.111
  425    H    LYS1162           HN       LYS1162   6.120  -3.914  -4.722
  426    HA   LYS1162           HA       LYS1162   5.764  -1.406  -5.994
  427   1HB   LYS1162           HB2      LYS1162   4.854  -3.092  -7.721
  428   2HB   LYS1162           HB1      LYS1162   3.496  -3.268  -6.619
  429   1HG   LYS1162           HG2      LYS1162   3.030  -0.883  -6.791
  430   2HG   LYS1162           HG1      LYS1162   4.398  -0.693  -7.890
  431   1HD   LYS1162           HD2      LYS1162   3.327  -2.202  -9.488
  432   2HD   LYS1162           HD1      LYS1162   1.961  -2.404  -8.388
  433   1HE   LYS1162           HE2      LYS1162   1.441  -0.793 -10.141
  434   2HE   LYS1162           HE1      LYS1162   1.465  -0.020  -8.557
  435   1HZ   LYS1162           HZ3      LYS1162   3.664   0.060 -10.552
  436   2HZ   LYS1162           HZ2      LYS1162   2.594   1.325 -10.211
  437   3HZ   LYS1162           HZ1      LYS1162   3.687   0.803  -9.032
  438    H    CYS1163           HN       CYS1163   3.878  -0.216  -5.229
  439    HA   CYS1163           HA       CYS1163   3.132  -1.076  -2.526
  440   1HB   CYS1163           HB2      CYS1163   3.018   1.628  -3.872
  441   2HB   CYS1163           HB1      CYS1163   2.458   1.311  -2.233
  442    H    LEU1164           HN       LEU1164   1.099  -1.570  -1.988
  443    HA   LEU1164           HA       LEU1164  -0.922  -1.478  -4.093
  444   1HB   LEU1164           HB2      LEU1164  -0.263  -3.337  -2.077
  445   2HB   LEU1164           HB1      LEU1164  -1.841  -2.698  -1.660
  446    HG   LEU1164           HG       LEU1164  -2.693  -3.345  -3.866
  447   1HD1  LEU1164          1HD1      LEU1164   0.059  -4.485  -4.303
  448   2HD1  LEU1164          3HD1      LEU1164  -1.334  -4.735  -5.353
  449   3HD1  LEU1164          2HD1      LEU1164  -0.653  -3.119  -5.160
  450   1HD2  LEU1164          1HD2      LEU1164  -1.296  -5.583  -2.411
  451   2HD2  LEU1164          3HD2      LEU1164  -2.882  -4.916  -2.017
  452   3HD2  LEU1164          2HD2      LEU1164  -2.636  -5.767  -3.543
  453    H    HIS1165           HN       HIS1165  -2.066   0.331  -4.175
  454    HA   HIS1165           HA       HIS1165  -2.366   2.210  -2.144
  455   1HB   HIS1165           HB2      HIS1165  -4.243   1.696  -4.462
  456   2HB   HIS1165           HB1      HIS1165  -4.141   3.182  -3.523
  457    HD1  HIS1165           HD1      HIS1165  -2.565   1.372  -6.332
  458    HD2  HIS1165           HD2      HIS1165  -1.793   4.730  -4.010
  459    HE1  HIS1165           HE1      HIS1165  -0.785   2.649  -7.567
  460    HE2  HIS1165           HE2      HIS1165  -0.273   4.632  -6.099
  461    HA   PRO1166           HA       PRO1166  -5.226   0.321   0.670
  462   1HB   PRO1166           HB2      PRO1166  -6.269   2.663   1.697
  463   2HB   PRO1166           HB1      PRO1166  -4.765   1.909   2.236
  464   1HG   PRO1166           HG2      PRO1166  -5.182   4.169   0.318
  465   2HG   PRO1166           HG1      PRO1166  -3.947   3.980   1.577
  466   1HD   PRO1166           HD2      PRO1166  -3.384   3.545  -1.005
  467   2HD   PRO1166           HD1      PRO1166  -2.663   2.550   0.276
  468    H    CYS1167           HN       CYS1167  -7.605   0.644   1.317
  469    HA   CYS1167           HA       CYS1167  -9.169   0.265  -0.968
  470   1HB   CYS1167           HB2      CYS1167  -9.732   0.557   1.941
  471   2HB   CYS1167           HB1      CYS1167 -11.073   0.646   0.806
  472    H    VAL1168           HN       VAL1168  -9.119   1.971  -2.367
  473    HA   VAL1168           HA       VAL1168 -10.350   4.470  -1.418
  474    HB   VAL1168           HB       VAL1168  -8.178   4.866  -2.400
  475   1HG1  VAL1168          1HG1      VAL1168  -9.229   3.443  -4.841
  476   2HG1  VAL1168          3HG1      VAL1168  -7.690   4.301  -4.742
  477   3HG1  VAL1168          2HG1      VAL1168  -7.966   2.867  -3.752
  478   1HG2  VAL1168          2HG2      VAL1168 -10.414   5.698  -4.241
  479   2HG2  VAL1168          1HG2      VAL1168  -9.850   6.558  -2.810
  480   3HG2  VAL1168          3HG2      VAL1168  -8.802   6.412  -4.222
  481    H    ILE1169           HN       ILE1169 -12.397   3.270  -1.499
  482    HA   ILE1169           HA       ILE1169 -13.414   2.447  -4.061
  483    HB   ILE1169           HB       ILE1169 -14.054   1.846  -1.432
  484   1HG1  ILE1169          2HG1      ILE1169 -15.686   1.252  -3.904
  485   2HG1  ILE1169          1HG1      ILE1169 -14.212   0.406  -3.442
  486   1HG2  ILE1169          2HG2      ILE1169 -15.463   3.851  -1.282
  487   2HG2  ILE1169          1HG2      ILE1169 -16.412   3.274  -2.652
  488   3HG2  ILE1169          3HG2      ILE1169 -16.401   2.365  -1.141
  489   1HD1  ILE1169          3HD1      ILE1169 -15.301  -0.360  -1.393
  490   2HD1  ILE1169          2HD1      ILE1169 -16.781   0.469  -1.878
  491   3HD1  ILE1169          1HD1      ILE1169 -16.169  -0.879  -2.838
  492    H    SER1170           HN       SER1170 -15.851   3.281  -4.438
  493    HA   SER1170           HA       SER1170 -15.535   6.151  -4.883
  494   1HB   SER1170           HB2      SER1170 -17.547   4.196  -6.016
  495   2HB   SER1170           HB1      SER1170 -17.416   5.896  -6.463
  496    HG   SER1170           HG       SER1170 -15.011   4.810  -6.696
  497    H    ARG1171           HN       ARG1171 -16.064   7.089  -2.938
  498    HA   ARG1171           HA       ARG1171 -18.229   6.425  -1.274
  499   1HB   ARG1171           HB2      ARG1171 -17.948   8.735  -0.379
  500   2HB   ARG1171           HB1      ARG1171 -16.444   7.830  -0.468
  501   1HG   ARG1171           HG2      ARG1171 -15.906   8.998  -2.577
  502   2HG   ARG1171           HG1      ARG1171 -17.374   9.959  -2.384
  503   1HD   ARG1171           HD2      ARG1171 -16.523  10.820  -0.255
  504   2HD   ARG1171           HD1      ARG1171 -15.053   9.868  -0.460
  505    HE   ARG1171           HE       ARG1171 -15.431  11.523  -2.708
  506   1HH1  ARG1171          1HH1      ARG1171 -14.553  11.688   0.660
  507   2HH1  ARG1171          2HH1      ARG1171 -13.587  13.113   0.470
  508   1HH2  ARG1171          1HH2      ARG1171 -14.161  13.397  -2.967
  509   2HH2  ARG1171          2HH2      ARG1171 -13.364  14.084  -1.591
  510    H    GLU1172           HN       GLU1172 -17.974   8.688  -3.984
  511    HA   GLU1172           HA       GLU1172 -20.568   9.782  -3.730
  512   1HB   GLU1172           HB2      GLU1172 -18.806   9.565  -6.178
  513   2HB   GLU1172           HB1      GLU1172 -20.224  10.595  -6.031
  514   1HG   GLU1172           HG2      GLU1172 -19.138  11.848  -4.245
  515   2HG   GLU1172           HG1      GLU1172 -17.720  10.809  -4.375
  516    H    ILE1173           HN       ILE1173 -19.763   6.673  -4.336
  517    HA   ILE1173           HA       ILE1173 -22.157   6.241  -5.989
  518    HB   ILE1173           HB       ILE1173 -19.491   4.889  -6.051
  519   1HG1  ILE1173          2HG1      ILE1173 -20.340   4.957  -8.578
  520   2HG1  ILE1173          1HG1      ILE1173 -21.338   6.257  -7.931
  521   1HG2  ILE1173          2HG2      ILE1173 -22.068   3.640  -6.973
  522   2HG2  ILE1173          1HG2      ILE1173 -20.449   3.049  -7.347
  523   3HG2  ILE1173          3HG2      ILE1173 -21.021   3.057  -5.679
  524   1HD1  ILE1173          3HD1      ILE1173 -19.332   7.383  -7.125
  525   2HD1  ILE1173          2HD1      ILE1173 -18.346   6.087  -7.802
  526   3HD1  ILE1173          1HD1      ILE1173 -19.293   7.126  -8.870
  527    H    MET1174           HN       MET1174 -20.255   5.092  -3.232
  528    HA   MET1174           HA       MET1174 -22.163   3.019  -2.632
  529   1HB   MET1174           HB2      MET1174 -20.735   2.763  -0.548
  530   2HB   MET1174           HB1      MET1174 -19.932   2.461  -2.082
  531   1HG   MET1174           HG2      MET1174 -18.525   4.187  -1.838
  532   2HG   MET1174           HG1      MET1174 -19.749   5.221  -1.106
  533   1HE   MET1174           HE3      MET1174 -20.775   3.383   1.292
  534   2HE   MET1174           HE2      MET1174 -19.746   3.956   2.606
  535   3HE   MET1174           HE1      MET1174 -20.439   5.106   1.462
  536    H    GLU1175           HN       GLU1175 -20.924   5.785  -0.742
  537    HA   GLU1175           HA       GLU1175 -23.118   5.765   1.050
  538   1HB   GLU1175           HB2      GLU1175 -22.065   7.530   2.123
  539   2HB   GLU1175           HB1      GLU1175 -20.701   6.759   1.315
  540   1HG   GLU1175           HG2      GLU1175 -20.779   8.408  -0.450
  541   2HG   GLU1175           HG1      GLU1175 -22.206   9.151   0.268
  542    H    ASN1176           HN       ASN1176 -23.401   6.242  -2.051
  543    HA   ASN1176           HA       ASN1176 -25.114   8.611  -1.858
  544   1HB   ASN1176           HB2      ASN1176 -23.382   7.511  -3.993
  545   2HB   ASN1176           HB1      ASN1176 -24.875   8.290  -4.495
  546   1HD2  ASN1176          1HD2      ASN1176 -23.851  10.021  -5.448
  547   2HD2  ASN1176          2HD2      ASN1176 -23.035  11.242  -4.540
  548    H    TYR1177           HN       TYR1177 -25.052   5.286  -3.245
  549    HA   TYR1177           HA       TYR1177 -27.904   5.631  -3.768
  550   1HB   TYR1177           HB2      TYR1177 -27.789   3.544  -5.096
  551   2HB   TYR1177           HB1      TYR1177 -26.780   4.843  -5.704
  552    HD1  TYR1177           HD1      TYR1177 -25.749   2.712  -2.867
  553    HD2  TYR1177           HD2      TYR1177 -25.418   3.459  -7.041
  554    HE1  TYR1177           HE1      TYR1177 -23.842   1.166  -2.992
  555    HE2  TYR1177           HE2      TYR1177 -23.510   1.921  -7.174
  556    HH   TYR1177           HH       TYR1177 -21.827   0.956  -5.747
  557    H    ASN1178           HN       ASN1178 -27.251   5.404  -1.124
  558    HA   ASN1178           HA       ASN1178 -28.362   4.519   0.649
  559   1HB   ASN1178           HB2      ASN1178 -29.200   2.248  -1.142
  560   2HB   ASN1178           HB1      ASN1178 -29.861   2.642   0.441
  561   1HD2  ASN1178          1HD2      ASN1178 -31.166   2.436  -2.151
  562   2HD2  ASN1178          2HD2      ASN1178 -31.936   3.957  -2.416
  563    H    ILE1179           HN       ILE1179 -25.498   3.788   0.022
  564    HA   ILE1179           HA       ILE1179 -25.527   1.557   1.916
  565    HB   ILE1179           HB       ILE1179 -23.984   0.194   0.815
  566   1HG1  ILE1179          2HG1      ILE1179 -23.644   2.183  -1.418
  567   2HG1  ILE1179          1HG1      ILE1179 -22.590   2.170  -0.007
  568   1HG2  ILE1179          3HG2      ILE1179 -25.890   1.237  -1.272
  569   2HG2  ILE1179          2HG2      ILE1179 -25.036  -0.305  -1.343
  570   3HG2  ILE1179          1HG2      ILE1179 -26.226  -0.014  -0.074
  571   1HD1  ILE1179          3HD1      ILE1179 -22.999  -0.116  -1.913
  572   2HD1  ILE1179          2HD1      ILE1179 -21.607   0.966  -1.872
  573   3HD1  ILE1179          1HD1      ILE1179 -21.928  -0.111  -0.512
  574    H    ALA1180           HN       ALA1180 -24.256   1.852   3.578
  575    HA   ALA1180           HA       ALA1180 -22.136   3.886   3.381
  576   1HB   ALA1180           HB1      ALA1180 -24.021   4.580   4.797
  577   2HB   ALA1180           HB3      ALA1180 -23.780   3.153   5.804
  578   3HB   ALA1180           HB2      ALA1180 -22.534   4.399   5.728
  579    H    LEU1181           HN       LEU1181 -21.726   2.798   6.354
  580    HA   LEU1181           HA       LEU1181 -20.203   0.407   5.592
  581   1HB   LEU1181           HB2      LEU1181 -19.093   2.916   6.254
  582   2HB   LEU1181           HB1      LEU1181 -18.800   1.861   7.624
  583    HG   LEU1181           HG       LEU1181 -18.181   0.486   5.170
  584   1HD1  LEU1181          2HD1      LEU1181 -17.807   2.721   4.267
  585   2HD1  LEU1181          1HD1      LEU1181 -16.731   3.090   5.616
  586   3HD1  LEU1181          3HD1      LEU1181 -16.290   1.841   4.451
  587   1HD2  LEU1181          1HD2      LEU1181 -16.517   1.363   7.523
  588   2HD2  LEU1181          3HD2      LEU1181 -17.361  -0.176   7.348
  589   3HD2  LEU1181          2HD2      LEU1181 -16.009   0.215   6.285
  590    H    ARG1182           HN       ARG1182 -19.372  -0.761   7.588
  591    HA   ARG1182           HA       ARG1182 -21.532  -1.565   9.163
  592   1HB   ARG1182           HB2      ARG1182 -19.549  -2.956   8.702
  593   2HB   ARG1182           HB1      ARG1182 -18.579  -1.899   9.718
  594   1HG   ARG1182           HG2      ARG1182 -19.905  -2.521  11.659
  595   2HG   ARG1182           HG1      ARG1182 -20.915  -3.556  10.646
  596   1HD   ARG1182           HD2      ARG1182 -19.200  -4.822  11.873
  597   2HD   ARG1182           HD1      ARG1182 -19.020  -4.961  10.126
  598    HE   ARG1182           HE       ARG1182 -17.354  -2.944  10.686
  599   1HH1  ARG1182          1HH1      ARG1182 -17.766  -6.074  12.162
  600   2HH1  ARG1182          2HH1      ARG1182 -16.108  -6.209  12.639
  601   1HH2  ARG1182          1HH2      ARG1182 -15.168  -3.115  11.312
  602   2HH2  ARG1182          2HH2      ARG1182 -14.630  -4.528  12.157
  603    H    TRP1183           HN       TRP1183 -19.535   1.147   9.448
  604    HA   TRP1183           HA       TRP1183 -20.169   1.480  12.295
  605   1HB   TRP1183           HB2      TRP1183 -18.204   3.049  10.610
  606   2HB   TRP1183           HB1      TRP1183 -18.382   3.117  12.362
  607    HD1  TRP1183           HD1      TRP1183 -17.697   0.266   9.794
  608    HE1  TRP1183           HE1      TRP1183 -15.856  -1.247  10.765
  609    HE3  TRP1183           HE3      TRP1183 -16.891   2.703  14.220
  610    HZ2  TRP1183           HZ2      TRP1183 -14.269  -1.381  13.079
  611    HZ3  TRP1183           HZ3      TRP1183 -15.186   1.814  15.756
  612    HH2  TRP1183           HH2      TRP1183 -13.902  -0.188  15.197
  613    H    THR1184           HN       THR1184 -21.184   2.362   9.254
  614    HA   THR1184           HA       THR1184 -22.531   3.979   8.386
  615    HB   THR1184           HB       THR1184 -24.495   4.493   9.649
  616    HG1  THR1184           HG1      THR1184 -24.362   3.724  12.005
  617   1HG2  THR1184          3HG2      THR1184 -23.482   1.764  10.452
  618   2HG2  THR1184          2HG2      THR1184 -25.168   2.281  10.469
  619   3HG2  THR1184          1HG2      THR1184 -24.296   2.163   8.940
  620    H    ALA1185           HN       ALA1185 -20.033   4.968   9.306
  621    HA   ALA1185           HA       ALA1185 -20.579   7.482  10.650
  622   1HB   ALA1185           HB3      ALA1185 -17.985   6.391   9.566
  623   2HB   ALA1185           HB1      ALA1185 -18.564   6.215  11.223
