NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
1548 | 1ap7 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
ASSI {10912} (segid " " and resid "2 " and name "HA ") (segid " " and resid "2 " and name "HB1 ") 5.000 5.000 0.000 peak 10912 weight 0.10000E+01 volume 0.11480E+01 ppm1 4.484 ppm2 3.889 OR {10912} (segid " " and resid "2 " and name "HA ") (segid " " and resid "2 " and name "HB2 ") ASSI {10914} (segid " " and resid "6 " and name "HA ") (segid " " and resid "6 " and name "HB1 ") 3.300 3.300 0.000 peak 10914 weight 0.10000E+01 volume 0.34030E+01 ppm1 4.298 ppm2 2.046 ASSI {10915} (segid " " and resid "6 " and name "HA ") (segid " " and resid "6 " and name "HB2 ") 2.700 2.700 0.000 peak 10915 weight 0.10000E+01 volume 0.44230E+01 ppm1 4.305 ppm2 1.957 ASSI {10916} (segid " " and resid "6 " and name "HA ") (segid " " and resid "6 " and name "HG2 ") 3.300 3.300 0.000 peak 10916 weight 0.10000E+01 volume 0.29960E+01 ppm1 4.296 ppm2 2.209 ASSI {10918} (segid " " and resid "8 " and name "HA ") (segid " " and resid "8 " and name "HB ") 5.000 5.000 0.000 peak 10918 weight 0.10000E+01 volume -0.13210E+01 ppm1 4.177 ppm2 2.110 ASSI {10919} (segid " " and resid "8 " and name "HA ") (segid " " and resid "8 " and name "HG13") 2.700 2.700 0.000 peak 10919 weight 0.10000E+01 volume -0.48960E+01 ppm1 4.182 ppm2 0.952 OR {10919} (segid " " and resid "8 " and name "HA ") (segid " " and resid "8 " and name "HG21") OR {10919} (segid " " and resid "8 " and name "HA ") (segid " " and resid "8 " and name "HG11") OR {10919} (segid " " and resid "8 " and name "HA ") (segid " " and resid "8 " and name "HG22") OR {10919} (segid " " and resid "8 " and name "HA ") (segid " " and resid "8 " and name "HG12") OR {10919} (segid " " and resid "8 " and name "HA ") (segid " " and resid "8 " and name "HG23") ASSI {10921} (segid " " and resid "8 " and name "HB ") (segid " " and resid "8 " and name "HG23") 2.700 2.700 0.000 peak 10921 weight 0.10000E+01 volume 0.55580E+01 ppm1 2.110 ppm2 0.960 OR {10921} (segid " " and resid "8 " and name "HB ") (segid " " and resid "8 " and name "HG11") OR {10921} (segid " " and resid "8 " and name "HB ") (segid " " and resid "8 " and name "HG13") OR {10921} (segid " " and resid "8 " and name "HB ") (segid " " and resid "8 " and name "HG22") OR {10921} (segid " " and resid "8 " and name "HB ") (segid " " and resid "8 " and name "HG21") OR {10921} (segid " " and resid "8 " and name "HB ") (segid " " and resid "8 " and name "HG12") ASSI {10922} (segid " " and resid "10 " and name "HA ") (segid " " and resid "10 " and name "HB ") 5.000 5.000 0.000 peak 10922 weight 0.10000E+01 volume -0.17370E+01 ppm1 3.898 ppm2 2.283 ASSI {10923} (segid " " and resid "10 " and name "HA ") (segid " " and resid "10 " and name "HG12") 3.300 3.300 0.000 peak 10923 weight 0.10000E+01 volume -0.35250E+01 ppm1 3.900 ppm2 1.124 OR {10923} (segid " " and resid "10 " and name "HA ") (segid " " and resid "10 " and name "HG22") OR {10923} (segid " " and resid "10 " and name "HA ") (segid " " and resid "10 " and name "HG13") OR {10923} (segid " " and resid "10 " and name "HA ") (segid " " and resid "10 " and name "HG11") OR {10923} (segid " " and resid "10 " and name "HA ") (segid " " and resid "10 " and name "HG21") OR {10923} (segid " " and resid "10 " and name "HA ") (segid " " and resid "10 " and name "HG23") ASSI {10924} (segid " " and resid "10 " and name "HG12") (segid " " and resid "10 " and name "HA ") 3.300 3.300 0.000 peak 10924 weight 0.10000E+01 volume -0.24870E+01 ppm1 1.137 ppm2 3.899 OR {10924} (segid " " and resid "10 " and name "HG13") (segid " " and resid "10 " and name "HA ") OR {10924} (segid " " and resid "10 " and name "HG11") (segid " " and resid "10 " and name "HA ") ASSI {10925} (segid " " and resid "10 " and name "HG13") (segid " " and resid "10 " and name "HB ") 3.300 3.300 0.000 peak 10925 weight 0.10000E+01 volume -0.38630E+01 ppm1 1.139 ppm2 2.287 OR {10925} (segid " " and resid "10 " and name "HG11") (segid " " and resid "10 " and name "HB ") OR {10925} (segid " " and resid "10 " and name "HG12") (segid " " and resid "10 " and name "HB ") ASSI {10264} (segid " " and resid "10 " and name "HG12") (segid " " and resid "11 " and name "HA1 ") 5.000 5.000 0.000 peak 10264 weight 0.10000E+01 volume -0.85900E+00 ppm1 1.137 ppm2 3.783 OR {10264} (segid " " and resid "10 " and name "HG11") (segid " " and resid "11 " and name "HA1 ") OR {10264} (segid " " and resid "10 " and name "HG13") (segid " " and resid "11 " and name "HA1 ") ASSI {10216} (segid " " and resid "11 " and name "HA2 ") (segid " " and resid "10 " and name "HG12") 6.000 6.000 0.000 peak 10216 weight 0.10000E+01 volume 0.20600E+00 ppm1 3.557 ppm2 1.128 OR {10216} (segid " " and resid "11 " and name "HA2 ") (segid " " and resid "10 " and name "HG11") OR {10216} (segid " " and resid "11 " and name "HA2 ") (segid " " and resid "10 " and name "HG13") ASSI {10218} (segid " " and resid "11 " and name "HA1 ") (segid " " and resid "39 " and name "HB2 ") 5.000 5.000 0.000 peak 10218 weight 0.10000E+01 volume 0.86700E+00 ppm1 3.792 ppm2 1.401 OR {10218} (segid " " and resid "11 " and name "HA1 ") (segid " " and resid "39 " and name "HB3 ") OR {10218} (segid " " and resid "11 " and name "HA1 ") (segid " " and resid "39 " and name "HB1 ") ASSI {10215} (segid " " and resid "11 " and name "HA2 ") (segid " " and resid "39 " and name "HB2 ") 5.000 5.000 0.000 peak 10215 weight 0.10000E+01 volume 0.64300E+00 ppm1 3.558 ppm2 1.398 OR {10215} (segid " " and resid "11 " and name "HA2 ") (segid " " and resid "39 " and name "HB3 ") OR {10215} (segid " " and resid "11 " and name "HA2 ") (segid " " and resid "39 " and name "HB1 ") ASSI {10926} (segid " " and resid "12 " and name "HB2 ") (segid " " and resid "12 " and name "HB1 ") 5.000 5.000 0.000 peak 10926 weight 0.10000E+01 volume 0.14410E+01 ppm1 2.603 ppm2 3.027 ASSI {10928} (segid " " and resid "14 " and name "HA ") (segid " " and resid "14 " and name "HB1 ") 5.000 5.000 0.000 peak 10928 weight 0.10000E+01 volume 0.18200E+01 ppm1 4.077 ppm2 2.091 ASSI {10929} (segid " " and resid "14 " and name "HA ") (segid " " and resid "14 " and name "HD22") 2.700 2.700 0.000 peak 10929 weight 0.10000E+01 volume 0.43670E+01 ppm1 4.076 ppm2 0.936 OR {10929} (segid " " and resid "14 " and name "HA ") (segid " " and resid "14 " and name "HD23") OR {10929} (segid " " and resid "14 " and name "HA ") (segid " " and resid "14 " and name "HD21") ASSI {10930} (segid " " and resid "14 " and name "HA ") (segid " " and resid "14 " and name "HG ") 5.000 5.000 0.000 peak 10930 weight 0.10000E+01 volume 0.15900E+01 ppm1 4.074 ppm2 1.532 ASSI {10933} (segid " " and resid "17 " and name "HA ") (segid " " and resid "17 " and name "HB3 ") 2.700 2.700 0.000 peak 10933 weight 0.10000E+01 volume 