  624   3HB   ALA1185           HB2      ALA1185 -18.170   7.814  10.592
  625    H    LYS1186           HN       LYS1186 -21.279   6.616   7.688
  626    HA   LYS1186           HA       LYS1186 -21.673   7.731   5.759
  627   1HB   LYS1186           HB2      LYS1186 -20.813  10.053   7.471
  628   2HB   LYS1186           HB1      LYS1186 -21.213  10.259   5.771
  629   1HG   LYS1186           HG2      LYS1186 -23.140  10.819   7.035
  630   2HG   LYS1186           HG1      LYS1186 -23.452   9.263   6.263
  631   1HD   LYS1186           HD2      LYS1186 -22.894   8.114   8.349
  632   2HD   LYS1186           HD1      LYS1186 -22.577   9.669   9.122
  633   1HE   LYS1186           HE2      LYS1186 -24.903  10.328   8.746
  634   2HE   LYS1186           HE1      LYS1186 -25.220   8.773   7.975
  635   1HZ   LYS1186           HZ1      LYS1186 -24.687   7.673  10.061
  636   2HZ   LYS1186           HZ3      LYS1186 -24.388   9.166  10.800
  637   3HZ   LYS1186           HZ2      LYS1186 -25.949   8.780  10.274
  638    H    GLN1187           HN       GLN1187 -20.406   7.062   4.210
  639    HA   GLN1187           HA       GLN1187 -18.695   7.094   2.687
  640   1HB   GLN1187           HB2      GLN1187 -18.470   9.536   3.267
  641   2HB   GLN1187           HB1      GLN1187 -17.300   9.078   4.494
  642   1HG   GLN1187           HG2      GLN1187 -15.921   8.054   2.693
  643   2HG   GLN1187           HG1      GLN1187 -17.046   8.743   1.522
  644   1HE2  GLN1187          1HE2      GLN1187 -14.534   9.397   3.817
  645   2HE2  GLN1187          2HE2      GLN1187 -14.261  11.041   3.362
  646    H    LYS1188           HN       LYS1188 -16.417   7.859   5.193
  647    HA   LYS1188           HA       LYS1188 -14.633   6.634   5.969
  648   1HB   LYS1188           HB2      LYS1188 -16.656   6.237   7.486
  649   2HB   LYS1188           HB1      LYS1188 -16.768   4.655   6.730
  650   1HG   LYS1188           HG2      LYS1188 -14.520   4.111   7.496
  651   2HG   LYS1188           HG1      LYS1188 -14.382   5.708   8.235
  652   1HD   LYS1188           HD2      LYS1188 -16.299   5.180   9.687
  653   2HD   LYS1188           HD1      LYS1188 -16.376   3.567   8.973
  654   1HE   LYS1188           HE2      LYS1188 -14.039   4.717  10.493
  655   2HE   LYS1188           HE1      LYS1188 -15.202   3.549  11.121
  656   1HZ   LYS1188           HZ2      LYS1188 -14.478   1.978   9.432
  657   2HZ   LYS1188           HZ1      LYS1188 -13.361   3.099   8.834
  658   3HZ   LYS1188           HZ3      LYS1188 -13.174   2.466  10.393
  659    H    LEU1189           HN       LEU1189 -15.475   5.927   3.164
  660    HA   LEU1189           HA       LEU1189 -15.070   3.107   2.891
  661   1HB   LEU1189           HB2      LEU1189 -15.221   3.465   0.545
  662   2HB   LEU1189           HB1      LEU1189 -16.431   4.451   1.331
  663    HG   LEU1189           HG       LEU1189 -15.668   5.915  -0.248
  664   1HD1  LEU1189          1HD1      LEU1189 -15.353   6.964   1.931
  665   2HD1  LEU1189          3HD1      LEU1189 -13.684   6.400   1.958
  666   3HD1  LEU1189          2HD1      LEU1189 -14.202   7.565   0.739
  667   1HD2  LEU1189          2HD2      LEU1189 -13.981   4.415  -1.172
  668   2HD2  LEU1189          1HD2      LEU1189 -13.384   6.070  -1.056
  669   3HD2  LEU1189          3HD2      LEU1189 -12.873   4.863   0.123
  670    H    TYR1190           HN       TYR1190 -12.928   5.088   4.021
  671    HA   TYR1190           HA       TYR1190 -10.730   4.277   2.261
  672   1HB   TYR1190           HB2      TYR1190 -11.088   6.496   4.227
  673   2HB   TYR1190           HB1      TYR1190  -9.460   5.917   3.882
  674    HD1  TYR1190           HD1      TYR1190 -11.894   5.703   1.194
  675    HD2  TYR1190           HD2      TYR1190  -8.953   8.193   3.023
  676    HE1  TYR1190           HE1      TYR1190 -11.812   7.107  -0.830
  677    HE2  TYR1190           HE2      TYR1190  -8.874   9.594   1.004
  678    HH   TYR1190           HH       TYR1190 -11.189   9.393  -1.468
  679    H    SER1191           HN       SER1191  -9.930   2.379   2.768
  680    HA   SER1191           HA       SER1191  -9.318   1.808   5.594
  681   1HB   SER1191           HB2      SER1191 -10.104  -0.102   3.381
  682   2HB   SER1191           HB1      SER1191  -9.480  -0.620   4.948
  683    HG   SER1191           HG       SER1191 -11.563  -0.591   5.390
  684    H    ARG1192           HN       ARG1192  -7.528   0.003   5.659
  685    HA   ARG1192           HA       ARG1192  -5.348   0.972   3.950
  686   1HB   ARG1192           HB2      ARG1192  -5.161   1.040   6.483
  687   2HB   ARG1192           HB1      ARG1192  -5.114  -0.716   6.443
  688   1HG   ARG1192           HG2      ARG1192  -3.078  -0.689   5.173
  689   2HG   ARG1192           HG1      ARG1192  -3.154   1.067   5.016
  690   1HD   ARG1192           HD2      ARG1192  -1.565   0.409   6.744
  691   2HD   ARG1192           HD1      ARG1192  -2.920   1.302   7.432
  692    HE   ARG1192           HE       ARG1192  -3.509  -1.423   7.584
  693   1HH1  ARG1192          1HH1      ARG1192  -1.249   0.866   8.922
  694   2HH1  ARG1192          2HH1      ARG1192  -1.051  -0.002  10.408
  695   1HH2  ARG1192          1HH2      ARG1192  -3.254  -2.573   9.538
  696   2HH2  ARG1192          2HH2      ARG1192  -2.189  -1.957  10.757
  697    H    THR1193           HN       THR1193  -4.444  -0.341   2.449
  698    HA   THR1193           HA       THR1193  -5.640  -2.659   1.586
  699    HB   THR1193           HB       THR1193  -2.715  -1.933   1.312
  700    HG1  THR1193           HG1      THR1193  -4.282  -1.699  -0.897
  701   1HG2  THR1193          1HG2      THR1193  -3.068  -4.313   0.881
  702   2HG2  THR1193          3HG2      THR1193  -4.366  -3.923  -0.247
  703   3HG2  THR1193          2HG2      THR1193  -2.707  -3.451  -0.614
  704    H    GLY1194           HN       GLY1194  -6.041  -4.389   2.769
  705   1HA   GLY1194           HA1      GLY1194  -3.985  -5.330   4.648
  706   2HA   GLY1194           HA2      GLY1194  -4.702  -6.449   3.495
  707    H    GLU1195           HN       GLU1195  -6.340  -3.849   5.219
  708    HA   GLU1195           HA       GLU1195  -7.564  -5.688   7.093
  709   1HB   GLU1195           HB2      GLU1195  -8.025  -2.733   6.642
  710   2HB   GLU1195           HB1      GLU1195  -8.706  -3.677   7.960
  711   1HG   GLU1195           HG2      GLU1195  -6.454  -4.139   8.791
  712   2HG   GLU1195           HG1      GLU1195  -5.777  -3.184   7.472
  713    H    SER1196           HN       SER1196  -9.775  -6.139   7.239
  714    HA   SER1196           HA       SER1196 -11.115  -6.251   4.679
  715   1HB   SER1196           HB2      SER1196 -12.800  -7.600   5.882
  716   2HB   SER1196           HB1      SER1196 -11.167  -8.211   6.142
  717    HG   SER1196           HG       SER1196 -12.939  -7.062   7.927
  718    H    VAL1197           HN       VAL1197 -12.883  -5.125   4.058
  719    HA   VAL1197           HA       VAL1197 -13.776  -2.979   5.861
  720    HB   VAL1197           HB       VAL1197 -14.199  -3.091   2.876
  721   1HG1  VAL1197          2HG1      VAL1197 -15.675  -1.582   4.095
  722   2HG1  VAL1197          1HG1      VAL1197 -14.281  -0.817   4.859
  723   3HG1  VAL1197          3HG1      VAL1197 -14.522  -0.673   3.118
  724   1HG2  VAL1197          1HG2      VAL1197 -11.949  -1.775   4.396
  725   2HG2  VAL1197          3HG2      VAL1197 -11.805  -3.159   3.312
  726   3HG2  VAL1197          2HG2      VAL1197 -12.273  -1.583   2.673
  727    H    GLU1198           HN       GLU1198 -16.088  -2.342   5.654
  728    HA   GLU1198           HA       GLU1198 -17.891  -4.457   4.782
  729   1HB   GLU1198           HB2      GLU1198 -17.129  -4.800   7.227
  730   2HB   GLU1198           HB1      GLU1198 -18.136  -3.406   7.588
  731   1HG   GLU1198           HG2      GLU1198 -19.086  -5.957   6.304
  732   2HG   GLU1198           HG1      GLU1198 -19.271  -5.524   8.005
  733    H    PHE1199           HN       PHE1199 -19.249  -3.350   3.501
  734    HA   PHE1199           HA       PHE1199 -20.072  -0.649   4.308
  735   1HB   PHE1199           HB2      PHE1199 -20.458  -2.055   1.655
  736   2HB   PHE1199           HB1      PHE1199 -20.883  -0.385   2.008
  737    HD1  PHE1199           HD1      PHE1199 -19.288   1.341   1.849
  738    HD2  PHE1199           HD2      PHE1199 -18.069  -2.732   1.670
  739    HE1  PHE1199           HE1      PHE1199 -17.036   2.055   1.119
  740    HE2  PHE1199           HE2      PHE1199 -15.832  -2.040   0.952
  741    HZ   PHE1199           HZ       PHE1199 -15.305   0.354   0.677
  742    H    VAL1200           HN       VAL1200 -22.088  -0.231   4.981
  743    HA   VAL1200           HA       VAL1200 -24.044  -2.427   4.902
  744    HB   VAL1200           HB       VAL1200 -25.231  -1.295   6.679
  745   1HG1  VAL1200          2HG1      VAL1200 -22.270  -1.395   7.247
  746   2HG1  VAL1200          1HG1      VAL1200 -23.549  -1.388   8.462
  747   3HG1  VAL1200          3HG1      VAL1200 -23.400  -2.747   7.348
  748   1HG2  VAL1200          2HG2      VAL1200 -23.167   0.885   6.419
  749   2HG2  VAL1200          1HG2      VAL1200 -24.871   1.003   5.983
  750   3HG2  VAL1200          3HG2      VAL1200 -24.406   0.788   7.670
  751    H    CYS1201           HN       CYS1201 -26.368  -0.956   5.245
  752    HA   CYS1201           HA       CYS1201 -26.473   0.632   2.767
  753   1HB   CYS1201           HB2      CYS1201 -28.988  -0.621   3.662
  754   2HB   CYS1201           HB1      CYS1201 -28.328  -0.436   2.038
  755    H    LYS1202           HN       LYS1202 -27.714   2.479   2.772
  756    HA   LYS1202           HA       LYS1202 -27.804   4.017   5.037
  757   1HB   LYS1202           HB2      LYS1202 -28.065   4.852   2.718
  758   2HB   LYS1202           HB1      LYS1202 -29.706   4.223   2.704
  759   1HG   LYS1202           HG2      LYS1202 -30.267   5.711   4.580
  760   2HG   LYS1202           HG1      LYS1202 -28.635   6.377   4.510
  761   1HD   LYS1202           HD2      LYS1202 -29.099   6.970   2.113
  762   2HD   LYS1202           HD1      LYS1202 -30.784   6.532   2.410
  763   1HE   LYS1202           HE2      LYS1202 -30.922   8.214   4.164
  764   2HE   LYS1202           HE1      LYS1202 -29.221   8.619   3.928
  765   1HZ   LYS1202           HZ1      LYS1202 -29.746   9.346   1.682
  766   2HZ   LYS1202           HZ3      LYS1202 -31.377   8.957   1.910
  767   3HZ   LYS1202           HZ2      LYS1202 -30.669  10.199   2.814
  768    H    ARG1203           HN       ARG1203 -28.674   3.240   6.849
  769    HA   ARG1203           HA       ARG1203 -30.236   1.901   8.058
  770   1HB   ARG1203           HB2      ARG1203 -31.820   3.713   8.864
  771   2HB   ARG1203           HB1      ARG1203 -30.105   4.015   9.030
  772   1HG   ARG1203           HG2      ARG1203 -30.111   5.455   7.110
  773   2HG   ARG1203           HG1      ARG1203 -31.795   5.056   6.777
  774   1HD   ARG1203           HD2      ARG1203 -31.617   7.230   7.861
  775   2HD   ARG1203           HD1      ARG1203 -32.462   6.079   8.894
  776    HE   ARG1203           HE       ARG1203 -29.813   5.960   9.640
  777   1HH1  ARG1203          1HH1      ARG1203 -32.302   8.396   9.509
  778   2HH1  ARG1203          2HH1      ARG1203 -31.668   9.299  10.845
  779   1HH2  ARG1203          1HH2      ARG1203 -28.970   7.143  11.398
  780   2HH2  ARG1203          2HH2      ARG1203 -29.774   8.586  11.917
  781    H    GLY1204           HN       GLY1204 -31.304   0.316   6.832
  782   1HA   GLY1204           HA1      GLY1204 -33.904   1.212   5.754
  783   2HA   GLY1204           HA2      GLY1204 -33.719  -0.263   6.685
  784    H    TYR1205           HN       TYR1205 -32.450   1.272   3.715
  785    HA   TYR1205           HA       TYR1205 -33.351  -0.442   1.858
  786   1HB   TYR1205           HB2      TYR1205 -30.554   0.686   1.893
  787   2HB   TYR1205           HB1      TYR1205 -31.392   0.083   0.473
  788    HD1  TYR1205           HD1      TYR1205 -33.367   1.329  -0.401
  789    HD2  TYR1205           HD2      TYR1205 -30.956   2.875   2.734
  790    HE1  TYR1205           HE1      TYR1205 -34.312   3.564  -0.789
  791    HE2  TYR1205           HE2      TYR1205 -31.892   5.117   2.360
  792    HH   TYR1205           HH       TYR1205 -34.637   5.665   0.444
  793    H    ARG1206           HN       ARG1206 -33.344  -2.501   1.552
  794    HA   ARG1206           HA       ARG1206 -31.541  -4.229   3.011
  795   1HB   ARG1206           HB2      ARG1206 -32.975  -6.029   2.200
  796   2HB   ARG1206           HB1      ARG1206 -33.940  -4.734   2.895
  797   1HG   ARG1206           HG2      ARG1206 -34.292  -3.871   0.563
  798   2HG   ARG1206           HG1      ARG1206 -33.526  -5.353  -0.017
  799   1HD   ARG1206           HD2      ARG1206 -35.942  -5.586  -0.044
  800   2HD   ARG1206           HD1      ARG1206 -35.223  -6.687   1.129
  801    HE   ARG1206           HE       ARG1206 -35.936  -4.311   2.437
  802   1HH1  ARG1206          1HH1      ARG1206 -37.418  -7.064   0.898
  803   2HH1  ARG1206          2HH1      ARG1206 -38.850  -6.999   1.869
  804   1HH2  ARG1206          1HH2      ARG1206 -37.817  -4.218   3.722
  805   2HH2  ARG1206          2HH2      ARG1206 -39.076  -5.382   3.474
  806    H    LEU1207           HN       LEU1207 -30.091  -5.653   2.135
  807    HA   LEU1207           HA       LEU1207 -28.615  -4.951  -0.079
  808   1HB   LEU1207           HB2      LEU1207 -27.981  -6.593   1.725
  809   2HB   LEU1207           HB1      LEU1207 -28.966  -7.785   0.900
  810    HG   LEU1207           HG       LEU1207 -27.495  -7.452  -1.127
  811   1HD1  LEU1207          2HD1      LEU1207 -26.586  -5.266  -0.517
  812   2HD1  LEU1207          1HD1      LEU1207 -25.767  -5.991   0.867
  813   3HD1  LEU1207          3HD1      LEU1207 -25.301  -6.448  -0.770
  814   1HD2  LEU1207          1HD2      LEU1207 -26.186  -8.445   1.401
  815   2HD2  LEU1207          3HD2      LEU1207 -27.254  -9.375   0.349
  816   3HD2  LEU1207          2HD2      LEU1207 -25.684  -8.835  -0.245
  817    H    SER1208           HN       SER1208 -29.286  -4.753  -2.107
  818    HA   SER1208           HA       SER1208 -31.597  -5.836  -3.194
  819   1HB   SER1208           HB2      SER1208 -29.102  -4.719  -4.445
  820   2HB   SER1208           HB1      SER1208 -30.449  -5.289  -5.427
  821    HG   SER1208           HG       SER1208 -31.750  -3.739  -4.527