0.96880E+01 ppm1 4.136 ppm2 1.507 OR {10933} (segid " " and resid "17 " and name "HA ") (segid " " and resid "17 " and name "HB2 ") OR {10933} (segid " " and resid "17 " and name "HA ") (segid " " and resid "17 " and name "HB1 ") ASSI {10935} (segid " " and resid "18 " and name "HA ") (segid " " and resid "51 " and name "HA ") 5.000 5.000 0.000 peak 10935 weight 0.10000E+01 volume 0.79000E+00 ppm1 3.835 ppm2 3.424 ASSI {10936} (segid " " and resid "18 " and name "HB3 ") (segid " " and resid "18 " and name "HA ") 2.700 2.700 0.000 peak 10936 weight 0.10000E+01 volume -0.48520E+01 ppm1 1.326 ppm2 3.835 OR {10936} (segid " " and resid "18 " and name "HB1 ") (segid " " and resid "18 " and name "HA ") OR {10936} (segid " " and resid "18 " and name "HB2 ") (segid " " and resid "18 " and name "HA ") ASSI {10937} (segid " " and resid "18 " and name "HB1 ") (segid " " and resid "51 " and name "HA ") 5.000 5.000 0.000 peak 10937 weight 0.10000E+01 volume -0.13870E+01 ppm1 1.326 ppm2 3.434 OR {10937} (segid " " and resid "18 " and name "HB2 ") (segid " " and resid "51 " and name "HA ") OR {10937} (segid " " and resid "18 " and name "HB3 ") (segid " " and resid "51 " and name "HA ") ASSI {10938} (segid " " and resid "19 " and name "HA ") (segid " " and resid "51 " and name "HA ") 5.000 5.000 0.000 peak 10938 weight 0.10000E+01 volume 0.13950E+01 ppm1 4.291 ppm2 3.438 ASSI {10939} (segid " " and resid "19 " and name "HB1 ") (segid " " and resid "51 " and name "HA ") 5.000 5.000 0.000 peak 10939 weight 0.10000E+01 volume -0.87700E+00 ppm1 1.547 ppm2 3.450 OR {10939} (segid " " and resid "19 " and name "HB2 ") (segid " " and resid "51 " and name "HA ") OR {10939} (segid " " and resid "19 " and name "HB3 ") (segid " " and resid "51 " and name "HA ") ASSI {10940} (segid " " and resid "20 " and name "HA ") (segid " " and resid "20 " and name "HD1 ") 6.000 6.000 0.000 peak 10940 weight 0.10000E+01 volume 0.24700E+00 ppm1 4.524 ppm2 3.349 ASSI {10941} (segid " " and resid "20 " and name "HA ") (segid " " and resid "20 " and name "HD2 ") 5.000 5.000 0.000 peak 10941 weight 0.10000E+01 volume 0.53300E+00 ppm1 4.516 ppm2 3.237 ASSI {10943} (segid " " and resid "21 " and name "HA1 ") (segid " " and resid "21 " and name "HA2 ") 3.300 3.300 0.000 peak 10943 weight 0.10000E+01 volume 0.21450E+01 ppm1 4.286 ppm2 3.566 ASSI {10944} (segid " " and resid "22 " and name "HA ") (segid " " and resid "22 " and name "HB1 ") 5.000 5.000 0.000 peak 10944 weight 0.10000E+01 volume 0.11810E+01 ppm1 4.725 ppm2 3.062 ASSI {10945} (segid " " and resid "22 " and name "HA ") (segid " " and resid "22 " and name "HB2 ") 5.000 5.000 0.000 peak 10945 weight 0.10000E+01 volume 0.14580E+01 ppm1 4.718 ppm2 2.448 ASSI {10954} (segid " " and resid "22 " and name "HB2 ") (segid " " and resid "22 " and name "HB1 ") 5.000 5.000 0.000 peak 10954 weight 0.10000E+01 volume 0.13550E+01 ppm1 2.436 ppm2 3.077 ASSI {10958} (segid " " and resid "23 " and name "HA ") (segid " " and resid "23 " and name "HB ") 5.000 5.000 0.000 peak 10958 weight 0.10000E+01 volume -0.11300E+01 ppm1 3.381 ppm2 1.968 ASSI {10962} (segid " " and resid "23 " and name "HG13") (segid " " and resid "23 " and name "HB ") 2.700 2.700 0.000 peak 10962 weight 0.10000E+01 volume -0.80080E+01 ppm1 0.933 ppm2 1.967 OR {10962} (segid " " and resid "23 " and name "HG11") (segid " " and resid "23 " and name "HB ") OR {10962} (segid " " and resid "23 " and name "HG12") (segid " " and resid "23 " and name "HB ") ASSI {10963} (segid " " and resid "23 " and name "HG23") (segid " " and resid "23 " and name "HA ") 5.000 5.000 0.000 peak 10963 weight 0.10000E+01 volume -0.13930E+01 ppm1 0.913 ppm2 3.386 OR {10963} (segid " " and resid "23 " and name "HG21") (segid " " and resid "23 " and name "HA ") OR {10963} (segid " " and resid "23 " and name "HG22") (segid " " and resid "23 " and name "HA ") ASSI {10964} (segid " " and resid "23 " and name "HG23") (segid " " and resid "23 " and name "HB ") 3.300 3.300 0.000 peak 10964 weight 0.10000E+01 volume -0.37270E+01 ppm1 0.918 ppm2 1.967 OR {10964} (segid " " and resid "23 " and name "HG22") (segid " " and resid "23 " and name "HB ") OR {10964} (segid " " and resid "23 " and name "HG21") (segid " " and resid "23 " and name "HB ") ASSI {10970} (segid " " and resid "25 " and name "HA ") (segid " " and resid "25 " and name "HB1 ") 3.300 3.300 0.000 peak 10970 weight 0.10000E+01 volume 0.23760E+01 ppm1 4.633 ppm2 1.963 ASSI {10971} (segid " " and resid "25 " and name "HA ") (segid " " and resid "25 " and name "HB2 ") 5.000 5.000 0.000 peak 10971 weight 0.10000E+01 volume 0.12990E+01 ppm1 4.631 ppm2 1.609 ASSI {10972} (segid " " and resid "25 " and name "HA ") (segid " " and resid "25 " and name "HG1 ") 5.000 5.000 0.000 peak 10972 weight 0.10000E+01 volume 0.56300E+00 ppm1 4.635 ppm2 2.345 ASSI {10973} (segid " " and resid "25 " and name "HA ") (segid " " and resid "25 " and name "HG2 ") 5.000 5.000 0.000 peak 10973 weight 0.10000E+01 volume 0.98100E+00 ppm1 4.634 ppm2 2.145 ASSI {10979} (segid " " and resid "26 " and name "HA ") (segid " " and resid "26 " and name "HB ") 5.000 5.000 0.000 peak 10979 weight 0.10000E+01 volume -0.79300E+00 ppm1 3.385 ppm2 2.167 ASSI {10981} (segid " " and resid "26 " and name "HG12") (segid " " and resid "26 " and name "HB ") 2.700 2.700 0.000 peak 10981 weight 0.10000E+01 volume -0.57680E+01 ppm1 0.926 ppm2 2.180 OR {10981} (segid " " and resid "26 " and name "HG11") (segid " " and resid "26 " and name "HB ") OR {10981} (segid " " and resid "26 " and name "HG13") (segid " " and resid "26 " and name "HB ") ASSI {10982} (segid " " and resid "26 " and name "HG23") (segid " " and resid "26 " and name "HA ") 3.300 3.300 0.000 peak 10982 weight 0.10000E+01 volume -0.25230E+01 ppm1 0.819 ppm2 3.381 OR {10982} (segid " " and resid "26 " and name "HG22") (segid " " and resid "26 " and name "HA ") OR {10982} (segid " " and resid "26 " and name "HG21") (segid " " and resid "26 " and name "HA ") ASSI {10983} (segid " " and resid "26 " and name "HG22") (segid " " and resid "26 " and name "HB ") 3.300 3.300 0.000 peak 10983 weight 0.10000E+01 volume -0.30140E+01 ppm1 0.819 ppm2 2.180 OR {10983} (segid " " and resid "26 " and name "HG21") (segid " " and resid "26 " and name "HB ") OR {10983} (segid " " and resid "26 " and name "HG23") (segid " " and resid "26 " and name "HB ") ASSI {10984} (segid " " and resid "27 " and name "HA ") (segid " " and resid "27 " and name "HD2 ") 5.000 5.000 0.000 peak 10984 weight 0.10000E+01 volume -0.38700E+00 ppm1 3.675 ppm2 3.107 OR {10984} (segid " " and resid "27 " and name "HA ") (segid " " and resid "27 " and name "HD1 ") ASSI {10986} (segid " " and resid "27 " and name "HB1 ") (segid " " and resid "27 " and name "HA ") 5.000 5.000 0.000 peak 10986 weight 0.10000E+01 volume -0.12790E+01 ppm1 1.892 ppm2 3.661 OR {10986} (segid " " and resid "27 " and name "HB2 ") (segid " " and resid "27 " and name "HA ") ASSI {10987} (segid " " and resid "27 " and name "HB1 ") (segid " " and resid "27 " and name "HD2 ") 3.300 3.300 0.000 peak 10987 weight 0.10000E+01 volume -0.24110E+01 ppm1 1.886 ppm2 3.114 OR {10987} (segid " " and resid "27 " and name "HB1 ") (segid " " and resid "27 " and name "HD1 ") OR {10987} (segid " " and resid "27 " and name "HB2 ") (segid " " and resid "27 " and name "HD1 ") OR {10987} (segid " " and resid "27 " and name "HB2 ") (segid " " and resid "27 " and name "HD2 ") ASSI {10993} (segid " " and resid "27 " and name "HG1 ") (segid " " and resid "27 " and name "HA ") 5.000 5.000 0.000 peak 10993 weight 0.10000E+01 volume -0.89700E+00 ppm1 1.691 ppm2 3.678 ASSI {10994} (segid " " and resid "27 " and name "HG2 ") (segid " " and resid "27 " and name "HA ") 5.000 5.000 0.000 peak 10994 weight 0.10000E+01 volume -0.55100E+00 ppm1 1.486 ppm2 3.675 ASSI {10995} (segid " " and resid "27 " and name "HG2 ") (segid " " and resid "27 " and name "HB1 ") 3.300 3.300 0.000 peak 10995 weight 0.10000E+01 volume -0.21710E+01 ppm1 1.486 ppm2 1.886 OR {10995} (segid " " and resid "27 " and name "HG2 ") (segid " " and resid "27 " and name "HB2 ") ASSI {10996} (segid " " and resid "27 " and name "HG1 ") (segid " " and resid "27 " and name "HD2 ") 3.300 3.300 0.000 peak 10996 weight 0.10000E+01 volume -0.24660E+01 ppm1 1.700 ppm2 3.114 OR {10996} (segid " " and resid "27 " and name "HG1 ") (segid " " and resid "27 " and name "HD1 ") ASSI {10997} (segid " " and resid "27 " and name "HG2 ") (segid " " and resid "27 " and name "HD1 ") 5.000 5.000 0.000 peak 10997 weight 0.10000E+01 volume -0.12330E+01 ppm1 1.486 ppm2 3.087 OR {10997} (segid " " and resid "27 " and name "HG2 ") (segid " " and resid "27 " and name "HD2 ") ASSI {10998} (segid " " and resid "27 " and name "HG2 ") (segid " " and resid "27 " and name "HG1 ") 3.300 3.300 0.000 peak 10998 weight 0.10000E+01 volume -0.26940E+01 ppm1 1.496 ppm2 1.711 ASSI {11001} (segid " " and resid "28 " and name "HA ") (segid " " and resid "28 " and name "HD2 ") 5.000 5.000 0.000 peak 11001 weight 0.10000E+01 volume -0.31200E+00 ppm1 3.995 ppm2 3.034 ASSI {11002} (segid " " and resid "28 " and name "HB1 ") (segid " " and resid "28 " and name "HA ") 3.300 3.300 0.000 peak 11002 weight 0.10000E+01 volume -0.22560E+01 ppm1 1.964 ppm2 3.992 OR {11002} (segid " " and resid "28 " and name "HB2 ") (segid " " and resid "28 " and name "HA ") ASSI {11003} (segid " " and resid "28 " and name "HD1 ") (segid " " and resid "28 " and name "HA ") 6.000 6.000 0.000 peak 11003 weight 0.10000E+01 volume 0.14300E+00 ppm1 3.426 ppm2 3.994 ASSI {11005} (segid " " and resid "28 " and name "HD1 ") (segid " " and resid "28 " and name "HB2 ") 5.000 5.000 0.000 peak 11005 weight 0.10000E+01 volume 0.77300E+00 ppm1 3.417 ppm2 1.964 OR {11005} (segid " " and resid "28 " and name "HD1 ") (segid " " and resid "28 " and name "HB1 ") ASSI {11006} (segid " " and resid "28 " and name "HD2 ") (segid " " and resid "28 " and name "HB1 ") 5.000 5.000 0.000 peak 11006 weight 0.10000E+01 volume 0.10090E+01 ppm1 3.023 ppm2 1.969 OR {11006} (segid " " and resid "28 " and name "HD2 ") (segid " " and resid "28 " and name "HB2 ") ASSI {11007} (segid " " and resid "28 " and name "HD2 ") (segid " " and resid "28 " and name "HD1 ") 3.300 3.300 0.000 peak 11007 weight 0.10000E+01 volume 0.20250E+01 ppm1 3.024 ppm2 3.414 ASSI {11009} (segid " " and resid "28 " and name "HD1 ") (segid " " and resid "28 " and name "HG1 ") 5.000 5.000 0.000 peak 11009 weight 0.10000E+01 volume 0.87100E+00 ppm1 3.424 ppm2 1.673 ASSI {11010} (segid " " and resid "28 " and name "HD2 ") (segid " " and resid "28 " and name "HG1 ") 5.000 5.000 0.000 peak 11010 weight 0.10000E+01 volume 0.10860E+01 ppm1 3.022 ppm2 1.673 ASSI {11011} (segid " " and resid "28 " and name "HD1 ") (segid " " and resid "28 " and name "HG2 ") 5.000 5.000 0.000 peak 11011 weight 0.10000E+01 volume 0.69700E+00 ppm1 3.424 ppm2 1.535 ASSI {11014} (segid " " and resid "28 " and name "HG2 ") (segid " " and resid "28 " and name "HD2 ") 5.000 5.000 0.000 peak 11014 weight 0.10000E+01 volume -0.47700E+00 ppm1 1.530 ppm2 3.011 ASSI {11015} (segid " " and resid "29 " and name "HB1 ") (segid " " and resid "29 " and name "HA ") 5.000 5.000 0.000 peak 11015 weight 0.10000E+01 volume 0.60200E+00 ppm1 1.992 ppm2 3.895 ASSI {11016} (segid " " and resid "30 " and name "HA ") (segid " " and resid "30 " and name "HB1 ") 5.000 5.000 0.000 peak 11016 weight 0.10000E+01 volume 0.12730E+01 ppm1 4.230 ppm2 1.594 ASSI {11017} (segid " " and resid "30 " and name "HA ") (segid " " and resid "30 " and name "HB2 ") 3.300 3.300 0.000 peak 11017 weight 0.10000E+01 volume 0.23870E+01 ppm1 4.228 ppm2 0.990 ASSI {11018} (segid " " and resid "30 " and name "HA ") (segid " " and resid "30 " and name "HD12") 5.000 5.000 0.000 peak 11018 weight 0.10000E+01 volume 0.16630E+01 ppm1 4.229 ppm2 0.670 OR {11018} (segid " " and resid "30 " and name "HA ") (segid " " and resid "30 " and name "HD13") OR {11018} (segid " " and resid "30 " and name "HA ") (segid " " and resid "30 " and name "HD11") ASSI {11019} (segid " " and resid "30 " and name "HA ") (segid " " and resid "30 " and name "HD21") 3.300 3.300 0.000 peak 11019 weight 0.10000E+01 volume 0.29250E+01 ppm1 4.228 ppm2 0.765 OR {11019} (segid " " and resid "30 " and name "HA ") (segid " " and resid "30 " and name "HD23") OR {11019} (segid " " and resid "30 " and name "HA ") (segid " " and resid "30 " and name "HD22") ASSI {11020} (segid " " and resid "30 " and name "HA ") (segid " " and resid "30 " and name "HG ") 5.000 5.000 0.000 peak 11020 weight 0.10000E+01 volume 0.13660E+01 ppm1 4.224 ppm2 1.969 ASSI {11023} (segid " " and resid "30 " and name "HB2 ") (segid " " and resid "30 " and name "HB1 ") 5.000 5.000 0.000 peak 11023 weight 0.10000E+01 volume 0.86600E+00 ppm1 1.002 ppm2 1.577 ASSI {11024} (segid " " and resid "30 " and name "HB1 ") (segid " " and resid "30 " and name "HD13") 5.000 5.000 0.000 peak 11024 weight 0.10000E+01 volume 0.10790E+01 ppm1 1.582 ppm2 0.669 OR {11024} (segid " " and resid "30 " and name "HB1 ") (segid " " and resid "30 " and name "HD11") OR {11024} (segid " " and resid "30 " and name "HB1 ") (segid " " and resid "30 " and name "HD12") ASSI {11025} (segid " " and resid "30 " and name "HB2 ") (segid " " and resid "30 " and name "HD13") 5.000 5.000 0.000 peak 11025 weight 0.10000E+01 volume 0.54400E+00 ppm1 1.012 ppm2 0.659 OR {11025} (segid " " and resid "30 " and name "HB2 ") (segid " " and resid "30 " and name "HD12") OR {11025} (segid " " and resid "30 " and name "HB2 ") (segid " " and resid "30 " and name "HD11") ASSI {11027} (segid " " and resid "30 " and