  822    H    SER1209           HN       SER1209 -28.732  -7.440  -2.480
  823    HA   SER1209           HA       SER1209 -28.128  -9.623  -2.723
  824   1HB   SER1209           HB2      SER1209 -30.501 -10.231  -2.674
  825   2HB   SER1209           HB1      SER1209 -30.635  -9.888  -4.399
  826    HG   SER1209           HG       SER1209 -30.222 -11.977  -4.463
  827    H    ARG1210           HN       ARG1210 -29.391  -8.261  -5.767
  828    HA   ARG1210           HA       ARG1210 -27.736  -9.662  -7.516
  829   1HB   ARG1210           HB2      ARG1210 -28.847  -6.862  -7.790
  830   2HB   ARG1210           HB1      ARG1210 -28.153  -7.801  -9.104
  831   1HG   ARG1210           HG2      ARG1210 -30.566  -8.628  -7.505
  832   2HG   ARG1210           HG1      ARG1210 -30.625  -7.810  -9.068
  833   1HD   ARG1210           HD2      ARG1210 -29.355 -10.491  -8.524
  834   2HD   ARG1210           HD1      ARG1210 -30.914 -10.228  -9.306
  835    HE   ARG1210           HE       ARG1210 -28.868  -8.827 -10.671
  836   1HH1  ARG1210          1HH1      ARG1210 -30.132 -12.035 -10.168
  837   2HH1  ARG1210          2HH1      ARG1210 -29.577 -12.633 -11.696
  838   1HH2  ARG1210          1HH2      ARG1210 -28.133  -9.606 -12.685
  839   2HH2  ARG1210          2HH2      ARG1210 -28.441 -11.252 -13.126
  840    H    SER1211           HN       SER1211 -27.004  -7.207  -5.275
  841    HA   SER1211           HA       SER1211 -24.761  -6.020  -6.504
  842   1HB   SER1211           HB2      SER1211 -25.577  -6.312  -3.609
  843   2HB   SER1211           HB1      SER1211 -24.154  -5.400  -4.116
  844    HG   SER1211           HG       SER1211 -25.455  -3.974  -5.187
  845    H    HIS1212           HN       HIS1212 -22.569  -6.205  -5.098
  846    HA   HIS1212           HA       HIS1212 -21.642  -8.889  -5.626
  847   1HB   HIS1212           HB2      HIS1212 -20.166  -6.454  -4.609
  848   2HB   HIS1212           HB1      HIS1212 -19.412  -7.974  -5.075
  849    HD1  HIS1212           HD1      HIS1212 -20.680  -4.805  -6.443
  850    HD2  HIS1212           HD2      HIS1212 -19.548  -8.530  -7.894
  851    HE1  HIS1212           HE1      HIS1212 -20.379  -4.498  -8.920
  852    HE2  HIS1212           HE2      HIS1212 -19.612  -6.745  -9.764
  853    H    THR1213           HN       THR1213 -20.733  -6.866  -2.856
  854    HA   THR1213           HA       THR1213 -21.932  -8.553  -0.907
  855    HB   THR1213           HB       THR1213 -20.298 -10.175  -1.309
  856    HG1  THR1213           HG1      THR1213 -20.434  -9.459   0.932
  857   1HG2  THR1213          2HG2      THR1213 -18.234  -7.976  -1.387
  858   2HG2  THR1213          1HG2      THR1213 -17.902  -9.700  -1.541
  859   3HG2  THR1213          3HG2      THR1213 -18.847  -8.870  -2.778
  860    H    LEU1214           HN       LEU1214 -21.106  -8.053   1.319
  861    HA   LEU1214           HA       LEU1214 -20.665  -5.169   1.517
  862   1HB   LEU1214           HB2      LEU1214 -21.359  -7.117   3.706
  863   2HB   LEU1214           HB1      LEU1214 -21.485  -5.368   3.760
  864    HG   LEU1214           HG       LEU1214 -23.092  -7.045   1.843
  865   1HD1  LEU1214          2HD1      LEU1214 -23.850  -6.115   4.605
  866   2HD1  LEU1214          1HD1      LEU1214 -24.954  -6.819   3.424
  867   3HD1  LEU1214          3HD1      LEU1214 -23.631  -7.783   4.077
  868   1HD2  LEU1214          2HD2      LEU1214 -22.727  -4.582   1.441
  869   2HD2  LEU1214          1HD2      LEU1214 -24.410  -5.104   1.561
  870   3HD2  LEU1214          3HD2      LEU1214 -23.638  -4.295   2.924
  871    H    ARG1215           HN       ARG1215 -19.387  -8.206   2.818
  872    HA   ARG1215           HA       ARG1215 -17.101  -6.797   3.957
  873   1HB   ARG1215           HB2      ARG1215 -18.167  -8.513   5.323
  874   2HB   ARG1215           HB1      ARG1215 -17.889  -9.714   4.070
  875   1HG   ARG1215           HG2      ARG1215 -15.479  -9.479   4.371
  876   2HG   ARG1215           HG1      ARG1215 -15.753  -8.262   5.620
  877   1HD   ARG1215           HD2      ARG1215 -16.957  -9.925   6.962
  878   2HD   ARG1215           HD1      ARG1215 -16.655 -11.139   5.718
  879    HE   ARG1215           HE       ARG1215 -14.198 -10.067   6.495
  880   1HH1  ARG1215          1HH1      ARG1215 -16.777 -11.987   7.836
  881   2HH1  ARG1215          2HH1      ARG1215 -15.747 -12.835   8.938
  882   1HH2  ARG1215          1HH2      ARG1215 -12.833 -11.179   7.944
  883   2HH2  ARG1215          2HH2      ARG1215 -13.504 -12.376   9.000
  884    H    THR1216           HN       THR1216 -15.347  -6.462   2.791
  885    HA   THR1216           HA       THR1216 -14.483  -8.523   0.888
  886    HB   THR1216           HB       THR1216 -15.498  -6.944  -0.556
  887    HG1  THR1216           HG1      THR1216 -12.829  -6.039  -0.636
  888   1HG2  THR1216          1HG2      THR1216 -15.725  -5.093   1.020
  889   2HG2  THR1216          3HG2      THR1216 -13.990  -4.788   0.922
  890   3HG2  THR1216          2HG2      THR1216 -15.011  -4.542  -0.496
  891    H    THR1217           HN       THR1217 -12.196  -7.740   0.002
  892    HA   THR1217           HA       THR1217 -10.596  -7.070   2.385
  893    HB   THR1217           HB       THR1217 -10.076  -8.981   0.129
  894    HG1  THR1217           HG1      THR1217 -10.938  -9.380   2.460
  895   1HG2  THR1217          2HG2      THR1217  -8.094  -7.526   0.271
  896   2HG2  THR1217          1HG2      THR1217  -7.977  -7.866   1.998
  897   3HG2  THR1217          3HG2      THR1217  -7.743  -9.164   0.826
  898    H    CYS1218           HN       CYS1218  -9.126  -5.474   2.285
  899    HA   CYS1218           HA       CYS1218  -9.176  -3.616   0.148
  900   1HB   CYS1218           HB2      CYS1218  -7.538  -3.941   2.638
  901   2HB   CYS1218           HB1      CYS1218  -7.051  -2.762   1.423
  902    H    TRP1219           HN       TRP1219  -8.397  -4.195  -1.811
  903    HA   TRP1219           HA       TRP1219  -5.618  -5.116  -1.888
  904   1HB   TRP1219           HB2      TRP1219  -7.548  -6.953  -2.199
  905   2HB   TRP1219           HB1      TRP1219  -7.438  -6.380  -3.861
  906    HD1  TRP1219           HD1      TRP1219  -4.725  -6.348  -4.802
  907    HE1  TRP1219           HE1      TRP1219  -2.993  -8.228  -4.522
  908    HE3  TRP1219           HE3      TRP1219  -6.841  -8.845  -0.875
  909    HZ2  TRP1219           HZ2      TRP1219  -2.575 -10.465  -2.879
  910    HZ3  TRP1219           HZ3      TRP1219  -5.709 -10.851  -0.007
  911    HH2  TRP1219           HH2      TRP1219  -3.618 -11.645  -0.991
  912    H    ASP1220           HN       ASP1220  -4.512  -3.745  -3.057
  913    HA   ASP1220           HA       ASP1220  -3.901  -2.248  -4.654
  914   1HB   ASP1220           HB2      ASP1220  -4.438  -4.213  -6.120
  915   2HB   ASP1220           HB1      ASP1220  -6.052  -3.544  -6.341
  916    H    GLY1221           HN       GLY1221  -6.487  -1.944  -2.920
  917   1HA   GLY1221           HA1      GLY1221  -7.085   0.710  -3.872
  918   2HA   GLY1221           HA2      GLY1221  -7.743  -0.058  -2.433
  919    H    LYS1222           HN       LYS1222  -8.632  -2.421  -3.932
  920    HA   LYS1222           HA       LYS1222 -10.980  -1.204  -5.224
  921   1HB   LYS1222           HB2      LYS1222  -9.074  -2.672  -6.558
  922   2HB   LYS1222           HB1      LYS1222 -10.295  -3.880  -6.173
  923   1HG   LYS1222           HG2      LYS1222 -10.879  -1.280  -7.560
  924   2HG   LYS1222           HG1      LYS1222 -10.586  -2.810  -8.388
  925   1HD   LYS1222           HD2      LYS1222 -12.764  -2.368  -6.348
  926   2HD   LYS1222           HD1      LYS1222 -13.001  -2.263  -8.094
  927   1HE   LYS1222           HE2      LYS1222 -12.060  -4.694  -6.576
  928   2HE   LYS1222           HE1      LYS1222 -13.678  -4.447  -7.232
  929   1HZ   LYS1222           HZ1      LYS1222 -11.176  -4.608  -8.825
  930   2HZ   LYS1222           HZ3      LYS1222 -12.337  -5.830  -8.684
  931   3HZ   LYS1222           HZ2      LYS1222 -12.730  -4.375  -9.452
  932    H    LEU1223           HN       LEU1223 -12.897  -1.948  -4.608
  933    HA   LEU1223           HA       LEU1223 -13.038  -4.438  -3.062
  934   1HB   LEU1223           HB2      LEU1223 -14.480  -1.911  -2.306
  935   2HB   LEU1223           HB1      LEU1223 -14.492  -3.437  -1.444
  936    HG   LEU1223           HG       LEU1223 -11.927  -3.046  -1.239
  937   1HD1  LEU1223          2HD1      LEU1223 -11.873  -1.101  -2.741
  938   2HD1  LEU1223          1HD1      LEU1223 -12.930  -0.229  -1.631
  939   3HD1  LEU1223          3HD1      LEU1223 -11.310  -0.701  -1.117
  940   1HD2  LEU1223          1HD2      LEU1223 -13.690  -3.077   0.536
  941   2HD2  LEU1223          3HD2      LEU1223 -12.294  -2.060   0.882
  942   3HD2  LEU1223          2HD2      LEU1223 -13.808  -1.327   0.352
  943    H    GLU1224           HN       GLU1224 -15.494  -4.886  -2.622
  944    HA   GLU1224           HA       GLU1224 -16.908  -4.546  -5.182
  945   1HB   GLU1224           HB2      GLU1224 -17.203  -6.755  -3.137
  946   2HB   GLU1224           HB1      GLU1224 -18.066  -6.645  -4.665
  947   1HG   GLU1224           HG2      GLU1224 -15.944  -6.831  -5.870
  948   2HG   GLU1224           HG1      GLU1224 -15.093  -6.967  -4.333
  949    H    TYR1225           HN       TYR1225 -17.460  -2.425  -4.046
  950    HA   TYR1225           HA       TYR1225 -19.099  -2.259  -1.826
  951   1HB   TYR1225           HB2      TYR1225 -19.984  -0.113  -2.974
  952   2HB   TYR1225           HB1      TYR1225 -18.288  -0.205  -2.528
  953    HD1  TYR1225           HD1      TYR1225 -20.546   0.587  -5.100
  954    HD2  TYR1225           HD2      TYR1225 -16.669  -1.024  -4.437
  955    HE1  TYR1225           HE1      TYR1225 -19.912   1.189  -7.395
  956    HE2  TYR1225           HE2      TYR1225 -16.023  -0.435  -6.733
  957    HH   TYR1225           HH       TYR1225 -17.105   0.009  -8.897
  958    HA   PRO1226           HA       PRO1226 -22.855  -4.199  -3.149
  959   1HB   PRO1226           HB2      PRO1226 -24.362  -3.523  -1.012
  960   2HB   PRO1226           HB1      PRO1226 -23.089  -4.748  -0.926
  961   1HG   PRO1226           HG2      PRO1226 -22.985  -1.854  -0.131
  962   2HG   PRO1226           HG1      PRO1226 -22.415  -3.275   0.764
  963   1HD   PRO1226           HD2      PRO1226 -20.745  -1.712  -0.657
  964   2HD   PRO1226           HD1      PRO1226 -20.501  -3.465  -0.516
  965    H    THR1227           HN       THR1227 -25.359  -3.330  -2.528
  966    HA   THR1227           HA       THR1227 -25.901  -0.613  -3.126
  967    HB   THR1227           HB       THR1227 -26.423  -2.528  -5.417
  968    HG1  THR1227           HG1      THR1227 -24.521  -1.968  -6.132
  969   1HG2  THR1227          1HG2      THR1227 -26.819   0.457  -5.167
  970   2HG2  THR1227          3HG2      THR1227 -27.093  -0.498  -6.625
  971   3HG2  THR1227          2HG2      THR1227 -28.095  -0.760  -5.197
  972    H    CYS1228           HN       CYS1228 -27.163  -1.232  -1.226
  973    HA   CYS1228           HA       CYS1228 -29.265  -3.161  -1.452
  974   1HB   CYS1228           HB2      CYS1228 -28.915  -0.995   0.626
  975   2HB   CYS1228           HB1      CYS1228 -29.898  -2.451   0.772
  976    H    ALA1229           HN       ALA1229 -31.567  -2.248  -0.627
  977    HA   ALA1229           HA       ALA1229 -32.318   0.224  -1.873
  978   1HB   ALA1229           HB2      ALA1229 -33.360  -2.331  -3.060
  979   2HB   ALA1229           HB3      ALA1229 -32.133  -1.304  -3.804
  980   3HB   ALA1229           HB1      ALA1229 -33.769  -0.690  -3.556
  981    H    LYS1230           HN       LYS1230 -34.517   0.775  -1.593
  982    HA   LYS1230           HA       LYS1230 -36.392   1.012  -0.381
  983   1HB   LYS1230           HB2      LYS1230 -37.307  -0.845  -1.432
  984   2HB   LYS1230           HB1      LYS1230 -36.179  -1.955  -0.671
  985   1HG   LYS1230           HG2      LYS1230 -37.327  -1.820   1.399
  986   2HG   LYS1230           HG1      LYS1230 -38.365  -0.519   0.810
  987   1HD   LYS1230           HD2      LYS1230 -39.324  -2.054  -0.848
  988   2HD   LYS1230           HD1      LYS1230 -38.295  -3.351  -0.236
  989   1HE   LYS1230           HE2      LYS1230 -39.375  -3.173   1.952
  990   2HE   LYS1230           HE1      LYS1230 -40.404  -1.879   1.339
  991   1HZ   LYS1230           HZ2      LYS1230 -40.360  -4.673   0.333
  992   2HZ   LYS1230           HZ1      LYS1230 -41.552  -4.001   1.327
  993   3HZ   LYS1230           HZ3      LYS1230 -41.348  -3.432  -0.252
  994    H    ARG1231           HN       ARG1231 -35.472   2.098   1.330
  995    HA   ARG1231           HA       ARG1231 -34.360   0.868   3.583
  996   1HB   ARG1231           HB2      ARG1231 -33.985   2.995   4.287
  997   2HB   ARG1231           HB1      ARG1231 -34.361   3.360   2.619
  998   1HG   ARG1231           HG2      ARG1231 -36.657   3.880   3.222
  999   2HG   ARG1231           HG1      ARG1231 -36.305   3.501   4.910
 1000   1HD   ARG1231           HD2      ARG1231 -34.642   5.298   4.963
 1001   2HD   ARG1231           HD1      ARG1231 -35.001   5.678   3.278
 1002    HE   ARG1231           HE       ARG1231 -37.375   5.787   4.776
 1003   1HH1  ARG1231          1HH1      ARG1231 -34.377   7.513   4.362
 1004   2HH1  ARG1231          2HH1      ARG1231 -35.048   9.046   4.811
 1005   1HH2  ARG1231          1HH2      ARG1231 -38.267   7.799   5.369
 1006   2HH2  ARG1231          2HH2      ARG1231 -37.260   9.208   5.384

  No H/Q in entry =        1006
  Start of MODEL   26
    1    H1   GLU1103           HT2      GLU1103  41.465  -7.058   4.242
    2    H2   GLU1103           HT1      GLU1103  41.928  -7.385   2.647
    3    H3   GLU1103           HT3      GLU1103  43.057  -6.766   3.746
    4    HA   GLU1103           HA       GLU1103  41.817  -4.711   3.916
    5   1HB   GLU1103           HB2      GLU1103  42.462  -5.519   1.072
    6   2HB   GLU1103           HB1      GLU1103  42.285  -3.866   1.644
    7   1HG   GLU1103           HG2      GLU1103  44.196  -4.176   3.134
    8   2HG   GLU1103           HG1      GLU1103  44.372  -5.833   2.557
    9    H    ALA1104           HN       ALA1104  40.382  -3.326   2.281
   10    HA   ALA1104           HA       ALA1104  37.977  -4.866   1.590
   11   1HB   ALA1104           HB2      ALA1104  36.545  -3.183   2.615
   12   2HB   ALA1104           HB1      ALA1104  37.623  -3.901   3.812
   13   3HB   ALA1104           HB3      ALA1104  37.965  -2.295   3.168
   14    H    GLU1105           HN       GLU1105  36.945  -4.218  -0.233
   15    HA   GLU1105           HA       GLU1105  38.280  -2.200  -1.846
   16   1HB   GLU1105           HB2      GLU1105  36.024  -4.093  -2.532
   17   2HB   GLU1105           HB1      GLU1105  36.849  -3.040  -3.672
   18   1HG   GLU1105           HG2      GLU1105  38.110  -5.289  -2.118
   19   2HG   GLU1105           HG1      GLU1105  37.652  -5.332  -3.820
   20    H    PHE1106           HN       PHE1106  36.921  -0.686  -3.143
   21    HA   PHE1106           HA       PHE1106  35.096   0.696  -1.369
   22   1HB   PHE1106           HB2      PHE1106  36.104   1.422  -4.128
   23   2HB   PHE1106           HB1      PHE1106  35.131   2.467  -3.098
   24    HD1  PHE1106           HD1      PHE1106  38.433   1.011  -3.644
   25    HD2  PHE1106           HD2      PHE1106  36.081   3.525  -1.143
   26    HE1  PHE1106           HE1      PHE1106  40.483   1.877  -2.594
   27    HE2  PHE1106           HE2      PHE1106  38.125   4.397  -0.088
   28    HZ   PHE1106           HZ       PHE1106  40.331   3.572  -0.813
   29    H    GLY1107           HN       GLY1107  32.932   1.080  -1.734
   30   1HA   GLY1107           HA1      GLY1107  31.439  -0.898  -3.010
   31   2HA   GLY1107           HA2      GLY1107  31.546   0.474  -4.099
   32    H    LYS1108           HN       LYS1108  31.706   2.191  -1.530
   33    HA   LYS1108           HA       LYS1108  29.459   2.021   0.015
   34   1HB   LYS1108           HB2      LYS1108  30.773   4.500  -1.105
   35   2HB   LYS1108           HB1      LYS1108  29.561   4.518   0.171
   36   1HG   LYS1108           HG2      LYS1108  32.070   2.909   0.445
   37   2HG   LYS1108           HG1      LYS1108  32.036   4.630   0.827
   38   1HD   LYS1108           HD2      LYS1108  30.117   4.162   2.368
   39   2HD   LYS1108           HD1      LYS1108  30.389   2.441   2.084
   40   1HE   LYS1108           HE2      LYS1108  32.692   2.694   2.926
   41   2HE   LYS1108           HE1      LYS1108  32.359   4.391   3.269
   42   1HZ   LYS1108           HZ2      LYS1108  30.633   3.701   4.815
   43   2HZ   LYS1108           HZ1      LYS1108  30.958   2.073   4.488
   44   3HZ   LYS1108           HZ3      LYS1108  32.126   3.035   5.247
   45    H    CYS1109           HN       CYS1109  27.374   2.024  -0.352
   46    HA   CYS1109           HA       CYS1109  26.391   2.718  -2.993
   47   1HB   CYS1109           HB2      CYS1109  24.755   1.655  -0.696
   48   2HB   CYS1109           HB1      CYS1109  24.415   1.542  -2.421
   49    H    GLY1110           HN       GLY1110  24.108   3.745  -2.954
   50   1HA   GLY1110           HA1      GLY1110  23.734   6.193  -2.871
   51   2HA   GLY1110           HA2      GLY1110  24.215   6.107  -1.181
   52    HA   PRO1111           HA       PRO1111  19.848   6.084  -0.290
   53   1HB   PRO1111           HB2      PRO1111  18.948   7.337  -2.840
   54   2HB   PRO1111           HB1      PRO1111  18.557   7.767  -1.169
   55   1HG   PRO1111           HG2      PRO1111  20.279   9.226  -2.604
   56   2HG   PRO1111           HG1      PRO1111  20.531   8.942  -0.873
   57   1HD   PRO1111           HD2      PRO1111  21.914   7.724  -3.216
   58   2HD   PRO1111           HD1      PRO1111  22.550   8.119  -1.607
   59    HA   PRO1112           HA       PRO1112  19.218   2.191  -2.481
   60   1HB   PRO1112           HB2      PRO1112  17.171   1.375  -0.810
   61   2HB   PRO1112           HB1      PRO1112  18.890   1.105  -0.516
   62   1HG   PRO1112           HG2      PRO1112  17.091   3.230   0.570
   63   2HG   PRO1112           HG1      PRO1112  18.365   2.310   1.393
   64   1HD   PRO1112           HD2      PRO1112  18.768   4.830   0.579
   65   2HD   PRO1112           HD1      PRO1112  20.060   3.614   0.489
   66    HA   PRO1113           HA       PRO1113  16.047   3.941  -5.272
   67   1HB   PRO1113           HB2      PRO1113  16.276   1.051  -6.033
   68   2HB   PRO1113           HB1      PRO1113  16.138   2.474  -7.073
   69   1HG   PRO1113           HG2      PRO1113  18.501   1.269  -6.621
   70   2HG   PRO1113           HG1      PRO1113  18.366   3.021  -6.846
   71   1HD   PRO1113           HD2      PRO1113  18.986   1.497  -4.414
   72   2HD   PRO1113           HD1      PRO1113  19.267   3.210  -4.770
   73    HA   PRO1114           HA       PRO1114  12.888   2.147  -2.540
   74   1HB   PRO1114           HB2      PRO1114  11.240   4.230  -2.514
   75   2HB   PRO1114           HB1      PRO1114  12.790   4.298  -1.663
   76   1HG   PRO1114           HG2      PRO1114  12.090   5.332  -4.395
   77   2HG   PRO1114           HG1      PRO1114  12.906   6.187  -3.070
   78   1HD   PRO1114           HD2      PRO1114  14.256   5.024  -5.116
   79   2HD   PRO1114           HD1      PRO1114  14.921   5.126  -3.472
   80    H    ILE1115           HN       ILE1115  10.336   2.457  -2.770
   81    HA   ILE1115           HA       ILE1115   9.652   1.478  -5.457
   82    HB   ILE1115           HB       ILE1115   7.494   0.836  -3.953
   83   1HG1  ILE1115          2HG1      ILE1115   9.891   0.574  -2.118
   84   2HG1  ILE1115          1HG1      ILE1115   8.565   1.710  -1.898
   85   1HG2  ILE1115          3HG2      ILE1115  10.020  -0.761  -4.307
   86   2HG2  ILE1115          2HG2      ILE1115   8.456  -1.434  -3.845
   87   3HG2  ILE1115          1HG2      ILE1115   8.657  -0.673  -5.423
   88   1HD1  ILE1115          1HD1      ILE1115   8.315  -1.286  -1.851
   89   2HD1  ILE1115          3HD1      ILE1115   8.363  -0.230  -0.438
   90   3HD1  ILE1115          2HD1      ILE1115   7.017  -0.125  -1.576
   91    H    ASP1116           HN       ASP1116   7.180   1.802  -5.861
   92    HA   ASP1116           HA       ASP1116   6.735   4.545  -6.242
   93   1HB   ASP1116           HB2      ASP1116   4.801   2.218  -6.294
   94   2HB   ASP1116           HB1      ASP1116   4.418   3.841  -6.855
   95    H    ASN1117           HN       ASN1117   6.490   5.940  -4.602
   96    HA   ASN1117           HA       ASN1117   5.649   6.956  -2.742
   97   1HB   ASN1117           HB2      ASN1117   3.480   4.859  -3.040
   98   2HB   ASN1117           HB1      ASN1117   3.404   6.233  -1.935
   99   1HD2  ASN1117          1HD2      ASN1117   3.300   5.208  -5.249
  100   2HD2  ASN1117          2HD2      ASN1117   2.682   6.685  -5.899
  101    H    GLY1118           HN       GLY1118   7.535   4.708  -2.600
  102   1HA   GLY1118           HA1      GLY1118   7.868   2.821  -1.073
  103   2HA   GLY1118           HA2      GLY1118   6.884   3.689   0.092
  104    H    ASP1119           HN       ASP1119   9.158   2.788   1.013
  105    HA   ASP1119           HA       ASP1119  11.518   4.190   0.748
  106   1HB   ASP1119           HB2      ASP1119  11.423   5.812   2.616
  107   2HB   ASP1119           HB1      ASP1119  10.291   6.225   1.332
  108    H    ILE1120           HN       ILE1120  12.832   4.097   2.954
  109    HA   ILE1120           HA       ILE1120  12.782   1.423   3.800
  110    HB   ILE1120           HB       ILE1120  13.980   2.906   5.888
  111   1HG1  ILE1120          2HG1      ILE1120  13.848   4.805   4.197
  112   2HG1  ILE1120          1HG1      ILE1120  15.443   4.442   4.839
  113   1HG2  ILE1120          2HG2      ILE1120  14.701   0.741   5.087
  114   2HG2  ILE1120          1HG2      ILE1120  15.181   1.447   3.544
  115   3HG2  ILE1120          3HG2      ILE1120  16.035   1.893   5.021
  116   1HD1  ILE1120          1HD1      ILE1120  15.980   3.220   2.799
  117   2HD1  ILE1120          3HD1      ILE1120  14.380   3.595   2.159
  118   3HD1  ILE1120          2HD1      ILE1120  15.534   4.893   2.466
  119    H    THR1121           HN       THR1121  12.052   0.432   5.671
  120    HA   THR1121           HA       THR1121   9.605   1.338   6.700
  121    HB   THR1121           HB       THR1121   9.809  -0.493   8.347
  122    HG1  THR1121           HG1      THR1121  11.861  -0.795   8.896
  123   1HG2  THR1121          1HG2      THR1121  10.651  -1.229   5.538
  124   2HG2  THR1121          3HG2      THR1121   9.954  -2.336   6.720
  125   3HG2  THR1121          2HG2      THR1121   8.996  -0.991   6.100
  126    H    SER1122           HN       SER1122  12.645   2.492   7.345
  127    HA   SER1122           HA       SER1122  11.763   3.562   9.939
  128   1HB   SER1122           HB2      SER1122  13.591   1.895  10.214
  129   2HB   SER1122           HB1      SER1122  14.620   2.897   9.190
  130    HG   SER1122           HG       SER1122  14.014   3.169  11.820
  131    H    PHE1123           HN       PHE1123  14.823   4.543   8.675
  132    HA   PHE1123           HA       PHE1123  13.646   7.043   7.708
  133   1HB   PHE1123           HB2      PHE1123  15.650   8.159   8.601
  134   2HB   PHE1123           HB1      PHE1123  14.713   7.376   9.859
  135    HD1  PHE1123           HD1      PHE1123  17.886   7.532   8.142
  136    HD2  PHE1123           HD2      PHE1123  15.526   5.272  10.867
  137    HE1  PHE1123           HE1      PHE1123  19.902   6.338   8.893
  138    HE2  PHE1123           HE2      PHE1123  17.537   4.073  11.622
  139    HZ   PHE1123           HZ       PHE1123  19.730   4.606  10.636
  140    HA   PRO1124           HA       PRO1124  15.919   6.322   3.984
  141   1HB   PRO1124           HB2      PRO1124  16.029   8.813   2.973
  142   2HB   PRO1124           HB1      PRO1124  14.514   7.908   3.074
  143   1HG   PRO1124           HG2      PRO1124  15.570  10.047   4.884
  144   2HG   PRO1124           HG1      PRO1124  13.928   9.825   4.256
  145   1HD   PRO1124           HD2      PRO1124  14.693   9.067   6.764
  146   2HD   PRO1124           HD1      PRO1124  13.393   8.270   5.856
  147    H    LEU1125           HN       LEU1125  17.965   6.391   3.136
  148    HA   LEU1125           HA       LEU1125  19.975   7.962   4.620
  149   1HB   LEU1125           HB2      LEU1125  20.109   5.152   3.546
  150   2HB   LEU1125           HB1      LEU1125  21.558   6.056   3.932
  151    HG   LEU1125           HG       LEU1125  20.964   4.525   5.730
  152   1HD1  LEU1125          2HD1      LEU1125  20.565   7.422   6.454
  153   2HD1  LEU1125          1HD1      LEU1125  20.959   6.129   7.587
  154   3HD1  LEU1125          3HD1      LEU1125  22.106   6.572   6.322
  155   1HD2  LEU1125          2HD2      LEU1125  18.476   4.637   5.239
  156   2HD2  LEU1125          1HD2      LEU1125  18.950   4.614   6.940
  157   3HD2  LEU1125          3HD2      LEU1125  18.467   6.129   6.181
  158    H    SER1126           HN       SER1126  21.784   8.716   3.422
  159    HA   SER1126           HA       SER1126  21.277   8.902   0.524
  160   1HB   SER1126           HB2      SER1126  21.211  11.080   1.598
  161   2HB   SER1126           HB1      SER1126  22.768  10.784   2.371
  162    HG   SER1126           HG       SER1126  22.732  10.528  -0.381
  163    H    VAL1127           HN       VAL1127  23.249   7.699   2.942
  164    HA   VAL1127           HA       VAL1127  25.193   6.732   0.987
  165    HB   VAL1127           HB       VAL1127  26.343   8.584   2.007
  166   1HG1  VAL1127          3HG1      VAL1127  24.840   8.654   4.026
  167   2HG1  VAL1127          2HG1      VAL1127  25.833   7.364   4.709
  168   3HG1  VAL1127          1HG1      VAL1127  26.555   8.931   4.345
  169   1HG2  VAL1127          1HG2      VAL1127  27.637   6.540   1.622
  170   2HG2  VAL1127          3HG2      VAL1127  28.249   7.441   3.010
  171   3HG2  VAL1127          2HG2      VAL1127  27.264   5.999   3.258
  172    H    TYR1128           HN       TYR1128  25.180   4.593   1.101
  173    HA   TYR1128           HA       TYR1128  24.604   3.328   3.699
  174   1HB   TYR1128           HB2      TYR1128  23.281   3.025   1.129
  175   2HB   TYR1128           HB1      TYR1128  23.864   1.486   1.752
  176    HD1  TYR1128           HD1      TYR1128  23.399   1.387   4.500
  177    HD2  TYR1128           HD2      TYR1128  21.069   3.390   1.561
  178    HE1  TYR1128           HE1      TYR1128  21.423   1.213   5.955
  179    HE2  TYR1128           HE2      TYR1128  19.089   3.231   3.004
  180    HH   TYR1128           HH       TYR1128  18.273   1.834   4.860
  181    H    ALA1129           HN       ALA1129  25.558   1.316   4.101
  182    HA   ALA1129           HA       ALA1129  28.210   1.038   3.037
  183   1HB   ALA1129           HB2      ALA1129  27.718   0.546   5.388
  184   2HB   ALA1129           HB1      ALA1129  26.675  -0.787   4.891
  185   3HB   ALA1129           HB3      ALA1129  28.408  -0.856   4.569
  186    HA   PRO1130           HA       PRO1130  27.301  -1.672  -0.331
  187   1HB   PRO1130           HB2      PRO1130  29.861  -3.034   0.129
  188   2HB   PRO1130           HB1      PRO1130  29.331  -2.072  -1.255
  189   1HG   PRO1130           HG2      PRO1130  31.190  -1.184   0.489
  190   2HG   PRO1130           HG1      PRO1130  30.050  -0.092  -0.317
  191   1HD   PRO1130           HD2      PRO1130  29.996  -1.166   2.475
  192   2HD   PRO1130           HD1      PRO1130  29.590   0.459   1.884
  193    H    ALA1131           HN       ALA1131  26.593  -3.727  -0.776
  194    HA   ALA1131           HA       ALA1131  25.796  -5.817  -0.406
  195   1HB   ALA1131           HB3      ALA1131  28.152  -6.381  -0.065
  196   2HB   ALA1131           HB1      ALA1131  27.095  -7.349   0.962
  197   3HB   ALA1131           HB2      ALA1131  27.995  -5.996   1.648
  198    H    SER1132           HN       SER1132  25.225  -3.374   1.523
  199    HA   SER1132           HA       SER1132  24.214  -4.744   3.861
  200   1HB   SER1132           HB2      SER1132  23.435  -2.555   4.590
  201   2HB   SER1132           HB1      SER1132  25.095  -2.427   4.005
  202    HG   SER1132           HG       SER1132  23.712  -0.757   3.213
  203    H    SER1133           HN       SER1133  21.874  -4.303   4.527
  204    HA   SER1133           HA       SER1133  20.009  -4.200   2.293
  205   1HB   SER1133           HB2      SER1133  19.812  -6.531   4.186
  206   2HB   SER1133           HB1      SER1133  19.062  -6.325   2.604
  207    HG   SER1133           HG       SER1133  21.776  -6.855   3.195
  208    H    VAL1134           HN       VAL1134  17.869  -3.721   2.892
  209    HA   VAL1134           HA       VAL1134  17.270  -3.408   5.727
  210    HB   VAL1134           HB       VAL1134  16.443  -1.093   5.451
  211   1HG1  VAL1134          3HG1      VAL1134  19.380  -1.501   4.932
  212   2HG1  VAL1134          2HG1      VAL1134  18.647  -0.009   5.523