name "HD13") (segid " " and resid "30 " and name "HG ") 3.300 3.300 0.000 peak 11027 weight 0.10000E+01 volume -0.29720E+01 ppm1 0.659 ppm2 1.967 OR {11027} (segid " " and resid "30 " and name "HD12") (segid " " and resid "30 " and name "HG ") OR {11027} (segid " " and resid "30 " and name "HD11") (segid " " and resid "30 " and name "HG ") ASSI {11029} (segid " " and resid "30 " and name "HD21") (segid " " and resid "30 " and name "HG ") 2.700 2.700 0.000 peak 11029 weight 0.10000E+01 volume -0.78250E+01 ppm1 0.766 ppm2 1.967 OR {11029} (segid " " and resid "30 " and name "HD22") (segid " " and resid "30 " and name "HG ") OR {11029} (segid " " and resid "30 " and name "HD23") (segid " " and resid "30 " and name "HG ") ASSI {11031} (segid " " and resid "31 " and name "HA ") (segid " " and resid "31 " and name "HB1 ") 3.300 3.300 0.000 peak 11031 weight 0.10000E+01 volume 0.23590E+01 ppm1 4.648 ppm2 3.129 ASSI {11032} (segid " " and resid "31 " and name "HA ") (segid " " and resid "31 " and name "HB2 ") 3.300 3.300 0.000 peak 11032 weight 0.10000E+01 volume 0.21740E+01 ppm1 4.645 ppm2 3.045 ASSI {11033} (segid " " and resid "31 " and name "HA ") (segid " " and resid "31 " and name "HD2 ") 6.000 6.000 0.000 peak 11033 weight 0.10000E+01 volume 0.29400E+00 ppm1 4.652 ppm2 6.954 ASSI {11036} (segid " " and resid "31 " and name "HB1 ") (segid " " and resid "31 " and name "HD2 ") 6.000 6.000 0.000 peak 11036 weight 0.10000E+01 volume -0.17200E+00 ppm1 3.143 ppm2 6.946 ASSI {11037} (segid " " and resid "31 " and name "HB2 ") (segid " " and resid "31 " and name "HD2 ") 6.000 6.000 0.000 peak 11037 weight 0.10000E+01 volume -0.17100E+00 ppm1 3.085 ppm2 6.949 ASSI {11040} (segid " " and resid "32 " and name "HA ") (segid " " and resid "32 " and name "HB1 ") 5.000 5.000 0.000 peak 11040 weight 0.10000E+01 volume 0.13840E+01 ppm1 4.670 ppm2 2.206 ASSI {11041} (segid " " and resid "32 " and name "HA ") (segid " " and resid "32 " and name "HB2 ") 5.000 5.000 0.000 peak 11041 weight 0.10000E+01 volume 0.13670E+01 ppm1 4.669 ppm2 2.083 ASSI {11042} (segid " " and resid "32 " and name "HA ") (segid " " and resid "32 " and name "HD1 ") 5.000 5.000 0.000 peak 11042 weight 0.10000E+01 volume 0.84400E+00 ppm1 4.667 ppm2 3.250 OR {11042} (segid " " and resid "32 " and name "HA ") (segid " " and resid "32 " and name "HD2 ") ASSI {11043} (segid " " and resid "32 " and name "HA ") (segid " " and resid "32 " and name "HG1 ") 5.000 5.000 0.000 peak 11043 weight 0.10000E+01 volume 0.50000E+00 ppm1 4.666 ppm2 1.830 ASSI {11044} (segid " " and resid "32 " and name "HA ") (segid " " and resid "32 " and name "HG2 ") 5.000 5.000 0.000 peak 11044 weight 0.10000E+01 volume 0.87200E+00 ppm1 4.672 ppm2 1.710 ASSI {11047} (segid " " and resid "32 " and name "HB1 ") (segid " " and resid "32 " and name "HD1 ") 5.000 5.000 0.000 peak 11047 weight 0.10000E+01 volume -0.62900E+00 ppm1 2.207 ppm2 3.248 OR {11047} (segid " " and resid "32 " and name "HB1 ") (segid " " and resid "32 " and name "HD2 ") ASSI {11048} (segid " " and resid "32 " and name "HB2 ") (segid " " and resid "32 " and name "HD1 ") 3.300 3.300 0.000 peak 11048 weight 0.10000E+01 volume -0.27970E+01 ppm1 2.073 ppm2 3.248 OR {11048} (segid " " and resid "32 " and name "HB2 ") (segid " " and resid "32 " and name "HD2 ") ASSI {11052} (segid " " and resid "32 " and name "HD2 ") (segid " " and resid "32 " and name "HG1 ") 2.700 2.700 0.000 peak 11052 weight 0.10000E+01 volume 0.65240E+01 ppm1 3.265 ppm2 1.822 OR {11052} (segid " " and resid "32 " and name "HD1 ") (segid " " and resid "32 " and name "HG1 ") ASSI {11053} (segid " " and resid "32 " and name "HD1 ") (segid " " and resid "32 " and name "HG2 ") 2.700 2.700 0.000 peak 11053 weight 0.10000E+01 volume 0.53450E+01 ppm1 3.257 ppm2 1.723 OR {11053} (segid " " and resid "32 " and name "HD2 ") (segid " " and resid "32 " and name "HG2 ") ASSI {11056} (segid " " and resid "32 " and name "HG1 ") (segid " " and resid "32 " and name "HB2 ") 2.700 2.700 0.000 peak 11056 weight 0.10000E+01 volume -0.47340E+01 ppm1 1.833 ppm2 2.073 ASSI {11058} (segid " " and resid "33 " and name "HA ") (segid " " and resid "33 " and name "HB1 ") 5.000 5.000 0.000 peak 11058 weight 0.10000E+01 volume 0.17890E+01 ppm1 4.465 ppm2 2.415 ASSI {11059} (segid " " and resid "33 " and name "HA ") (segid " " and resid "33 " and name "HG2 ") 5.000 5.000 0.000 peak 11059 weight 0.10000E+01 volume 0.18850E+01 ppm1 4.464 ppm2 2.205 ASSI {11061} (segid " " and resid "33 " and name "HG1 ") (segid " " and resid "33 " and name "HA ") 5.000 5.000 0.000 peak 11061 weight 0.10000E+01 volume 0.79100E+00 ppm1 2.291 ppm2 4.456 ASSI {11063} (segid " " and resid "34 " and name "HA ") (segid " " and resid "34 " and name "HB1 ") 5.000 5.000 0.000 peak 11063 weight 0.10000E+01 volume 0.16070E+01 ppm1 4.023 ppm2 1.983 ASSI {11064} (segid " " and resid "34 " and name "HA ") (segid " " and resid "34 " and name "HB2 ") 3.300 3.300 0.000 peak 11064 weight 0.10000E+01 volume 0.22650E+01 ppm1 4.025 ppm2 1.621 ASSI {11068} (segid " " and resid "34 " and name "HB2 ") (segid " " and resid "34 " and name "HB1 ") 5.000 5.000 0.000 peak 11068 weight 0.10000E+01 volume 0.19300E+01 ppm1 1.625 ppm2 1.977 ASSI {11071} (segid " " and resid "34 " and name "HB2 ") (segid " " and resid "34 " and name "HD13") 5.000 5.000 0.000 peak 11071 weight 0.10000E+01 volume 0.14850E+01 ppm1 1.630 ppm2 0.924 OR {11071} (segid " " and resid "34 " and name "HB2 ") (segid " " and resid "34 " and name "HD12") OR {11071} (segid " " and resid "34 " and name "HB2 ") (segid " " and resid "34 " and name "HD11") ASSI {11072} (segid " " and resid "34 " and name "HB2 ") (segid " " and resid "34 " and name "HD23") 5.000 5.000 0.000 peak 11072 weight 0.10000E+01 volume 0.12010E+01 ppm1 1.628 ppm2 0.852 OR {11072} (segid " " and resid "34 " and name "HB2 ") (segid " " and resid "34 " and name "HD22") OR {11072} (segid " " and resid "34 " and name "HB2 ") (segid " " and resid "34 " and name "HD21") ASSI {11073} (segid " " and resid "34 " and name "HB1 ") (segid " " and resid "34 " and name "HG ") 5.000 5.000 0.000 peak 11073 weight 0.10000E+01 volume 0.94300E+00 ppm1 1.989 ppm2 1.399 ASSI {11074} (segid " " and resid "34 " and name "HB2 ") (segid " " and resid "34 " and name "HG ") 5.000 5.000 0.000 peak 11074 weight 0.10000E+01 volume 0.91600E+00 ppm1 1.625 ppm2 1.386 ASSI {11075} (segid " " and resid "34 " and name "HD12") (segid " " and resid "34 " and name "HB1 ") 2.700 2.700 0.000 peak 11075 weight 0.10000E+01 volume -0.43220E+01 ppm1 0.923 ppm2 1.988 OR {11075} (segid " " and resid "34 " and name "HD11") (segid " " and resid "34 " and name "HB1 ") OR {11075} (segid " " and resid "34 " and name "HD13") (segid " " and resid "34 " and name "HB1 ") ASSI {11076} (segid " " and resid "34 " and