  213   3HG1  VAL1134          1HG1      VAL1134  18.574  -1.476   6.501
  214   1HG2  VAL1134          2HG2      VAL1134  16.212  -1.171   2.985
  215   2HG2  VAL1134          1HG2      VAL1134  17.069   0.256   3.573
  216   3HG2  VAL1134          3HG2      VAL1134  17.969  -1.083   2.855
  217    H    GLU1135           HN       GLU1135  15.003  -2.651   6.061
  218    HA   GLU1135           HA       GLU1135  13.256  -4.103   4.241
  219   1HB   GLU1135           HB2      GLU1135  12.740  -2.885   6.959
  220   2HB   GLU1135           HB1      GLU1135  11.591  -3.846   6.046
  221   1HG   GLU1135           HG2      GLU1135  13.032  -5.782   6.200
  222   2HG   GLU1135           HG1      GLU1135  14.255  -4.826   7.036
  223    H    TYR1136           HN       TYR1136  11.301  -3.183   3.430
  224    HA   TYR1136           HA       TYR1136  11.268  -0.245   3.408
  225   1HB   TYR1136           HB2      TYR1136  11.533  -2.090   1.152
  226   2HB   TYR1136           HB1      TYR1136  10.250  -0.902   0.944
  227    HD1  TYR1136           HD1      TYR1136  10.836   1.036  -0.131
  228    HD2  TYR1136           HD2      TYR1136  13.782  -0.975   2.184
  229    HE1  TYR1136           HE1      TYR1136  12.489   2.734  -0.771
  230    HE2  TYR1136           HE2      TYR1136  15.447   0.719   1.549
  231    HH   TYR1136           HH       TYR1136  15.800   2.348  -0.297
  232    H    GLN1137           HN       GLN1137   9.198   0.641   2.587
  233    HA   GLN1137           HA       GLN1137   6.812  -0.842   2.542
  234   1HB   GLN1137           HB2      GLN1137   7.355  -1.127   4.959
  235   2HB   GLN1137           HB1      GLN1137   7.304   0.620   5.145
  236   1HG   GLN1137           HG2      GLN1137   4.952   0.628   4.498
  237   2HG   GLN1137           HG1      GLN1137   5.001  -1.124   4.299
  238   1HE2  GLN1137          1HE2      GLN1137   5.014   1.509   6.564
  239   2HE2  GLN1137          2HE2      GLN1137   4.695   0.564   7.976
  240    H    CYS1138           HN       CYS1138   4.893   0.567   2.466
  241    HA   CYS1138           HA       CYS1138   5.638   3.249   1.529
  242   1HB   CYS1138           HB2      CYS1138   3.361   1.416   0.818
  243   2HB   CYS1138           HB1      CYS1138   3.315   3.134   0.433
  244    H    GLN1139           HN       GLN1139   4.811   5.033   2.412
  245    HA   GLN1139           HA       GLN1139   3.397   4.795   4.918
  246   1HB   GLN1139           HB2      GLN1139   3.712   7.239   5.042
  247   2HB   GLN1139           HB1      GLN1139   5.219   6.394   4.714
  248   1HG   GLN1139           HG2      GLN1139   4.886   6.916   2.293
  249   2HG   GLN1139           HG1      GLN1139   3.519   7.925   2.762
  250   1HE2  GLN1139          1HE2      GLN1139   6.017   8.644   1.443
  251   2HE2  GLN1139          2HE2      GLN1139   6.754   9.849   2.436
  252    H    ASN1140           HN       ASN1140   1.892   7.078   4.994
  253    HA   ASN1140           HA       ASN1140  -0.267   7.727   4.724
  254   1HB   ASN1140           HB2      ASN1140   1.164   8.114   2.356
  255   2HB   ASN1140           HB1      ASN1140  -0.406   7.479   1.860
  256   1HD2  ASN1140          1HD2      ASN1140  -1.771   8.604   4.180
  257   2HD2  ASN1140          2HD2      ASN1140  -1.908  10.300   3.877
  258    H    LEU1141           HN       LEU1141  -0.291   5.121   5.411
  259    HA   LEU1141           HA       LEU1141  -1.701   3.345   5.526
  260   1HB   LEU1141           HB2      LEU1141  -3.338   4.923   3.548
  261   2HB   LEU1141           HB1      LEU1141  -3.878   3.462   4.350
  262    HG   LEU1141           HG       LEU1141  -3.354   4.820   6.534
  263   1HD1  LEU1141          3HD1      LEU1141  -3.814   7.012   4.522
  264   2HD1  LEU1141          2HD1      LEU1141  -3.802   7.209   6.275
  265   3HD1  LEU1141          1HD1      LEU1141  -2.330   6.726   5.431
  266   1HD2  LEU1141          3HD2      LEU1141  -5.555   3.992   5.862
  267   2HD2  LEU1141          2HD2      LEU1141  -5.662   5.611   6.555
  268   3HD2  LEU1141          1HD2      LEU1141  -5.759   5.391   4.808
  269    H    TYR1142           HN       TYR1142  -0.295   4.283   2.554
  270    HA   TYR1142           HA       TYR1142  -1.153   2.343   0.786
  271   1HB   TYR1142           HB2      TYR1142   1.515   3.687   1.127
  272   2HB   TYR1142           HB1      TYR1142   1.258   2.485  -0.132
  273    HD1  TYR1142           HD1      TYR1142   0.180   5.801   1.097
  274    HD2  TYR1142           HD2      TYR1142   0.078   3.020  -2.120
  275    HE1  TYR1142           HE1      TYR1142  -0.758   7.540  -0.367
  276    HE2  TYR1142           HE2      TYR1142  -0.862   4.750  -3.594
  277    HH   TYR1142           HH       TYR1142  -0.910   8.040  -2.767
  278    H    GLN1143           HN       GLN1143  -0.785   0.208   0.468
  279    HA   GLN1143           HA       GLN1143   0.631  -1.177   2.623
  280   1HB   GLN1143           HB2      GLN1143  -1.717  -1.814   2.178
  281   2HB   GLN1143           HB1      GLN1143  -1.265  -2.280   0.544
  282   1HG   GLN1143           HG2      GLN1143  -1.456  -4.225   1.964
  283   2HG   GLN1143           HG1      GLN1143   0.213  -4.004   1.442
  284   1HE2  GLN1143          1HE2      GLN1143   1.031  -5.194   3.150
  285   2HE2  GLN1143          2HE2      GLN1143   1.050  -4.599   4.772
  286    H    LEU1144           HN       LEU1144   2.099  -2.901   2.145
  287    HA   LEU1144           HA       LEU1144   3.407  -2.554  -0.464
  288   1HB   LEU1144           HB2      LEU1144   4.786  -1.984   1.484
  289   2HB   LEU1144           HB1      LEU1144   4.549  -3.596   2.128
  290    HG   LEU1144           HG       LEU1144   5.725  -3.430  -0.591
  291   1HD1  LEU1144          1HD1      LEU1144   6.880  -1.607   0.543
  292   2HD1  LEU1144          3HD1      LEU1144   7.269  -2.678   1.889
  293   3HD1  LEU1144          2HD1      LEU1144   7.959  -2.979   0.294
  294   1HD2  LEU1144          1HD2      LEU1144   5.346  -5.569   0.518
  295   2HD2  LEU1144          3HD2      LEU1144   7.069  -5.278   0.275
  296   3HD2  LEU1144          2HD2      LEU1144   6.353  -5.057   1.871
  297    H    GLU1145           HN       GLU1145   4.388  -4.443  -1.436
  298    HA   GLU1145           HA       GLU1145   3.369  -7.038  -0.626
  299   1HB   GLU1145           HB2      GLU1145   1.583  -6.159  -2.056
  300   2HB   GLU1145           HB1      GLU1145   2.749  -5.836  -3.332
  301   1HG   GLU1145           HG2      GLU1145   3.199  -8.222  -3.536
  302   2HG   GLU1145           HG1      GLU1145   2.042  -8.554  -2.247
  303    H    GLY1146           HN       GLY1146   4.985  -8.442  -0.795
  304   1HA   GLY1146           HA1      GLY1146   7.002  -8.013  -2.911
  305   2HA   GLY1146           HA2      GLY1146   6.553  -9.591  -2.279
  306    H    ASN1147           HN       ASN1147   9.187  -8.945  -2.381
  307    HA   ASN1147           HA       ASN1147   9.919  -9.084   0.397
  308   1HB   ASN1147           HB2      ASN1147  12.266  -9.261  -0.562
  309   2HB   ASN1147           HB1      ASN1147  11.137 -10.521  -1.050
  310   1HD2  ASN1147          1HD2      ASN1147  13.019  -7.813  -2.066
  311   2HD2  ASN1147          2HD2      ASN1147  12.760  -8.001  -3.764
  312    H    LYS1148           HN       LYS1148   9.386  -7.062   1.231
  313    HA   LYS1148           HA       LYS1148  10.171  -4.594   0.148
  314   1HB   LYS1148           HB2      LYS1148   9.807  -3.761   2.519
  315   2HB   LYS1148           HB1      LYS1148   8.445  -4.561   1.748
  316   1HG   LYS1148           HG2      LYS1148   8.491  -5.379   3.940
  317   2HG   LYS1148           HG1      LYS1148   9.182  -6.666   2.952
  318   1HD   LYS1148           HD2      LYS1148  11.434  -5.940   3.579
  319   2HD   LYS1148           HD1      LYS1148  10.745  -4.651   4.569
  320   1HE   LYS1148           HE2      LYS1148  10.327  -7.611   4.975
  321   2HE   LYS1148           HE1      LYS1148  11.393  -6.579   5.928
  322   1HZ   LYS1148           HZ2      LYS1148   8.444  -6.295   5.726
  323   2HZ   LYS1148           HZ1      LYS1148   9.285  -6.940   7.044
  324   3HZ   LYS1148           HZ3      LYS1148   9.467  -5.307   6.640
  325    H    ARG1149           HN       ARG1149  12.072  -6.997   1.557
  326    HA   ARG1149           HA       ARG1149  14.075  -5.130   2.556
  327   1HB   ARG1149           HB2      ARG1149  13.533  -7.177   3.851
  328   2HB   ARG1149           HB1      ARG1149  14.131  -8.151   2.514
  329   1HG   ARG1149           HG2      ARG1149  16.353  -7.190   2.794
  330   2HG   ARG1149           HG1      ARG1149  15.758  -6.197   4.127
  331   1HD   ARG1149           HD2      ARG1149  15.190  -8.224   5.377
  332   2HD   ARG1149           HD1      ARG1149  15.798  -9.211   4.048
  333    HE   ARG1149           HE       ARG1149  17.850  -7.501   4.811
  334   1HH1  ARG1149          1HH1      ARG1149  15.996 -10.111   6.187
  335   2HH1  ARG1149          2HH1      ARG1149  17.273 -10.637   7.232
  336   1HH2  ARG1149          1HH2      ARG1149  19.536  -8.188   6.183
  337   2HH2  ARG1149          2HH2      ARG1149  19.284  -9.545   7.231
  338    H    ILE1150           HN       ILE1150  15.280  -4.209   1.009
  339    HA   ILE1150           HA       ILE1150  16.127  -5.838  -1.274
  340    HB   ILE1150           HB       ILE1150  16.620  -3.874  -2.465
  341   1HG1  ILE1150          2HG1      ILE1150  17.812  -2.706  -0.621
  342   2HG1  ILE1150          1HG1      ILE1150  16.732  -1.650  -1.524
  343   1HG2  ILE1150          3HG2      ILE1150  14.246  -4.322  -2.287
  344   2HG2  ILE1150          2HG2      ILE1150  14.150  -3.347  -0.820
  345   3HG2  ILE1150          1HG2      ILE1150  14.537  -2.583  -2.363
  346   1HD1  ILE1150          1HD1      ILE1150  15.072  -1.845   0.259
  347   2HD1  ILE1150          3HD1      ILE1150  16.184  -2.868   1.168
  348   3HD1  ILE1150          2HD1      ILE1150  16.604  -1.188   0.835
  349    H    THR1151           HN       THR1151  18.443  -4.947  -2.085
  350    HA   THR1151           HA       THR1151  20.339  -4.651   0.063
  351    HB   THR1151           HB       THR1151  20.336  -7.201  -1.563
  352    HG1  THR1151           HG1      THR1151  19.298  -8.023   0.077
  353   1HG2  THR1151          1HG2      THR1151  22.226  -6.248   0.592
  354   2HG2  THR1151          3HG2      THR1151  22.254  -7.839  -0.168
  355   3HG2  THR1151          2HG2      THR1151  22.599  -6.398  -1.127
  356    H    CYS1152           HN       CYS1152  21.968  -3.441  -0.663
  357    HA   CYS1152           HA       CYS1152  22.228  -2.690  -3.372
  358   1HB   CYS1152           HB2      CYS1152  22.936  -1.220  -1.552
  359   2HB   CYS1152           HB1      CYS1152  24.161  -2.385  -1.062
  360    H    ARG1153           HN       ARG1153  23.560  -3.434  -4.984
  361    HA   ARG1153           HA       ARG1153  24.960  -5.932  -4.374
  362   1HB   ARG1153           HB2      ARG1153  24.484  -4.972  -7.162
  363   2HB   ARG1153           HB1      ARG1153  24.630  -6.620  -6.569
  364   1HG   ARG1153           HG2      ARG1153  22.402  -6.628  -6.853
  365   2HG   ARG1153           HG1      ARG1153  22.411  -5.857  -5.264
  366   1HD   ARG1153           HD2      ARG1153  20.969  -4.668  -6.856
  367   2HD   ARG1153           HD1      ARG1153  22.304  -3.665  -6.291
  368    HE   ARG1153           HE       ARG1153  23.313  -4.655  -8.552
  369   1HH1  ARG1153          1HH1      ARG1153  20.200  -3.247  -7.870
  370   2HH1  ARG1153          2HH1      ARG1153  19.993  -2.616  -9.469
  371   1HH2  ARG1153          1HH2      ARG1153  23.048  -3.828 -10.659
  372   2HH2  ARG1153          2HH2      ARG1153  21.610  -2.946 -11.054
  373    H    ASN1154           HN       ASN1154  25.632  -2.786  -4.730
  374    HA   ASN1154           HA       ASN1154  28.236  -2.629  -4.429
  375   1HB   ASN1154           HB2      ASN1154  29.402  -2.641  -6.570
  376   2HB   ASN1154           HB1      ASN1154  28.629  -4.197  -6.300
  377   1HD2  ASN1154          1HD2      ASN1154  25.965  -3.076  -6.969
  378   2HD2  ASN1154          2HD2      ASN1154  25.953  -2.943  -8.690
  379    H    GLY1155           HN       GLY1155  27.471  -0.659  -3.658
  380   1HA   GLY1155           HA1      GLY1155  27.851   1.559  -5.336
  381   2HA   GLY1155           HA2      GLY1155  27.132   1.606  -3.736
  382    H    GLN1156           HN       GLN1156  25.264  -0.518  -5.401
  383    HA   GLN1156           HA       GLN1156  23.236   1.511  -5.891
  384   1HB   GLN1156           HB2      GLN1156  24.257  -0.336  -8.052
  385   2HB   GLN1156           HB1      GLN1156  22.745   0.553  -8.160
  386   1HG   GLN1156           HG2      GLN1156  23.971   2.660  -8.002
  387   2HG   GLN1156           HG1      GLN1156  25.487   1.765  -7.900
  388   1HE2  GLN1156          1HE2      GLN1156  24.592   3.723  -9.871
  389   2HE2  GLN1156          2HE2      GLN1156  24.674   2.928 -11.403
  390    H    TRP1157           HN       TRP1157  21.435   0.804  -4.966
  391    HA   TRP1157           HA       TRP1157  21.109  -1.975  -4.271
  392   1HB   TRP1157           HB2      TRP1157  19.175   0.320  -3.950
  393   2HB   TRP1157           HB1      TRP1157  19.034  -1.264  -3.209
  394    HD1  TRP1157           HD1      TRP1157  21.425   1.779  -3.093
  395    HE1  TRP1157           HE1      TRP1157  22.345   1.930  -0.699
  396    HE3  TRP1157           HE3      TRP1157  19.326  -2.448  -1.189
  397    HZ2  TRP1157           HZ2      TRP1157  22.215   0.396   1.700
  398    HZ3  TRP1157           HZ3      TRP1157  19.764  -3.052   1.147
  399    HH2  TRP1157           HH2      TRP1157  21.175  -1.667   2.556
  400    H    SER1158           HN       SER1158  18.521  -2.463  -4.407
  401    HA   SER1158           HA       SER1158  17.736  -2.276  -7.233
  402   1HB   SER1158           HB2      SER1158  17.704  -4.705  -5.437
  403   2HB   SER1158           HB1      SER1158  16.785  -4.607  -6.937
  404    HG   SER1158           HG       SER1158  19.036  -5.544  -6.941
  405    H    GLU1159           HN       GLU1159  15.833  -1.316  -7.428
  406    HA   GLU1159           HA       GLU1159  14.210  -0.338  -5.497
  407   1HB   GLU1159           HB2      GLU1159  13.918   0.281  -7.807
  408   2HB   GLU1159           HB1      GLU1159  13.438  -1.354  -8.233
  409   1HG   GLU1159           HG2      GLU1159  11.411  -1.119  -6.907
  410   2HG   GLU1159           HG1      GLU1159  11.895   0.513  -6.448
  411    HA   PRO1160           HA       PRO1160  12.313  -3.811  -3.507
  412   1HB   PRO1160           HB2      PRO1160  10.110  -1.988  -2.802
  413   2HB   PRO1160           HB1      PRO1160  11.238  -2.841  -1.747
  414   1HG   PRO1160           HG2      PRO1160  11.374  -0.183  -2.097
  415   2HG   PRO1160           HG1      PRO1160  12.829  -1.173  -1.874
  416   1HD   PRO1160           HD2      PRO1160  11.670  -0.051  -4.399
  417   2HD   PRO1160           HD1      PRO1160  13.364  -0.124  -3.878
  418    HA   PRO1161           HA       PRO1161   9.107  -5.570  -5.963
  419   1HB   PRO1161           HB2      PRO1161   7.011  -6.015  -4.206
  420   2HB   PRO1161           HB1      PRO1161   8.396  -7.085  -4.434
  421   1HG   PRO1161           HG2      PRO1161   7.925  -5.016  -2.329
  422   2HG   PRO1161           HG1      PRO1161   8.646  -6.630  -2.177
  423   1HD   PRO1161           HD2      PRO1161  10.169  -4.434  -2.212
  424   2HD   PRO1161           HD1      PRO1161  10.696  -5.927  -3.017
  425    H    LYS1162           HN       LYS1162   6.505  -4.413  -3.963
  426    HA   LYS1162           HA       LYS1162   6.064  -1.962  -5.370
  427   1HB   LYS1162           HB2      LYS1162   5.510  -3.740  -7.089
  428   2HB   LYS1162           HB1      LYS1162   4.170  -4.207  -6.055
  429   1HG   LYS1162           HG2      LYS1162   3.197  -1.993  -6.277
  430   2HG   LYS1162           HG1      LYS1162   4.556  -1.487  -7.283
  431   1HD   LYS1162           HD2      LYS1162   2.653  -3.730  -7.955
  432   2HD   LYS1162           HD1      LYS1162   2.545  -2.089  -8.596
  433   1HE   LYS1162           HE2      LYS1162   4.859  -3.986  -8.968
  434   2HE   LYS1162           HE1      LYS1162   3.640  -3.591 -10.180
  435   1HZ   LYS1162           HZ2      LYS1162   4.386  -1.290 -10.120
  436   2HZ   LYS1162           HZ1      LYS1162   5.560  -1.677  -8.967
  437   3HZ   LYS1162           HZ3      LYS1162   5.660  -2.325 -10.527
  438    H    CYS1163           HN       CYS1163   3.818  -1.088  -4.907
  439    HA   CYS1163           HA       CYS1163   2.853  -2.066  -2.298
  440   1HB   CYS1163           HB2      CYS1163   3.358   0.748  -3.235
  441   2HB   CYS1163           HB1      CYS1163   2.264   0.401  -1.899
  442    H    LEU1164           HN       LEU1164   0.697  -2.223  -2.002
  443    HA   LEU1164           HA       LEU1164  -0.986  -1.771  -4.350
  444   1HB   LEU1164           HB2      LEU1164  -2.074  -3.047  -1.900
  445   2HB   LEU1164           HB1      LEU1164  -2.379  -3.419  -3.584
  446    HG   LEU1164           HG       LEU1164   0.096  -4.179  -2.035
  447   1HD1  LEU1164          3HD1      LEU1164  -1.867  -5.442  -1.350
  448   2HD1  LEU1164          2HD1      LEU1164  -2.204  -5.849  -3.032
  449   3HD1  LEU1164          1HD1      LEU1164  -0.745  -6.461  -2.253
  450   1HD2  LEU1164          1HD2      LEU1164   0.587  -3.765  -4.390
  451   2HD2  LEU1164          3HD2      LEU1164   0.685  -5.486  -4.015
  452   3HD2  LEU1164          2HD2      LEU1164  -0.724  -4.847  -4.860
  453    H    HIS1165           HN       HIS1165  -2.144   0.027  -4.461
  454    HA   HIS1165           HA       HIS1165  -2.356   2.019  -2.608
  455   1HB   HIS1165           HB2      HIS1165  -4.487   1.226  -4.608
  456   2HB   HIS1165           HB1      HIS1165  -4.355   2.796  -3.822
  457    HD1  HIS1165           HD1      HIS1165  -3.087   0.838  -6.669
  458    HD2  HIS1165           HD2      HIS1165  -2.104   4.355  -4.687
  459    HE1  HIS1165           HE1      HIS1165  -1.520   2.061  -8.208
  460    HE2  HIS1165           HE2      HIS1165  -1.008   4.227  -7.026
  461    HA   PRO1166           HA       PRO1166  -4.668   0.192   0.727
  462   1HB   PRO1166           HB2      PRO1166  -5.453   2.591   1.866
  463   2HB   PRO1166           HB1      PRO1166  -3.914   1.779   2.171
  464   1HG   PRO1166           HG2      PRO1166  -4.535   4.034   0.311
  465   2HG   PRO1166           HG1      PRO1166  -3.114   3.790   1.346
  466   1HD   PRO1166           HD2      PRO1166  -3.020   3.311  -1.287
  467   2HD   PRO1166           HD1      PRO1166  -2.141   2.290  -0.135
  468    H    CYS1167           HN       CYS1167  -6.854   0.768   1.840
  469    HA   CYS1167           HA       CYS1167  -8.891   0.325  -0.038
  470   1HB   CYS1167           HB2      CYS1167  -8.762  -0.202   2.502
  471   2HB   CYS1167           HB1      CYS1167  -9.412   1.417   2.705
  472    H    VAL1168           HN       VAL1168  -8.957   1.966  -1.577
  473    HA   VAL1168           HA       VAL1168  -9.865   4.574  -0.561
  474    HB   VAL1168           HB       VAL1168  -7.752   4.890  -1.621
  475   1HG1  VAL1168          3HG1      VAL1168  -8.888   3.426  -3.999
  476   2HG1  VAL1168          2HG1      VAL1168  -7.317   4.225  -3.944
  477   3HG1  VAL1168          1HG1      VAL1168  -7.635   2.836  -2.906
  478   1HG2  VAL1168          2HG2      VAL1168  -9.421   6.603  -2.067
  479   2HG2  VAL1168          1HG2      VAL1168  -8.329   6.421  -3.441
  480   3HG2  VAL1168          3HG2      VAL1168  -9.951   5.729  -3.504
  481    H    ILE1169           HN       ILE1169 -12.053   3.841  -0.561
  482    HA   ILE1169           HA       ILE1169 -13.225   3.240  -3.170
  483    HB   ILE1169           HB       ILE1169 -13.980   2.662  -0.428
  484   1HG1  ILE1169          2HG1      ILE1169 -14.721   1.677  -3.174
  485   2HG1  ILE1169          1HG1      ILE1169 -13.778   0.863  -1.929
  486   1HG2  ILE1169          3HG2      ILE1169 -15.537   4.537  -0.754
  487   2HG2  ILE1169          2HG2      ILE1169 -16.179   3.740  -2.188
  488   3HG2  ILE1169          1HG2      ILE1169 -16.376   2.994  -0.602
  489   1HD1  ILE1169          3HD1      ILE1169 -16.743   1.386  -1.826
  490   2HD1  ILE1169          2HD1      ILE1169 -15.971  -0.157  -2.193
  491   3HD1  ILE1169          1HD1      ILE1169 -15.794   0.560  -0.592
  492    H    SER1170           HN       SER1170 -15.026   4.449  -3.984
  493    HA   SER1170           HA       SER1170 -14.713   7.293  -3.494
  494   1HB   SER1170           HB2      SER1170 -16.434   5.813  -5.497
  495   2HB   SER1170           HB1      SER1170 -16.204   7.561  -5.445
  496    HG   SER1170           HG       SER1170 -14.419   5.546  -6.206
  497    H    ARG1171           HN       ARG1171 -15.913   8.375  -2.087
  498    HA   ARG1171           HA       ARG1171 -18.028   7.269  -0.616
  499   1HB   ARG1171           HB2      ARG1171 -18.444   9.598   0.143
  500   2HB   ARG1171           HB1      ARG1171 -16.757   9.120   0.263
  501   1HG   ARG1171           HG2      ARG1171 -16.477  11.175  -0.641
  502   2HG   ARG1171           HG1      ARG1171 -16.657  10.250  -2.134
  503   1HD   ARG1171           HD2      ARG1171 -19.035  10.819  -2.198
  504   2HD   ARG1171           HD1      ARG1171 -18.856  11.741  -0.706
  505    HE   ARG1171           HE       ARG1171 -17.033  12.707  -2.614
  506   1HH1  ARG1171          1HH1      ARG1171 -20.455  12.627  -1.962
  507   2HH1  ARG1171          2HH1      ARG1171 -20.779  14.111  -2.794
  508   1HH2  ARG1171          1HH2      ARG1171 -17.450  14.661  -3.712
  509   2HH2  ARG1171          2HH2      ARG1171 -19.071  15.266  -3.791
  510    H    GLU1172           HN       GLU1172 -18.006   9.268  -3.519
  511    HA   GLU1172           HA       GLU1172 -20.814   9.690  -3.609
  512   1HB   GLU1172           HB2      GLU1172 -19.110  11.080  -4.807
  513   2HB   GLU1172           HB1      GLU1172 -18.851   9.735  -5.910
  514   1HG   GLU1172           HG2      GLU1172 -21.179   9.875  -6.631
  515   2HG   GLU1172           HG1      GLU1172 -21.441  11.219  -5.521
  516    H    ILE1173           HN       ILE1173 -19.079   6.907  -3.895
  517    HA   ILE1173           HA       ILE1173 -21.098   5.696  -5.655
  518    HB   ILE1173           HB       ILE1173 -18.161   5.137  -5.417
  519   1HG1  ILE1173          2HG1      ILE1173 -18.584   5.029  -7.988
  520   2HG1  ILE1173          1HG1      ILE1173 -20.098   5.838  -7.593
  521   1HG2  ILE1173          2HG2      ILE1173 -20.233   3.271  -6.539
  522   2HG2  ILE1173          1HG2      ILE1173 -18.492   3.119  -6.773
  523   3HG2  ILE1173          3HG2      ILE1173 -19.179   2.973  -5.156
  524   1HD1  ILE1173          3HD1      ILE1173 -18.824   7.630  -6.512
  525   2HD1  ILE1173          2HD1      ILE1173 -17.332   6.827  -6.998
  526   3HD1  ILE1173          1HD1      ILE1173 -18.436   7.448  -8.223
  527    H    MET1174           HN       MET1174 -19.664   5.666  -2.522
  528    HA   MET1174           HA       MET1174 -21.012   3.115  -1.968
  529   1HB   MET1174           HB2      MET1174 -19.562   2.747  -0.132
  530   2HB   MET1174           HB1      MET1174 -18.548   3.246  -1.476
  531   1HG   MET1174           HG2      MET1174 -17.702   4.884  -0.272
  532   2HG   MET1174           HG1      MET1174 -19.307   5.553   0.006
  533   1HE   MET1174           HE1      MET1174 -20.706   3.138   1.587
  534   2HE   MET1174           HE3      MET1174 -20.407   3.627   3.255
  535   3HE   MET1174           HE2      MET1174 -20.873   4.830   2.054
  536    H    GLU1175           HN       GLU1175 -20.402   6.303  -0.438
  537    HA   GLU1175           HA       GLU1175 -22.621   5.892   1.366
  538   1HB   GLU1175           HB2      GLU1175 -21.958   7.844   2.458
  539   2HB   GLU1175           HB1      GLU1175 -20.433   7.220   1.846
  540   1HG   GLU1175           HG2      GLU1175 -20.381   8.806   0.092
  541   2HG   GLU1175           HG1      GLU1175 -22.051   9.289   0.387
  542    H    ASN1176           HN       ASN1176 -22.523   6.517  -1.795
  543    HA   ASN1176           HA       ASN1176 -24.875   8.282  -1.731
  544   1HB   ASN1176           HB2      ASN1176 -22.742   9.171  -2.790
  545   2HB   ASN1176           HB1      ASN1176 -23.012   7.984  -4.054
  546   1HD2  ASN1176          1HD2      ASN1176 -23.283   9.530  -5.636
  547   2HD2  ASN1176          2HD2      ASN1176 -24.700  10.514  -5.733
  548    H    TYR1177           HN       TYR1177 -23.537   5.287  -2.840
  549    HA   TYR1177           HA       TYR1177 -25.683   4.773  -4.724
  550   1HB   TYR1177           HB2      TYR1177 -23.228   3.294  -3.857
  551   2HB   TYR1177           HB1      TYR1177 -24.520   2.419  -4.665
  552    HD1  TYR1177           HD1      TYR1177 -24.310   5.795  -5.807
  553    HD2  TYR1177           HD2      TYR1177 -22.585   1.933  -6.268
  554    HE1  TYR1177           HE1      TYR1177 -23.397   6.468  -7.990
  555    HE2  TYR1177           HE2      TYR1177 -21.666   2.593  -8.445
  556    HH   TYR1177           HH       TYR1177 -22.122   4.246 -10.213
  557    H    ASN1178           HN       ASN1178 -26.539   5.260  -2.076
  558    HA   ASN1178           HA       ASN1178 -28.078   4.470  -0.620
  559   1HB   ASN1178           HB2      ASN1178 -28.207   1.815  -1.996
  560   2HB   ASN1178           HB1      ASN1178 -29.497   2.740  -1.236
  561   1HD2  ASN1178          1HD2      ASN1178 -29.281   1.500  -3.890
  562   2HD2  ASN1178          2HD2      ASN1178 -29.600   2.765  -5.020
  563    H    ILE1179           HN       ILE1179 -25.039   3.440  -0.848
  564    HA   ILE1179           HA       ILE1179 -25.303   1.332   1.175
  565    HB   ILE1179           HB       ILE1179 -22.571   1.990   0.385
  566   1HG1  ILE1179          2HG1      ILE1179 -24.386   0.810  -1.732
  567   2HG1  ILE1179          1HG1      ILE1179 -23.766   2.458  -1.768
  568   1HG2  ILE1179          3HG2      ILE1179 -24.212  -0.535   0.401
  569   2HG2  ILE1179          2HG2      ILE1179 -22.473  -0.459   0.108
  570   3HG2  ILE1179          1HG2      ILE1179 -23.126   0.035   1.670
  571   1HD1  ILE1179          3HD1      ILE1179 -21.471   1.565  -1.826
  572   2HD1  ILE1179          2HD1      ILE1179 -22.132  -0.069  -1.871
  573   3HD1  ILE1179          1HD1      ILE1179 -22.440   1.042  -3.206
  574    H    ALA1180           HN       ALA1180 -23.640   1.388   2.948
  575    HA   ALA1180           HA       ALA1180 -22.597   3.935   3.739
  576   1HB   ALA1180           HB3      ALA1180 -24.943   4.233   4.366
  577   2HB   ALA1180           HB2      ALA1180 -24.873   2.763   5.337
  578   3HB   ALA1180           HB1      ALA1180 -23.902   4.165   5.788
  579    H    LEU1181           HN       LEU1181 -21.218   3.783   5.544
  580    HA   LEU1181           HA       LEU1181 -19.633   1.580   5.769
  581   1HB   LEU1181           HB2      LEU1181 -20.298   3.523   7.972
  582   2HB   LEU1181           HB1      LEU1181 -18.875   2.499   7.912
  583    HG   LEU1181           HG       LEU1181 -19.433   4.495   5.738
  584   1HD1  LEU1181          2HD1      LEU1181 -19.505   5.707   7.864
  585   2HD1  LEU1181          1HD1      LEU1181 -17.940   5.021   8.302
  586   3HD1  LEU1181          3HD1      LEU1181 -18.069   6.115   6.924
  587   1HD2  LEU1181          2HD2      LEU1181 -16.918   3.220   6.806
  588   2HD2  LEU1181          1HD2      LEU1181 -17.742   2.812   5.302
  589   3HD2  LEU1181          3HD2      LEU1181 -16.994   4.398   5.495
  590    H    ARG1182           HN       ARG1182 -19.409  -0.123   7.285
  591    HA   ARG1182           HA       ARG1182 -21.735  -1.525   7.910
  592   1HB   ARG1182           HB2      ARG1182 -19.582  -2.633   7.719
  593   2HB   ARG1182           HB1      ARG1182 -18.971  -1.751   9.112
  594   1HG   ARG1182           HG2      ARG1182 -20.632  -2.883  10.530
  595   2HG   ARG1182           HG1      ARG1182 -21.171  -3.806   9.125
  596   1HD   ARG1182           HD2      ARG1182 -19.587  -5.052  10.561
  597   2HD   ARG1182           HD1      ARG1182 -19.010  -4.838   8.908
  598    HE   ARG1182           HE       ARG1182 -17.997  -2.729  10.389
  599   1HH1  ARG1182          1HH1      ARG1182 -17.746  -6.204  10.346
  600   2HH1  ARG1182          2HH1      ARG1182 -16.133  -6.224  10.977
  601   1HH2  ARG1182          1HH2      ARG1182 -15.872  -2.746  11.219
  602   2HH2  ARG1182          2HH2      ARG1182 -15.068  -4.259  11.474
  603    H    TRP1183           HN       TRP1183 -20.129   1.009   9.563
  604    HA   TRP1183           HA       TRP1183 -21.704   0.556  12.001
  605   1HB   TRP1183           HB2      TRP1183 -19.439   2.523  11.652
  606   2HB   TRP1183           HB1      TRP1183 -20.123   1.916  13.158
  607    HD1  TRP1183           HD1      TRP1183 -18.272   0.418  10.083
  608    HE1  TRP1183           HE1      TRP1183 -16.710  -1.442  10.928
  609    HE3  TRP1183           HE3      TRP1183 -19.432   0.577  15.062
  610    HZ2  TRP1183           HZ2      TRP1183 -16.046  -2.666  13.367
  611    HZ3  TRP1183           HZ3      TRP1183 -18.281  -0.976  16.586
  612    HH2  TRP1183           HH2      TRP1183 -16.623  -2.565  15.755
  613    H    THR1184           HN       THR1184 -21.789   2.194   9.158
  614    HA   THR1184           HA       THR1184 -22.885   3.992   8.329
  615    HB   THR1184           HB       THR1184 -25.092   4.492   9.314
  616    HG1  THR1184           HG1      THR1184 -25.073   2.471  11.140
  617   1HG2  THR1184          1HG2      THR1184 -24.806   2.621   7.763
  618   2HG2  THR1184          3HG2      THR1184 -24.473   1.548   9.123
  619   3HG2  THR1184          2HG2      THR1184 -26.065   2.289   8.954
  620    H    ALA1185           HN       ALA1185 -21.283   5.511   8.643
  621    HA   ALA1185           HA       ALA1185 -21.790   7.384  10.861
  622   1HB   ALA1185           HB1      ALA1185 -19.121   6.756   9.604
  623   2HB   ALA1185           HB3      ALA1185 -19.415   7.921  10.896
  624   3HB   ALA1185           HB2      ALA1185 -19.672   6.201  11.185
  625    H    LYS1186           HN       LYS1186 -19.830   7.442   7.896
  626    HA   LYS1186           HA       LYS1186 -21.282   8.985   6.221
  627   1HB   LYS1186           HB2      LYS1186 -20.460  11.316   6.631
  628   2HB   LYS1186           HB1      LYS1186 -21.578  10.720   7.850
  629   1HG   LYS1186           HG2      LYS1186 -19.691  10.232   9.334
  630   2HG   LYS1186           HG1      LYS1186 -18.582  10.863   8.115
  631   1HD   LYS1186           HD2      LYS1186 -19.663  13.051   8.258
  632   2HD   LYS1186           HD1      LYS1186 -20.781  12.421   9.471
  633   1HE   LYS1186           HE2      LYS1186 -17.784  12.603   9.751
  634   2HE   LYS1186           HE1      LYS1186 -18.960  13.680  10.505
  635   1HZ   LYS1186           HZ2      LYS1186 -19.847  11.796  11.729
  636   2HZ   LYS1186           HZ1      LYS1186 -18.720  10.763  11.006
  637   3HZ   LYS1186           HZ3      LYS1186 -18.198  11.990  12.048
  638    H    GLN1187           HN       GLN1187 -20.140   8.149   4.577
  639    HA   GLN1187           HA       GLN1187 -18.470   7.947   3.048
  640   1HB   GLN1187           HB2      GLN1187 -18.185  10.371   3.271
  641   2HB   GLN1187           HB1      GLN1187 -17.174  10.140   4.689
  642   1HG   GLN1187           HG2      GLN1187 -15.506   9.002   3.305
  643   2HG   GLN1187           HG1      GLN1187 -16.516   9.273   1.885
  644   1HE2  GLN1187          1HE2      GLN1187 -16.185  11.601   4.461
  645   2HE2  GLN1187          2HE2      GLN1187 -15.294  12.771   3.555
  646    H    LYS1188           HN       LYS1188 -16.071   8.892   5.331
  647    HA   LYS1188           HA       LYS1188 -14.211   7.701   6.018
  648   1HB   LYS1188           HB2      LYS1188 -16.084   7.701   7.764
  649   2HB   LYS1188           HB1      LYS1188 -16.329   6.019   7.324
  650   1HG   LYS1188           HG2      LYS1188 -14.034   5.499   7.964
  651   2HG   LYS1188           HG1      LYS1188 -13.763   7.192   8.383
  652   1HD   LYS1188           HD2      LYS1188 -15.506   7.046  10.096
  653   2HD   LYS1188           HD1      LYS1188 -15.775   5.352   9.677
  654   1HE   LYS1188           HE2      LYS1188 -13.212   6.529  10.747
  655   2HE   LYS1188           HE1      LYS1188 -14.368   5.565  11.663
  656   1HZ   LYS1188           HZ1      LYS1188 -12.825   4.628   9.305
  657   2HZ   LYS1188           HZ3      LYS1188 -12.501   4.231  10.919
  658   3HZ   LYS1188           HZ2      LYS1188 -13.931   3.702  10.188
  659    H    LEU1189           HN       LEU1189 -14.956   6.664   3.422
  660    HA   LEU1189           HA       LEU1189 -14.830   3.772   3.695
  661   1HB   LEU1189           HB2      LEU1189 -14.738   3.958   1.113
  662   2HB   LEU1189           HB1      LEU1189 -16.237   4.261   1.961
  663    HG   LEU1189           HG       LEU1189 -15.522   5.828   0.036
  664   1HD1  LEU1189          2HD1      LEU1189 -16.496   6.815   2.687
  665   2HD1  LEU1189          1HD1      LEU1189 -16.561   7.754   1.196
  666   3HD1  LEU1189          3HD1      LEU1189 -17.463   6.245   1.329
  667   1HD2  LEU1189          2HD2      LEU1189 -13.879   6.981   2.270
  668   2HD2  LEU1189          1HD2      LEU1189 -13.269   6.296   0.764
  669   3HD2  LEU1189          3HD2      LEU1189 -14.228   7.775   0.734
  670    H    TYR1190           HN       TYR1190 -12.535   5.175   4.669
  671    HA   TYR1190           HA       TYR1190 -10.540   4.282   2.697
  672   1HB   TYR1190           HB2      TYR1190 -10.655   6.734   4.370
  673   2HB   TYR1190           HB1      TYR1190  -9.075   6.009   4.097
  674    HD1  TYR1190           HD1      TYR1190 -11.663   5.715   1.524
  675    HD2  TYR1190           HD2      TYR1190  -8.329   7.995   2.885
  676    HE1  TYR1190           HE1      TYR1190 -11.523   6.824  -0.668
  677    HE2  TYR1190           HE2      TYR1190  -8.189   9.107   0.698
  678    HH   TYR1190           HH       TYR1190 -10.651   8.913  -1.626
  679    H    SER1191           HN       SER1191  -9.356   2.649   3.272
  680    HA   SER1191           HA       SER1191  -8.612   2.274   6.088
  681   1HB   SER1191           HB2      SER1191  -9.799   0.185   4.251
  682   2HB   SER1191           HB1      SER1191  -8.903  -0.230   5.709
  683    HG   SER1191           HG       SER1191 -10.468   1.176   6.821
  684    H    ARG1192           HN       ARG1192  -7.075   0.092   5.945
  685    HA   ARG1192           HA       ARG1192  -4.982   0.864   4.033
  686   1HB   ARG1192           HB2      ARG1192  -4.394   1.007   6.443
  687   2HB   ARG1192           HB1      ARG1192  -4.723  -0.712   6.603
  688   1HG   ARG1192           HG2      ARG1192  -2.892  -1.280   5.202
  689   2HG   ARG1192           HG1      ARG1192  -2.656   0.404   4.729
  690   1HD   ARG1192           HD2      ARG1192  -0.993  -0.288   6.373
  691   2HD   ARG1192           HD1      ARG1192  -2.043   0.975   7.018
  692    HE   ARG1192           HE       ARG1192  -3.141  -1.466   7.761
  693   1HH1  ARG1192          1HH1      ARG1192  -0.224   0.352   8.335
  694   2HH1  ARG1192          2HH1      ARG1192   0.033  -0.314   9.912
  695   1HH2  ARG1192          1HH2      ARG1192  -2.810  -2.348   9.838
  696   2HH2  ARG1192          2HH2      ARG1192  -1.435  -1.849  10.766
  697    H    THR1193           HN       THR1193  -4.771  -0.432   2.332
  698    HA   THR1193           HA       THR1193  -6.177  -2.628   1.697
  699    HB   THR1193           HB       THR1193  -3.385  -1.842   0.944
  700    HG1  THR1193           HG1      THR1193  -5.926  -1.666  -0.071
  701   1HG2  THR1193          1HG2      THR1193  -3.411  -4.339   1.034
  702   2HG2  THR1193          3HG2      THR1193  -4.738  -4.321  -0.127
  703   3HG2  THR1193          2HG2      THR1193  -3.155  -3.689  -0.586
  704    H    GLY1194           HN       GLY1194  -6.539  -4.465   2.682
  705   1HA   GLY1194           HA1      GLY1194  -4.410  -5.620   4.359
  706   2HA   GLY1194           HA2      GLY1194  -5.315  -6.624   3.232
  707    H    GLU1195           HN       GLU1195  -7.073  -4.095   4.712
  708    HA   GLU1195           HA       GLU1195  -8.098  -5.900   6.792
  709   1HB   GLU1195           HB2      GLU1195  -8.398  -2.905   6.491
  710   2HB   GLU1195           HB1      GLU1195  -9.057  -3.864   7.811
  711   1HG   GLU1195           HG2      GLU1195  -6.137  -3.526   7.164
  712   2HG   GLU1195           HG1      GLU1195  -7.012  -2.725   8.467
  713    H    SER1196           HN       SER1196 -10.326  -6.211   7.065
  714    HA   SER1196           HA       SER1196 -11.820  -6.125   4.588
  715   1HB   SER1196           HB2      SER1196 -12.571  -7.222   7.308
  716   2HB   SER1196           HB1      SER1196 -13.506  -7.435   5.829
  717    HG   SER1196           HG       SER1196 -12.014  -8.785   5.053
  718    H    VAL1197           HN       VAL1197 -13.482  -4.808   4.107
  719    HA   VAL1197           HA       VAL1197 -14.484  -3.013   6.213
  720    HB   VAL1197           HB       VAL1197 -13.848  -2.207   3.369
  721   1HG1  VAL1197          3HG1      VAL1197 -14.944  -0.593   5.673
  722   2HG1  VAL1197          2HG1      VAL1197 -14.467   0.053   4.102
  723   3HG1  VAL1197          1HG1      VAL1197 -15.825  -1.067   4.221
  724   1HG2  VAL1197          2HG2      VAL1197 -12.537  -1.431   5.976
  725   2HG2  VAL1197          1HG2      VAL1197 -11.839  -2.457   4.723
  726   3HG2  VAL1197          3HG2      VAL1197 -12.155  -0.754   4.392
  727    H    GLU1198           HN       GLU1198 -16.588  -3.256   6.468
  728    HA   GLU1198           HA       GLU1198 -18.176  -4.338   4.255
  729   1HB   GLU1198           HB2      GLU1198 -18.535  -5.715   6.082
  730   2HB   GLU1198           HB1      GLU1198 -18.444  -4.388   7.232
  731   1HG   GLU1198           HG2      GLU1198 -20.621  -3.711   6.822
  732   2HG   GLU1198           HG1      GLU1198 -20.707  -4.581   5.288
  733    H    PHE1199           HN       PHE1199 -19.891  -3.291   3.399
  734    HA   PHE1199           HA       PHE1199 -20.493  -0.601   4.452
  735   1HB   PHE1199           HB2      PHE1199 -20.710  -1.464   1.560
  736   2HB   PHE1199           HB1      PHE1199 -20.917   0.162   2.199
  737    HD1  PHE1199           HD1      PHE1199 -19.175   1.637   1.978
  738    HD2  PHE1199           HD2      PHE1199 -18.355  -2.537   2.087
  739    HE1  PHE1199           HE1      PHE1199 -16.794   2.102   1.533
  740    HE2  PHE1199           HE2      PHE1199 -15.987  -2.089   1.655
  741    HZ   PHE1199           HZ       PHE1199 -15.195   0.230   1.381
  742    H    VAL1200           HN       VAL1200 -22.294  -1.213   5.673
  743    HA   VAL1200           HA       VAL1200 -24.310  -2.973   4.843
  744    HB   VAL1200           HB       VAL1200 -25.743  -1.938   6.527
  745   1HG1  VAL1200          3HG1      VAL1200 -22.875  -2.198   7.429
  746   2HG1  VAL1200          2HG1      VAL1200 -24.283  -2.216   8.490
  747   3HG1  VAL1200          1HG1      VAL1200 -24.057  -3.501   7.303
  748   1HG2  VAL1200          2HG2      VAL1200 -23.620   0.191   6.652
  749   2HG2  VAL1200          1HG2      VAL1200 -25.289   0.387   6.116
  750   3HG2  VAL1200          3HG2      VAL1200 -24.943   0.017   7.806
  751    H    CYS1201           HN       CYS1201 -26.713  -2.011   4.646
  752    HA   CYS1201           HA       CYS1201 -26.555  -0.176   2.364
  753   1HB   CYS1201           HB2      CYS1201 -28.733  -2.126   3.134
  754   2HB   CYS1201           HB1      CYS1201 -28.801  -1.030   1.758
  755    H    LYS1202           HN       LYS1202 -27.440   1.747   2.410
  756    HA   LYS1202           HA       LYS1202 -27.967   3.232   4.555
  757   1HB   LYS1202           HB2      LYS1202 -27.904   4.124   2.285
  758   2HB   LYS1202           HB1      LYS1202 -29.476   3.414   1.950
  759   1HG   LYS1202           HG2      LYS1202 -30.462   4.845   3.700
  760   2HG   LYS1202           HG1      LYS1202 -28.883   5.601   3.930
  761   1HD   LYS1202           HD2      LYS1202 -28.890   6.356   1.619
  762   2HD   LYS1202           HD1      LYS1202 -30.441   5.559   1.349
  763   1HE   LYS1202           HE2      LYS1202 -29.923   7.815   3.287
  764   2HE   LYS1202           HE1      LYS1202 -30.707   7.969   1.714
  765   1HZ   LYS1202           HZ3      LYS1202 -31.721   6.355   3.992
  766   2HZ   LYS1202           HZ2      LYS1202 -32.319   7.864   3.513
  767   3HZ   LYS1202           HZ1      LYS1202 -32.477   6.528   2.487
  768    H    ARG1203           HN       ARG1203 -28.994   2.293   6.208
  769    HA   ARG1203           HA       ARG1203 -30.692   1.094   7.294
  770   1HB   ARG1203           HB2      ARG1203 -32.367   2.912   7.874
  771   2HB   ARG1203           HB1      ARG1203 -30.674   3.241   8.198
  772   1HG   ARG1203           HG2      ARG1203 -30.489   4.663   6.317
  773   2HG   ARG1203           HG1      ARG1203 -32.064   4.158   5.705
  774   1HD   ARG1203           HD2      ARG1203 -32.194   6.365   6.731
  775   2HD   ARG1203           HD1      ARG1203 -33.151   5.191   7.634
  776    HE   ARG1203           HE       ARG1203 -30.634   5.278   8.807
  777   1HH1  ARG1203          1HH1      ARG1203 -33.340   7.414   8.295
  778   2HH1  ARG1203          2HH1      ARG1203 -33.040   8.345   9.724
  779   1HH2  ARG1203          1HH2      ARG1203 -30.232   6.499  10.690
  780   2HH2  ARG1203          2HH2      ARG1203 -31.273   7.825  11.085
  781    H    GLY1204           HN       GLY1204 -31.615  -0.545   6.047
  782   1HA   GLY1204           HA1      GLY1204 -34.249   0.181   4.965
  783   2HA   GLY1204           HA2      GLY1204 -33.793  -1.404   5.560
  784    H    TYR1205           HN       TYR1205 -32.082   0.642   3.197
  785    HA   TYR1205           HA       TYR1205 -32.983  -0.322   0.832
  786   1HB   TYR1205           HB2      TYR1205 -30.341   0.635   1.755
  787   2HB   TYR1205           HB1      TYR1205 -30.347  -0.244   0.234
  788    HD1  TYR1205           HD1      TYR1205 -31.303   2.829   1.934
  789    HD2  TYR1205           HD2      TYR1205 -31.557   0.655  -1.706
  790    HE1  TYR1205           HE1      TYR1205 -32.003   4.877   0.768
  791    HE2  TYR1205           HE2      TYR1205 -32.259   2.693  -2.885
  792    HH   TYR1205           HH       TYR1205 -32.002   5.784  -1.521
  793    H    ARG1206           HN       ARG1206 -33.573  -2.393   0.540
  794    HA   ARG1206           HA       ARG1206 -32.204  -4.625   1.605
  795   1HB   ARG1206           HB2      ARG1206 -33.690  -5.984   0.257
  796   2HB   ARG1206           HB1      ARG1206 -34.592  -4.665   0.990
  797   1HG   ARG1206           HG2      ARG1206 -34.636  -3.463  -1.085
  798   2HG   ARG1206           HG1      ARG1206 -33.569  -4.649  -1.841
  799   1HD   ARG1206           HD2      ARG1206 -35.310  -6.378  -1.441
  800   2HD   ARG1206           HD1      ARG1206 -36.379  -5.107  -0.850
  801    HE   ARG1206           HE       ARG1206 -35.596  -4.264  -3.331
  802   1HH1  ARG1206          1HH1      ARG1206 -37.158  -7.105  -2.054
  803   2HH1  ARG1206          2HH1      ARG1206 -38.064  -7.414  -3.498
  804   1HH2  ARG1206          1HH2      ARG1206 -36.783  -4.664  -5.237
  805   2HH2  ARG1206          2HH2      ARG1206 -37.849  -6.027  -5.308
  806    H    LEU1207           HN       LEU1207 -30.559  -5.821   0.874
  807    HA   LEU1207           HA       LEU1207 -28.772  -4.957  -1.024
  808   1HB   LEU1207           HB2      LEU1207 -28.381  -6.740   0.682
  809   2HB   LEU1207           HB1      LEU1207 -29.289  -7.849  -0.327
  810    HG   LEU1207           HG       LEU1207 -27.589  -7.450  -2.142
  811   1HD1  LEU1207          3HD1      LEU1207 -26.731  -5.311  -1.304
  812   2HD1  LEU1207          2HD1      LEU1207 -26.055  -6.139   0.101
  813   3HD1  LEU1207          1HD1      LEU1207 -25.443  -6.498  -1.514
  814   1HD2  LEU1207          3HD2      LEU1207 -27.541  -9.448  -0.749
  815   2HD2  LEU1207          2HD2      LEU1207 -25.907  -8.910  -1.138
  816   3HD2  LEU1207          1HD2      LEU1207 -26.582  -8.592   0.460
  817    H    SER1208           HN       SER1208 -28.724  -4.893  -3.172
  818    HA   SER1208           HA       SER1208 -30.926  -5.555  -4.760
  819   1HB   SER1208           HB2      SER1208 -29.299  -3.868  -5.438
  820   2HB   SER1208           HB1      SER1208 -28.049  -5.104  -5.584
  821    HG   SER1208           HG       SER1208 -28.990  -4.594  -7.605
  822    H    SER1209           HN       SER1209 -28.590  -7.584  -3.444
  823    HA   SER1209           HA       SER1209 -28.274  -9.833  -3.579
  824   1HB   SER1209           HB2      SER1209 -30.678 -10.075  -3.976
  825   2HB   SER1209           HB1      SER1209 -30.440  -9.757  -5.693
  826    HG   SER1209           HG       SER1209 -30.575 -12.033  -5.022
  827    H    ARG1210           HN       ARG1210 -28.939  -8.765  -6.926
  828    HA   ARG1210           HA       ARG1210 -26.957 -10.331  -8.123
  829   1HB   ARG1210           HB2      ARG1210 -28.110  -7.700  -9.069
  830   2HB   ARG1210           HB1      ARG1210 -27.209  -8.833 -10.066
  831   1HG   ARG1210           HG2      ARG1210 -28.940 -10.502  -9.790
  832   2HG   ARG1210           HG1      ARG1210 -29.831  -9.427  -8.712
  833   1HD   ARG1210           HD2      ARG1210 -30.767  -9.402 -10.969
  834   2HD   ARG1210           HD1      ARG1210 -30.120  -7.824 -10.520
  835    HE   ARG1210           HE       ARG1210 -28.177  -9.353 -11.908
  836   1HH1  ARG1210          1HH1      ARG1210 -31.084  -7.494 -12.393
  837   2HH1  ARG1210          2HH1      ARG1210 -30.690  -7.064 -14.024
  838   1HH2  ARG1210          1HH2      ARG1210 -27.652  -8.793 -14.054
  839   2HH2  ARG1210          2HH2      ARG1210 -28.741  -7.803 -14.969
  840    H    SER1211           HN       SER1211 -26.647  -7.636  -6.130
  841    HA   SER1211           HA       SER1211 -24.411  -6.327  -7.206
  842   1HB   SER1211           HB2      SER1211 -25.289  -6.624  -4.324
  843   2HB   SER1211           HB1      SER1211 -24.051  -5.499  -4.881
  844    HG   SER1211           HG       SER1211 -26.461  -4.870  -4.681
  845    H    HIS1212           HN       HIS1212 -22.341  -6.272  -5.586
  846    HA   HIS1212           HA       HIS1212 -21.122  -8.861  -5.986
  847   1HB   HIS1212           HB2      HIS1212 -19.975  -6.279  -4.911
  848   2HB   HIS1212           HB1      HIS1212 -19.042  -7.730  -5.266
  849    HD1  HIS1212           HD1      HIS1212 -20.427  -4.708  -6.815
  850    HD2  HIS1212           HD2      HIS1212 -18.931  -8.372  -8.082
  851    HE1  HIS1212           HE1      HIS1212 -19.952  -4.429  -9.268
  852    HE2  HIS1212           HE2      HIS1212 -18.966  -6.632  -9.994
  853    H    THR1213           HN       THR1213 -20.635  -6.730  -3.184
  854    HA   THR1213           HA       THR1213 -21.823  -8.535  -1.331
  855    HB   THR1213           HB       THR1213 -20.015  -9.971  -1.505
  856    HG1  THR1213           HG1      THR1213 -19.388  -9.909   0.521
  857   1HG2  THR1213          1HG2      THR1213 -18.184  -7.571  -1.597
  858   2HG2  THR1213          3HG2      THR1213 -17.670  -9.258  -1.645
  859   3HG2  THR1213          2HG2      THR1213 -18.626  -8.589  -2.967
  860    H    LEU1214           HN       LEU1214 -21.343  -7.951   0.945
  861    HA   LEU1214           HA       LEU1214 -21.246  -5.041   1.193
  862   1HB   LEU1214           HB2      LEU1214 -22.038  -7.230   3.114
  863   2HB   LEU1214           HB1      LEU1214 -21.953  -5.540   3.568
  864    HG   LEU1214           HG       LEU1214 -24.239  -6.054   3.128
  865   1HD1  LEU1214          3HD1      LEU1214 -22.941  -4.517   0.891
  866   2HD1  LEU1214          2HD1      LEU1214 -24.690  -4.598   1.125
  867   3HD1  LEU1214          1HD1      LEU1214 -23.662  -3.885   2.370
  868   1HD2  LEU1214          2HD2      LEU1214 -23.888  -8.084   1.811
  869   2HD2  LEU1214          1HD2      LEU1214 -25.014  -6.983   1.018
  870   3HD2  LEU1214          3HD2      LEU1214 -23.350  -7.105   0.446
  871    H    ARG1215           HN       ARG1215 -19.959  -7.796   3.036
  872    HA   ARG1215           HA       ARG1215 -17.763  -6.152   4.004
  873   1HB   ARG1215           HB2      ARG1215 -18.975  -7.747   5.504
  874   2HB   ARG1215           HB1      ARG1215 -18.333  -9.073   4.544
  875   1HG   ARG1215           HG2      ARG1215 -16.049  -8.352   5.129
  876   2HG   ARG1215           HG1      ARG1215 -16.738  -7.091   6.154
  877   1HD   ARG1215           HD2      ARG1215 -17.145 -10.062   6.479
  878   2HD   ARG1215           HD1      ARG1215 -16.094  -9.046   7.466
  879    HE   ARG1215           HE       ARG1215 -18.681  -7.984   7.551
  880   1HH1  ARG1215          1HH1      ARG1215 -16.936 -10.810   8.608
  881   2HH1  ARG1215          2HH1      ARG1215 -17.957 -11.085   9.979
  882   1HH2  ARG1215          1HH2      ARG1215 -20.030  -8.340   9.355
  883   2HH2  ARG1215          2HH2      ARG1215 -19.715  -9.682  10.404
  884    H    THR1216           HN       THR1216 -16.241  -5.820   2.494
  885    HA   THR1216           HA       THR1216 -15.218  -8.178   1.045
  886    HB   THR1216           HB       THR1216 -16.233  -6.666  -0.526
  887    HG1  THR1216           HG1      THR1216 -14.100  -7.614  -1.009
  888   1HG2  THR1216          1HG2      THR1216 -14.465  -4.544   0.691
  889   2HG2  THR1216          3HG2      THR1216 -15.417  -4.339  -0.780
  890   3HG2  THR1216          2HG2      THR1216 -16.226  -4.617   0.762
  891    H    THR1217           HN       THR1217 -12.937  -7.548   0.103
  892    HA   THR1217           HA       THR1217 -11.311  -6.581   2.364
  893    HB   THR1217           HB       THR1217 -10.763  -8.758   0.352
  894    HG1  THR1217           HG1      THR1217 -10.082  -9.207   2.943
  895   1HG2  THR1217          2HG2      THR1217  -8.799  -7.209   0.527
  896   2HG2  THR1217          1HG2      THR1217  -8.737  -7.572   2.252
  897   3HG2  THR1217          3HG2      THR1217  -8.472  -8.856   1.072
  898    H    CYS1218           HN       CYS1218 -10.360  -4.691   1.973
  899    HA   CYS1218           HA       CYS1218 -10.266  -3.534  -0.607
  900   1HB   CYS1218           HB2      CYS1218  -8.550  -2.658   1.706
  901   2HB   CYS1218           HB1      CYS1218  -9.212  -1.681   0.398
  902    H    TRP1219           HN       TRP1219  -8.734  -3.565  -2.138
  903    HA   TRP1219           HA       TRP1219  -6.026  -4.350  -1.523
  904   1HB   TRP1219           HB2      TRP1219  -7.697  -6.421  -2.003
  905   2HB   TRP1219           HB1      TRP1219  -7.208  -6.040  -3.651
  906    HD1  TRP1219           HD1      TRP1219  -4.745  -6.640  -4.370
  907    HE1  TRP1219           HE1      TRP1219  -2.874  -8.003  -3.246
  908    HE3  TRP1219           HE3      TRP1219  -6.683  -6.972   0.352
  909    HZ2  TRP1219           HZ2      TRP1219  -2.291  -9.073  -0.719
  910    HZ3  TRP1219           HZ3      TRP1219  -5.400  -8.187   2.067
  911    HH2  TRP1219           HH2      TRP1219  -3.249  -9.217   1.541
  912    H    ASP1220           HN       ASP1220  -4.590  -3.596  -2.981
  913    HA   ASP1220           HA       ASP1220  -3.787  -2.191  -4.577
  914   1HB   ASP1220           HB2      ASP1220  -4.257  -2.810  -6.843
  915   2HB   ASP1220           HB1      ASP1220  -4.265  -4.281  -5.877
  916    H    GLY1221           HN       GLY1221  -6.356  -1.424  -3.110
  917   1HA   GLY1221           HA1      GLY1221  -6.723   1.065  -4.502
  918   2HA   GLY1221           HA2      GLY1221  -7.483   0.590  -2.991
  919    H    LYS1222           HN       LYS1222  -8.781  -1.748  -3.808
  920    HA   LYS1222           HA       LYS1222 -10.939  -0.559  -5.360
  921   1HB   LYS1222           HB2      LYS1222  -9.602  -1.685  -7.047
  922   2HB   LYS1222           HB1      LYS1222  -9.640  -3.171  -6.115
  923   1HG   LYS1222           HG2      LYS1222 -11.194  -3.145  -8.045
  924   2HG   LYS1222           HG1      LYS1222 -11.975  -3.445  -6.492
  925   1HD   LYS1222           HD2      LYS1222 -12.839  -1.238  -6.397
  926   2HD   LYS1222           HD1      LYS1222 -11.831  -0.713  -7.749
  927   1HE   LYS1222           HE2      LYS1222 -14.165  -1.051  -8.423
  928   2HE   LYS1222           HE1      LYS1222 -13.071  -2.149  -9.263
  929   1HZ   LYS1222           HZ3      LYS1222 -13.691  -3.895  -7.710
  930   2HZ   LYS1222           HZ2      LYS1222 -14.747  -2.842  -6.913
  931   3HZ   LYS1222           HZ1      LYS1222 -15.053  -3.294  -8.513
  932    H    LEU1223           HN       LEU1223 -12.888  -1.203  -4.783
  933    HA   LEU1223           HA       LEU1223 -13.207  -3.559  -3.071
  934   1HB   LEU1223           HB2      LEU1223 -14.108  -0.767  -2.462
  935   2HB   LEU1223           HB1      LEU1223 -14.840  -2.170  -1.710
  936    HG   LEU1223           HG       LEU1223 -12.323  -2.710  -1.089
  937   1HD1  LEU1223          3HD1      LEU1223 -12.369   0.293  -1.374
  938   2HD1  LEU1223          2HD1      LEU1223 -11.107  -0.643  -0.569
  939   3HD1  LEU1223          1HD1      LEU1223 -11.374  -0.828  -2.303
  940   1HD2  LEU1223          1HD2      LEU1223 -14.052  -0.675   0.307
  941   2HD2  LEU1223          3HD2      LEU1223 -14.161  -2.427   0.468
  942   3HD2  LEU1223          2HD2      LEU1223 -12.727  -1.577   1.043
  943    H    GLU1224           HN       GLU1224 -15.270  -4.466  -3.074
  944    HA   GLU1224           HA       GLU1224 -16.829  -3.875  -5.458
  945   1HB   GLU1224           HB2      GLU1224 -16.977  -6.133  -3.452
  946   2HB   GLU1224           HB1      GLU1224 -18.050  -5.977  -4.833
  947   1HG   GLU1224           HG2      GLU1224 -16.322  -7.544  -5.358
  948   2HG   GLU1224           HG1      GLU1224 -16.091  -6.090  -6.330
  949    H    TYR1225           HN       TYR1225 -17.731  -1.847  -4.679
  950    HA   TYR1225           HA       TYR1225 -19.342  -1.798  -2.328
  951   1HB   TYR1225           HB2      TYR1225 -20.278   0.339  -3.683
  952   2HB   TYR1225           HB1      TYR1225 -18.793   0.361  -2.740
  953    HD1  TYR1225           HD1      TYR1225 -19.941  -0.470  -6.191
  954    HD2  TYR1225           HD2      TYR1225 -16.925   1.228  -3.728
  955    HE1  TYR1225           HE1      TYR1225 -18.682   0.199  -8.202
  956    HE2  TYR1225           HE2      TYR1225 -15.659   1.910  -5.718
  957    HH   TYR1225           HH       TYR1225 -15.457   1.255  -8.086
  958    HA   PRO1226           HA       PRO1226 -22.874  -3.959  -3.998
  959   1HB   PRO1226           HB2      PRO1226 -24.565  -3.164  -1.954
  960   2HB   PRO1226           HB1      PRO1226 -23.491  -4.565  -1.890
  961   1HG   PRO1226           HG2      PRO1226 -23.076  -1.808  -0.804
  962   2HG   PRO1226           HG1      PRO1226 -22.684  -3.373  -0.068
  963   1HD   PRO1226           HD2      PRO1226 -20.796  -1.864  -1.191
  964   2HD   PRO1226           HD1      PRO1226 -20.773  -3.632  -1.364
  965    H    THR1227           HN       THR1227 -25.448  -2.744  -3.139
  966    HA   THR1227           HA       THR1227 -25.532  -0.161  -4.423
  967    HB   THR1227           HB       THR1227 -27.114  -2.407  -5.672
  968    HG1  THR1227           HG1      THR1227 -25.569  -1.895  -7.476
  969   1HG2  THR1227          2HG2      THR1227 -28.117  -0.177  -5.858
  970   2HG2  THR1227          1HG2      THR1227 -26.615   0.441  -6.546
  971   3HG2  THR1227          3HG2      THR1227 -27.560  -0.761  -7.427
  972    H    CYS1228           HN       CYS1228 -27.555  -2.913  -3.515
  973    HA   CYS1228           HA       CYS1228 -29.369  -3.109  -2.154
  974   1HB   CYS1228           HB2      CYS1228 -28.807  -0.386  -1.018
  975   2HB   CYS1228           HB1      CYS1228 -29.410  -1.826  -0.199
  976    H    ALA1229           HN       ALA1229 -31.567  -2.142  -1.717
  977    HA   ALA1229           HA       ALA1229 -32.297   0.027  -3.514
  978   1HB   ALA1229           HB1      ALA1229 -33.552  -2.698  -3.780
  979   2HB   ALA1229           HB2      ALA1229 -32.407  -1.981  -4.914
  980   3HB   ALA1229           HB3      ALA1229 -33.994  -1.248  -4.681
  981    H    LYS1230           HN       LYS1230 -34.040   1.129  -2.967
  982    HA   LYS1230           HA       LYS1230 -35.431   2.119  -1.478
  983   1HB   LYS1230           HB2      LYS1230 -37.529   0.896  -1.179
  984   2HB   LYS1230           HB1      LYS1230 -36.934   0.790  -2.829
  985   1HG   LYS1230           HG2      LYS1230 -36.020  -1.453  -2.292
  986   2HG   LYS1230           HG1      LYS1230 -36.795  -1.340  -0.711
  987   1HD   LYS1230           HD2      LYS1230 -38.977  -1.067  -1.828
  988   2HD   LYS1230           HD1      LYS1230 -38.181  -1.267  -3.391
  989   1HE   LYS1230           HE2      LYS1230 -37.457  -3.506  -2.742
  990   2HE   LYS1230           HE1      LYS1230 -38.231  -3.307  -1.170
  991   1HZ   LYS1230           HZ1      LYS1230 -40.365  -3.106  -2.290
  992   2HZ   LYS1230           HZ3      LYS1230 -39.619  -3.306  -3.796
  993   3HZ   LYS1230           HZ2      LYS1230 -39.620  -4.575  -2.677
  994    H    ARG1231           HN       ARG1231 -34.552   2.635   0.372
  995    HA   ARG1231           HA       ARG1231 -33.701   1.057   2.439
  996   1HB   ARG1231           HB2      ARG1231 -34.248   3.129   3.861
  997   2HB   ARG1231           HB1      ARG1231 -33.098   3.312   2.557
  998   1HG   ARG1231           HG2      ARG1231 -34.765   4.337   1.163
  999   2HG   ARG1231           HG1      ARG1231 -36.021   4.009   2.360
 1000   1HD   ARG1231           HD2      ARG1231 -33.632   5.803   2.762
 1001   2HD   ARG1231           HD1      ARG1231 -35.277   6.343   2.435
 1002    HE   ARG1231           HE       ARG1231 -35.187   4.665   4.723
 1003   1HH1  ARG1231          1HH1      ARG1231 -34.476   7.896   3.630
 1004   2HH1  ARG1231          2HH1      ARG1231 -34.685   8.610   5.194
 1005   1HH2  ARG1231          1HH2      ARG1231 -35.465   5.596   6.785
 1006   2HH2  ARG1231          2HH2      ARG1231 -35.247   7.302   6.987

  No H/Q in entry =        1006