name "HD12") (segid " " and resid "34 " and name "HG ") 2.700 2.700 0.000 peak 11076 weight 0.10000E+01 volume -0.67360E+01 ppm1 0.926 ppm2 1.392 OR {11076} (segid " " and resid "34 " and name "HD13") (segid " " and resid "34 " and name "HG ") OR {11076} (segid " " and resid "34 " and name "HD11") (segid " " and resid "34 " and name "HG ") ASSI {11077} (segid " " and resid "34 " and name "HD22") (segid " " and resid "34 " and name "HA ") 2.700 2.700 0.000 peak 11077 weight 0.10000E+01 volume -0.49440E+01 ppm1 0.846 ppm2 4.021 OR {11077} (segid " " and resid "34 " and name "HD21") (segid " " and resid "34 " and name "HA ") OR {11077} (segid " " and resid "34 " and name "HD23") (segid " " and resid "34 " and name "HA ") ASSI {11078} (segid " " and resid "34 " and name "HD21") (segid " " and resid "34 " and name "HG ") 2.700 2.700 0.000 peak 11078 weight 0.10000E+01 volume -0.59080E+01 ppm1 0.846 ppm2 1.379 OR {11078} (segid " " and resid "34 " and name "HD22") (segid " " and resid "34 " and name "HG ") OR {11078} (segid " " and resid "34 " and name "HD23") (segid " " and resid "34 " and name "HG ") ASSI {11079} (segid " " and resid "34 " and name "HG ") (segid " " and resid "34 " and name "HA ") 5.000 5.000 0.000 peak 11079 weight 0.10000E+01 volume -0.64100E+00 ppm1 1.379 ppm2 4.021 ASSI {11083} (segid " " and resid "35 " and name "HA ") (segid " " and resid "35 " and name "HB ") 5.000 5.000 0.000 peak 11083 weight 0.10000E+01 volume -0.74900E+00 ppm1 3.794 ppm2 1.597 ASSI {11085} (segid " " and resid "35 " and name "HB ") (segid " " and resid "35 " and name "HG11") 3.300 3.300 0.000 peak 11085 weight 0.10000E+01 volume -0.38110E+01 ppm1 1.593 ppm2 0.952 OR {11085} (segid " " and resid "35 " and name "HB ") (segid " " and resid "35 " and name "HG22") OR {11085} (segid " " and resid "35 " and name "HB ") (segid " " and resid "35 " and name "HG12") OR {11085} (segid " " and resid "35 " and name "HB ") (segid " " and resid "35 " and name "HG21") OR {11085} (segid " " and resid "35 " and name "HB ") (segid " " and resid "35 " and name "HG13") OR {11085} (segid " " and resid "35 " and name "HB ") (segid " " and resid "35 " and name "HG23") ASSI {11086} (segid " " and resid "35 " and name "HG22") (segid " " and resid "35 " and name "HB ") 2.700 2.700 0.000 peak 11086 weight 0.10000E+01 volume -0.43200E+01 ppm1 0.926 ppm2 1.593 OR {11086} (segid " " and resid "35 " and name "HG21") (segid " " and resid "35 " and name "HB ") OR {11086} (segid " " and resid "35 " and name "HG23") (segid " " and resid "35 " and name "HB ") ASSI {11087} (segid " " and resid "36 " and name "HA ") (segid " " and resid "36 " and name "HB1 ") 5.000 5.000 0.000 peak 11087 weight 0.10000E+01 volume 0.11280E+01 ppm1 4.379 ppm2 3.203 ASSI {11088} (segid " " and resid "36 " and name "HA ") (segid " " and resid "36 " and name "HB2 ") 5.000 5.000 0.000 peak 11088 weight 0.10000E+01 volume 0.15040E+01 ppm1 4.381 ppm2 2.881 ASSI {11089} (segid " " and resid "36 " and name "HA ") (segid " " and resid "37 " and name "HD1 ") 5.000 5.000 0.000 peak 11089 weight 0.10000E+01 volume 0.15980E+01 ppm1 4.380 ppm2 3.283 ASSI {11090} (segid " " and resid "36 " and name "HA ") (segid " " and resid "37 " and name "HD2 ") 5.000 5.000 0.000 peak 11090 weight 0.10000E+01 volume 0.16240E+01 ppm1 4.379 ppm2 2.546 ASSI {11091} (segid " " and resid "36 " and name "HA ") (segid " " and resid "37 " and name "HG1 ") 5.000 5.000 0.000 peak 11091 weight 0.10000E+01 volume 0.91500E+00 ppm1 4.378 ppm2 1.682 ASSI {11092} (segid " " and resid "36 " and name "HA ") (segid " " and resid "37 " and name "HG2 ") 5.000 5.000 0.000 peak 11092 weight 0.10000E+01 volume 0.52200E+00 ppm1 4.377 ppm2 1.381 ASSI {11095} (segid " " and resid "36 " and name "HB2 ") (segid " " and resid "36 " and name "HB1 ") 5.000 5.000 0.000 peak 11095 weight 0.10000E+01 volume -0.15110E+01 ppm1 2.883 ppm2 3.194 ASSI {11097} (segid " " and resid "36 " and name "HD2 ") (segid " " and resid "36 " and name "HA ") 6.000 6.000 0.000 peak 11097 weight 0.10000E+01 volume -0.10000E+00 ppm1 7.184 ppm2 4.384 ASSI {11098} (segid " " and resid "36 " and name "HD2 ") (segid " " and resid "36 " and name "HB1 ") 5.000 5.000 0.000 peak 11098 weight 0.10000E+01 volume -0.36500E+00 ppm1 7.197 ppm2 3.194 ASSI {11099} (segid " " and resid "36 " and name "HD2 ") (segid " " and resid "36 " and name "HB2 ") 6.000 6.000 0.000 peak 11099 weight 0.10000E+01 volume -0.21900E+00 ppm1 7.189 ppm2 2.889 ASSI {11100} (segid " " and resid "36 " and name "HE1 ") (segid " " and resid "38 " and name "HB1 ") 6.000 6.000 0.000 peak 11100 weight 0.10000E+01 volume -0.14100E+00 ppm1 7.789 ppm2 3.216 ASSI {11101} (segid " " and resid "36 " and name "HE1 ") (segid " " and resid "38 " and name "HB2 ") 6.000 6.000 0.000 peak 11101 weight 0.10000E+01 volume -0.24700E+00 ppm1 7.793 ppm2 2.589 ASSI {11102} (segid " " and resid "37 " and name "HA ") (segid " " and resid "37 " and name "HB1 ") 5.000 5.000 0.000 peak 11102 weight 0.10000E+01 volume -0.12090E+01 ppm1 4.102 ppm2 1.967 ASSI {11103} (segid " " and resid "37 " and name "HA ") (segid " " and resid "37 " and name "HB2 ") 5.000 5.000 0.000 peak 11103 weight 0.10000E+01 volume -0.11210E+01 ppm1 4.102 ppm2 1.691 ASSI {11104} (segid " " and resid "37 " and name "HA ") (segid " " and resid "37 " and name "HG2 ") 5.000 5.000 0.000 peak 11104 weight 0.10000E+01 volume -0.44400E+00 ppm1 4.096 ppm2 1.386 ASSI {11107} (segid " " and resid "37 " and name "HD2 ") (segid " " and resid "37 " and name "HB1 ") 6.000 6.000 0.000 peak 11107 weight 0.10000E+01 volume 0.14400E+00 ppm1 2.556 ppm2 1.948 ASSI {11108} (segid " " and resid "37 " and name "HD2 ") (segid " " and resid "37 " and name "HD1 ") 5.000 5.000 0.000 peak 11108 weight 0.10000E+01 volume 0.91000E+00 ppm1 2.543 ppm2 3.277 ASSI {11110} (segid " " and resid "37 " and name "HD1 ") (segid " " and resid "37 " and name "HG1 ") 5.000 5.000 0.000 peak 11110 weight 0.10000E+01 volume 0.57200E+00 ppm1 3.285 ppm2 1.689 ASSI {11111} (segid " " and resid "37 " and name "HD2 ") (segid " " and resid "37 " and name "HG1 ") 5.000 5.000 0.000 peak 11111 weight 0.10000E+01 volume 0.46100E+00 ppm1 2.545 ppm2 1.699 ASSI {11113} (segid " " and resid "37 " and name "HD2 ") (segid " " and resid "37 " and name "HG2 ") 5.000 5.000 0.000 peak 11113 weight 0.10000E+01 volume 0.31500E+00 ppm1 2.537 ppm2 1.388 ASSI {11114} (segid " " and resid "37 " and name "HG2 ") (segid " " and resid "37 " and name "HD1 ") 5.000 5.000 0.000 peak 11114 weight 0.10000E+01 volume -0.57700E+00 ppm1 1.387 ppm2 3.280 ASSI {11117} (segid " " and resid "38 " and name "HA ") (segid " " and resid "38 " and name "HB1 ") 5.000 5.000 0.000 peak 11117 weight 0.10000E+01 volume 0.57900E+00 ppm1 5.151 ppm2 3.224 ASSI {11118} (segid " " and resid "38 " and name "HA ") (segid " " and resid "38 " and name "HB2 ") 5.000 5.000 0.000 peak 11118 weight 0.10000E+01 volume 0.42700E+00 ppm1 5.152 ppm2 2.589 ASSI {11120} (segid " " and resid "38 " and name "HA ") (segid " " and resid "46 " and name "HB ") 5.000 5.000 0.000 peak 11120 weight 0.10000E+01 volume 0.88300E+00 ppm1 5.158 ppm2 4.942 ASSI {11121} (segid " " and resid "38 " and name "HA ") (segid " " and resid "46 " and name "HG23") 5.000 5.000 0.000 peak 11121 weight 0.10000E+01 volume 0.13200E+01 ppm1 5.165 ppm2 1.197 OR {11121} (segid " " and resid "38 " and name "HA ") (segid " " and resid "46 " and name "HG21") OR {11121} (segid " " and resid "38 " and name "HA ") (segid " " and resid "46 " and name "HG22") ASSI {11126} (segid " " and resid "38 " and name "HB2 ") (segid " " and resid "38 " and name "HB1 ") 5.000 5.000 0.000 peak 11126 weight 0.10000E+01 volume 0.14440E+01 ppm1 2.600 ppm2 3.215 ASSI {11128} (segid " " and resid "38 " and name "HB1 ") (segid " " and resid "46 " and name "HG22") 5.000 5.000 0.000 peak 11128 weight 0.10000E+01 volume 0.30900E+00 ppm1 3.223 ppm2 1.197 OR {11128} (segid " " and resid "38 " and name "HB1 ") (segid " " and resid "46 " and name "HG21") OR {11128} (segid " " and resid "38 " and name "HB1 ") (segid " " and resid "46 " and name "HG23") ASSI {11130} (segid " " and resid "39 " and name "HA ") (segid " " and resid "39 " and name "HB1 ") 2.700 2.700 0.000 peak 11130 weight 0.10000E+01 volume 0.43160E+01 ppm1 4.046 ppm2 1.400 OR {11130} (segid " " and resid "39 " and name "HA ") (segid " " and resid "39 " and name "HB2 ") OR {11130} (segid " " and resid "39 " and name "HA ") (segid " " and resid "39 " and name "HB3 ") ASSI {11132} (segid " " and resid "40 " and name "HA ") (segid " " and resid "40 " and name "HB1 ") 5.000 5.000 0.000 peak 11132 weight 0.10000E+01 volume 0.11820E+01 ppm1 4.368 ppm2 1.773 ASSI {11133} (segid " " and resid "40 " and name "HA ") (segid " " and resid "40 " and name "HB2 ") 5.000 5.000 0.000 peak 11133 weight 0.10000E+01 volume 0.11010E+01 ppm1 4.366 ppm2 1.266 ASSI {11134} (segid " " and resid "40 " and name "HA ") (segid " " and resid "40 " and name "HD13") 5.000 5.000 0.000 peak 11134 weight 0.10000E+01 volume 0.77300E+00 ppm1 4.369 ppm2 0.898 OR {11134} (segid " " and resid "40 " and name "HA ") (segid " " and resid "40 " and name "HD11") OR {11134} (segid " " and resid "40 " and name "HA ") (segid " " and resid "40 " and name "HD12") ASSI {11135} (segid " " and resid "40 " and name "HA ") (segid " " and resid "40 " and name "HD23") 3.300 3.300 0.000 peak 11135 weight 0.10000E+01 volume 0.21540E+01 ppm1 4.368 ppm2 0.664 OR {11135} (segid " " and resid "40 " and name "HA ") (segid " " and resid "40 " and name "HD22") OR {11135} (segid " " and resid "40 " and name "HA ") (segid " " and resid "40 " and name "HD21") ASSI {11138} (segid " " and resid "40 " and name "HB2 ") (segid " " and resid "40 " and name "HB1 ") 5.000 5.000 0.000 peak 11138 weight 0.10000E+01 volume 0.16760E+01 ppm1 1.272 ppm2 1.779 ASSI {11140} (segid " " and resid "40 " and name "HB1 ") (segid " " and resid "40 " and name "HD12") 5.000 5.000 0.000 peak 11140 weight 0.10000E+01 volume 0.14890E+01 ppm1 1.780 ppm2 0.895 OR {11140} (segid " " and resid "40 " and name "HB1 ") (segid " " and resid "40 " and name "HD11") OR {11140} (segid " " and resid "40 " and name "HB1 ") (segid " " and resid "40 " and name "HD13") ASSI {11141} (segid " " and resid "40 " and name "HB2 ") (segid " " and resid "40 " and name "HD11") 5.000 5.000 0.000 peak 11141 weight 0.10000E+01 volume 0.10380E+01 ppm1 1.262 ppm2 0.893 OR {11141} (segid " " and resid "40 " and name "HB2 ") (segid " " and resid "40 " and name "HD12") OR {11141} (segid " " and resid "40 " and name "HB2 ") (segid " " and resid "40 " and name "HD13") ASSI {11142} (segid " " and resid "40 " and name "HB1 ") (segid " " and resid "40 " and name "HD21") 5.000 5.000 0.000 peak 11142 weight 0.10000E+01 volume 0.11290E+01 ppm1 1.785 ppm2 0.669 OR {11142} (segid " " and resid "40 " and name "HB1 ") (segid " " and resid "40 " and name "HD22") OR {11142} (segid " " and resid "40 " and name "HB1 ") (segid " " and resid "40 " and name "HD23") ASSI {11143} (segid " " and resid "40 " and name "HB2 ") (segid " " and resid "40 " and name "HD23") 5.000 5.000 0.000 peak 11143 weight 0.10000E+01 volume 0.10450E+01 ppm1 1.275 ppm2 0.668 OR {11143} (segid " " and resid "40 " and name "HB2 ") (segid " " and resid "40 " and name "HD22") OR {11143} (segid " " and resid "40 " and name "HB2 ") (segid " " and resid "40 " and name "HD21") ASSI {11145} (segid " " and resid "40 " and name "HD11") (segid " " and resid "40 " and name "HD21") 2.700 2.700 0.000 peak 11145 weight 0.10000E+01 volume -0.91600E+01 ppm1 0.898 ppm2 0.666 OR {11145} (segid " " and resid "40 " and name "HD13") (segid " " and resid "40 " and name "HD22") OR {11145} (segid " " and resid "40 " and name "HD11") (segid " " and resid "40 " and name "HD22") OR {11145} (segid " " and resid "40 " and name "HD13") (segid " " and resid "40 " and name "HD23") OR {11145} (segid " " and resid "40 " and name "HD11") (segid " " and resid "40 " and name "HD23") OR {11145} (segid " " and resid "40 " and name "HD13") (segid " " and resid "40 " and name "HD21") OR {11145} (segid " " and resid "40 " and name "HD12") (segid " " and resid "40 " and name "HD21") OR {11145} (segid " " and resid "40 " and name "HD12") (segid " " and resid "40 " and name "HD23") OR {11145} (segid " " and resid "40 " and name "HD12") (segid " " and resid "40 " and name "HD22") ASSI {11146} (segid " " and resid "40 " and name "HD13") (segid " " and resid "40 " and name "HG ") 2.700 2.700 0.000 peak 11146 weight 0.10000E+01 volume -0.85120E+01 ppm1 0.899 ppm2 1.780 OR {11146} (segid " " and resid "40 " and name "HD12") (segid " " and resid "40 " and name "HG ") OR {11146} (segid " " and resid "40 " and name "HD11") (segid " " and resid "40 " and name "HG ") ASSI {11149} (segid " " and resid "40 " and name "HD22") (segid " " and resid "40 " and name "HG ") 2.700 2.700 0.000 peak 11149 weight 0.10000E+01 volume -0.53150E+01 ppm1 0.659 ppm2 1.780 OR {11149} (segid " " and resid "40 " and name "HD23") (segid " " and resid "40 " and name "HG ") OR {11149} (segid " " and resid "40 " and name "HD21") (segid " " and resid "40 " and name "HG ") ASSI {11151} (segid " " and resid "41 " and name "HA ") (segid " " and resid "41 " and name "HB1 ") 5.000 5.000 0.000 peak 11151 weight 0.10000E+01 volume 0.11110E+01 ppm1 4.542 ppm2 3.855 ASSI {11152} (segid " " and resid "41 " and name "HA ") (segid " " and resid "41 " and name "HB2 ") 5.000 5.000 0.000 peak 11152 weight 0.10000E+01 volume 0.87300E+00 ppm1 4.544 ppm2 2.817 ASSI {11155} (segid " " and resid "41 " and name "HB2 ") (segid " " and resid "41 " and name "HB1 ") 5.000 5.000 0.000 peak 11155 weight 0.10000E+01 volume 0.72800E+00 ppm1 2.817 ppm2 3.868 ASSI {11157} (segid " " and resid "42 " and name "HA ") (segid " " and resid "42 " and name "HB2 ") 3.300 3.300 0.000 peak 11157 weight 0.10000E+01 volume 0.28570E+01 ppm1 4.157 ppm2 1.737 ASSI {11158} (segid " " and resid "42 " and name "HA ") (segid " " and resid "42 " and name "HD1 ") 5.000 5.000 0.000 peak 11158 weight 0.10000E+01 volume 0.52000E+00 ppm1 4.155 ppm2 2.935 OR {11158} (segid " " and resid "42 " and name "HA ") (segid " " and resid "42 " and name "HD2 ") ASSI {11160} (segid " " and resid "42 " and name "HB1 ") (segid " " and resid "42 " and name "HD2 ") 5.000 5.000 0.000 peak 11160 weight 0.10000E+01 volume -0.64300E+00 ppm1 1.967 ppm2 2.927 OR {11160} (segid " " and resid "42 " and name "HB1 ") (segid " " and resid "42 " and name "HD1 ") ASSI {11161} (segid " " and resid "42 " and name "HB1 ") (segid " " and resid "42 " and name "HG2 ") 6.000 6.000 0.000 peak 11161 weight 0.10000E+01 volume -0.27700E+00 ppm1 1.967 ppm2 0.259 ASSI {11162} (segid " " and resid "42 " and name "HB2 ") (segid " " and resid "42 " and name "HG2 ") 5.000 5.000 0.000 peak 11162 weight 0.10000E+01 volume -0.37200E+00 ppm1 1.745 ppm2 0.275 ASSI {11165} (segid " " and resid "42 " and name "HD1 ") (segid " " and resid "42 " and name "HB2 ") 5.000 5.000 0.000 peak 11165 weight 0.10000E+01 volume 0.14370E+01 ppm1 2.937 ppm2 1.737 OR {11165} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "42 " and name "HB2 ") ASSI {11166} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "42 " and name "HG1 ") 5.000 5.000 0.000 peak 11166 weight 0.10000E+01 volume 0.15340E+01 ppm1 2.936 ppm2 1.277 OR {11166} (segid " " and resid "42 " and name "HD1 ") (segid " " and resid "42 " and name "HG1 ") ASSI {11167} (segid " " and resid "42 " and name "HD1 ") (segid " " and resid "42 " and name "HG2 ") 5.000 5.000 0.000 peak 11167 weight 0.10000E+01 volume 0.14000E+01 ppm1 2.933 ppm2 0.262 OR {11167} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "42 " and name "HG2 ") ASSI {11168} (segid " " and resid "42 " and name "HG1 ") (segid " " and resid "42 " and name "HA ") 6.000 6.000 0.000 peak 11168 weight 0.10000E+01 volume -0.25700E+00 ppm1 1.266 ppm2 4.165 ASSI {11169} (segid " " and resid "42 " and name "HG1 ") (segid " " and resid "42 " and name "HB1 ") 5.000 5.000 0.000 peak 11169 weight 0.10000E+01 volume -0.48000E+00 ppm1 1.273 ppm2 1.967 ASSI {11171} (segid " " and resid "42 " and name "HG1 ") (segid " " and resid "42 " and name "HB2 ") 5.000 5.000 0.000 peak 11171 weight 0.10000E+01 volume -0.58500E+00 ppm1 1.276 ppm2 1.737 ASSI {11174} (segid " " and resid "42 " and name "HG2 ") (segid " " and resid "42 " and name "HG1 ") 5.000 5.000 0.000 peak 11174 weight 0.10000E+01 volume -0.98800E+00 ppm1 0.269 ppm2 1.283 ASSI {11176} (segid " " and resid "43 " and name "HA ") (segid " " and resid "43 " and name "HB1 ") 5.000 5.000 0.000 peak 11176 weight 0.10000E+01 volume 0.98200E+00 ppm1 4.849 ppm2 3.549 ASSI {11177} (segid " " and resid "43 " and name "HA ") (segid " " and resid "43 " and name "HB2 ") 5.000 5.000 0.000 peak 11177 weight 0.10000E+01 volume 0.70400E+00 ppm1 4.846 ppm2 2.799 ASSI {11178} (segid " " and resid "43 " and name "HA ") (segid " " and resid "43 " and name "HD2 ") 5.000 5.000 0.000 peak 11178 weight 0.10000E+01 volume 0.77500E+00 ppm1 4.847 ppm2 7.213 OR {11178} (segid " " and resid "43 " and name "HA ") (segid " " and resid "43 " and name "HD1 ") ASSI {11181} (segid " " and resid "43 " and name "HB2 ") (segid " " and resid "43 " and name "HB1 ") 5.000 5.000 0.000 peak 11181 weight 0.10000E+01 volume 0.83000E+00 ppm1 2.803 ppm2 3.545 ASSI {11183} (segid " " and resid "43 " and name "HB1 ") (segid " " and resid "43 " and name "HD2 ") 6.000 6.000 0.000 peak 11183 weight 0.10000E+01 volume 0.17500E+00 ppm1 3.547 ppm2 7.213 OR {11183} (segid " " and resid "43 " and name "HB1 ") (segid " " and resid "43 " and name "HD1 ") ASSI {11184} (segid " " and resid "43 " and name "HB2 ") (segid " " and resid "43 " and name "HD1 ") 5.000 5.000 0.000 peak 11184 weight 0.10000E+01 volume 0.48600E+00 ppm1 2.798 ppm2 7.203 OR {11184} (segid " " and resid "43 " and name "HB2 ") (segid " " and resid "43 " and name "HD2 ") ASSI {11188} (segid " " and resid "44 " and name "HA2 ") (segid " " and resid "44 " and name "HA1 ") 3.300 3.300 0.000 peak 11188 weight 0.10000E+01 volume 0.22860E+01 ppm1 3.730 ppm2 4.205 ASSI {11190} (segid " " and resid "45 " and name "HA ") (segid " " and resid "45 " and name "HB1 ") 5.000 5.000 0.000 peak 11190 weight 0.10000E+01 volume 0.66500E+00 ppm1 4.845 ppm2 1.897 ASSI {11191} (segid " " and resid "45 " and name "HA ") (segid " " and resid "45 " and name "HB2 ") 5.000 5.000 0.000 peak 11191 weight 0.10000E+01 volume 0.12230E+01 ppm1 4.831 ppm2 1.525 ASSI {11192} (segid " " and resid "45 " and name "HA ") (segid " " and resid "45 " and name "HG1 ") 5.000 5.000 0.000 peak 11192 weight 0.10000E+01 volume 0.12610E+01 ppm1 4.830 ppm2 1.356 OR {11192} (segid " " and resid "45 " and name "HA ") (segid " " and resid "45 " and name "HG2 ") ASSI {11194} (segid " " and resid "45 " and name "HB2 ") (segid " " and resid "45 " and name "HB1 ") 5.000 5.000 0.000 peak 11194 weight 0.10000E+01 volume 0.33300E+00 ppm1 1.514 ppm2 1.917 ASSI {11196} (segid " " and resid "45 " and name "HD1 ") (segid " " and resid "45 " and name "HA ") 6.000 6.000 0.000 peak 11196 weight 0.10000E+01 volume -0.22500E+00 ppm1 1.575 ppm2 4.838 ASSI {11197} (segid " " and resid "45 " and name "HD2 ") (segid " " and resid "45 " and name "HA ") 6.000 6.000 0.000 peak 11197 weight 0.10000E+01 volume -0.21600E+00 ppm1 1.481 ppm2 4.830 ASSI {11198} (segid " " and resid "45 " and name "HD1 ") (segid " " and resid "45 " and name "HE2 ") 5.000 5.000 0.000 peak 11198 weight 0.10000E+01 volume -0.11320E+01 ppm1 1.585 ppm2 2.958 OR {11198} (segid " " and resid "45 " and name "HD1 ") (segid " " and resid "45 " and name "HE1 ") ASSI {11199} (segid " " and resid "45 " and name "HD2 ") (segid " " and resid "45 " and name "HE1 ") 5.000 5.000 0.000 peak 11199 weight 0.10000E+01 volume -0.11060E+01 ppm1 1.486 ppm2 2.954 OR {11199} (segid " " and resid "45 " and name "HD2 ") (segid " " and resid "45 " and name "HE2 ") ASSI {11200} (segid " " and resid "45 " and name "HE2 ") (segid " " and resid "45 " and name "HA ") 6.000 6.000 0.000 peak 11200 weight 0.10000E+01 volume 0.24400E+00 ppm1 2.953 ppm2 4.848 OR {11200} (segid " " and resid "45 " and name "HE1 ") (segid " " and resid "45 " and name "HA ") ASSI {11201} (segid " " and resid "45 " and name "HE1 ") (segid " " and resid "73 " and name "HB1 ") 5.000 5.000 0.000 peak 11201 weight 0.10000E+01 volume 0.71200E+00 ppm1 2.953 ppm2 3.533 OR {11201} (segid " " and resid "45 " and name "HE2 ") (segid " " and resid "73 " and name "HB1 ") ASSI {11202} (segid " " and resid "45 " and name "HE1 ") (segid " " and resid "73 " and name "HB2 ") 5.000 5.000 0.000 peak 11202 weight 0.10000E+01 volume 0.64700E+00 ppm1 2.953 ppm2 2.660 OR {11202} (segid " " and resid "45 " and name "HE2 ") (segid " " and resid "73 " and name "HB2 ") ASSI {11204} (segid " " and resid "45 " and name "HG2 ") (segid " " and resid "45 " and name "HE1 ") 5.000 5.000 0.000 peak 11204 weight 0.10000E+01 volume -0.61000E+00 ppm1 1.379 ppm2 2.954 OR {11204} (segid " " and resid "45 " and name "HG1 ") (segid " " and resid "45 " and name "HE2 ") OR {11204} (segid " " and resid "45 " and name "HG2 ") (segid " " and resid "45 " and name "HE2 ") OR {11204} (segid " " and resid "45 " and name "HG1 ") (segid " " and resid "45 " and name "HE1 ") ASSI {11205} (segid " " and resid "46 " and name "HA ") (segid " " and resid "38 " and name "HA ") 5.000 5.000 0.000 peak 11205 weight 0.10000E+01 volume 0.33300E+00 ppm1 4.771 ppm2 5.142 ASSI {11206} (segid " " and resid "46 " and name "HA ") (segid " " and resid "40 " and name "HA ") 5.000 5.000 0.000 peak 11206 weight 0.10000E+01 volume 0.62900E+00 ppm1 4.771 ppm2 4.363 ASSI {11207} (segid " " and resid "46 " and name "HA ") (segid " " and resid "46 " and name "HB ") 5.000 5.000 0.000 peak 11207 weight 0.10000E+01 volume 0.17200E+01 ppm1 4.771 ppm2 4.930 ASSI {11208} (segid " " and resid "46 " and name "HA ") (segid " " and resid "46 " and name "HG23") 3.300 3.300 0.000 peak 11208 weight 0.10000E+01 volume 0.20230E+01 ppm1 4.768 ppm2 1.198 OR {11208} (segid " " and resid "46 " and name "HA ") (segid " " and resid "46 " and name "HG22") OR {11208} (segid " " and resid "46 " and name "HA ") (segid " " and resid "46 " and name "HG21") ASSI {11211} (segid " " and resid "46 " and name "HB ") (segid " " and resid "46 " and name "HG21") 3.300 3.300 0.000 peak 11211 weight 0.10000E+01 volume -0.21290E+01 ppm1 4.929 ppm2 1.193 OR {11211} (segid " " and resid "46 " and name "HB ") (segid " " and resid "46 " and name "HG22") OR {11211} (segid " " and resid "46 " and name "HB ") (segid " " and resid "46 " and name "HG23") ASSI {11214} (segid " " and resid "46 " and name "HG22") (segid " " and resid "38 " and name "HB2 ") 5.000 5.000 0.000 peak 11214 weight 0.10000E+01 volume -0.64800E+00 ppm1 1.193 ppm2 2.596 OR {11214} (segid " " and resid "46 " and name "HG23") (segid " " and resid "38 " and name "HB2 ") OR {11214} (segid " " and resid "46 " and name "HG21") (segid " " and resid "38 " and name "HB2 ") ASSI {11217} (segid " " and resid "47 " and name "HA ") (segid " " and resid "47 " and name "HB3 ") 3.300 3.300 0.000 peak 11217 weight 0.10000E+01 volume 0.28590E+01 ppm1 4.014 ppm2 1.250 OR {11217} (segid " " and resid "47 " and name "HA ") (segid " " and resid "47 " and name "HB2 ") OR {11217} (segid " " and resid "47 " and name "HA ") (segid " " and resid "47 " and name "HB1 ") ASSI {11219} (segid " " and resid "48 " and name "HA ") (segid " " and resid "48 " and name "HB1 ") 5.000 5.000 0.000 peak 11219 weight 0.10000E+01 volume 0.88600E+00 ppm1 3.784 ppm2 1.562 ASSI {11220} (segid " " and resid "48 " and name "HA ") (segid " " and resid "48 " and name "HB2 ") 5.000 5.000 0.000 peak 11220 weight 0.10000E+01 volume 0.10920E+01 ppm1 3.783 ppm2 1.403 ASSI {11221} (segid " " and resid "48 " and name "HA ") (segid " " and resid "48 " and name "HD12") 3.300 3.300 0.000 peak 11221 weight 0.10000E+01 volume 0.23000E+01 ppm1 3.780 ppm2 0.802 OR {11221} (segid " " and resid "48 " and name "HA ") (segid " " and resid "48 " and name "HD21") OR {11221} (segid " " and resid "48 " and name "HA ") (segid " " and resid "48 " and name "HD23") OR {11221} (segid " " and resid "48 " and name "HA ") (segid " " and resid "48 " and name "HD22") OR {11221} (segid " " and resid "48 " and name "HA ") (segid " " and resid "48 " and name "HD13") OR {11221} (segid " " and resid "48 " and name "HA ") (segid " " and resid "48 " and name "HD11") ASSI {11222} (segid " " and resid "48 " and name "HA ") (segid " " and resid "48 " and name "HG ") 5.000 5.000 0.000 peak 11222 weight 0.10000E+01 volume 0.90800E+00 ppm1 3.781 ppm2 1.727 ASSI {11225} (segid " " and resid "48 " and name "HB2 ") (segid " " and resid "48 " and name "HB1 ") 5.000 5.000 0.000 peak 11225 weight 0.10000E+01 volume 0.19090E+01 ppm1 1.390 ppm2 1.565 ASSI {11227} (segid " " and resid "48 " and name "HB1 ") (segid " " and resid "48 " and name "HD12") 5.000 5.000 0.000 peak 11227 weight 0.10000E+01 volume 0.18860E+01 ppm1 1.569 ppm2 0.815 OR {11227} (segid " " and resid "48 " and name "HB1 ") (segid " " and resid "48 " and name "HD13") OR {11227} (segid " " and resid "48 " and name "HB1 ") (segid " " and resid "48 " and name "HD22") OR {11227} (segid " " and resid "48 " and name "HB1 ") (segid " " and resid "48 " and name "HD11") OR {11227} (segid " " and resid "48 " and name "HB1 ") (segid " " and resid "48 " and name "HD23") OR {11227} (segid " " and resid "48 " and name "HB1 ") (segid " " and resid "48 " and name "HD21") ASSI {11228} (segid " " and resid "48 " and name "HB2 ") (segid " " and resid "48 " and name "HD13") 5.000 5.000 0.000 peak 11228 weight 0.10000E+01 volume 0.15470E+01 ppm1 1.402 ppm2 0.816 OR {11228} (segid " " and resid "48 " and name "HB2 ") (segid " " and resid "48 " and name "HD12") OR {11228} (segid " " and resid "48 " and name "HB2 ") (segid " " and resid "48 " and name "HD22") OR {11228} (segid " " and resid "48 " and name "HB2 ") (segid " " and resid "48 " and name "HD23") OR {11228} (segid " " and resid "48 " and name "HB2 ") (segid " " and resid "48 " and name "HD21") OR {11228} (segid " " and resid "48 " and name "HB2 ") (segid " " and resid "48 " and name "HD11") ASSI {11230} (segid " " and resid "48 " and name "HD12") (segid " " and resid "48 " and name "HA ") 5.000 5.000 0.000 peak 11230 weight 0.10000E+01 volume -0.88700E+00 ppm1 0.819 ppm2 3.781 OR {11230} (segid " " and resid "48 " and name "HD13") (segid " " and resid "48 " and name "HA ") OR {11230} (segid " " and resid "48 " and name "HD11") (segid " " and resid "48 " and name "HA ") ASSI {11231} (segid " " and resid "48 " and name "HD12") (segid " " and resid "48 " and name "HB1 ") 5.000 5.000 0.000 peak 11231 weight 0.10000E+01 volume -0.19730E+01 ppm1 0.819 ppm2 1.566 OR {11231} (segid " " and resid "48 " and name "HD13") (segid " " and resid "48 " and name "HB1 ") OR {11231} (segid " " and resid "48 " and name "HD11") (segid " " and resid "48 " and name "HB1 ") ASSI {11232} (segid " " and resid "48 " and name "HD13") (segid " " and resid "48 " and name "HB2 ") 5.000 5.000 0.000 peak 11232 weight 0.10000E+01 volume -0.17770E+01 ppm1 0.819 ppm2 1.406 OR {11232} (segid " " and resid "48 " and name "HD12") (segid " " and resid "48 " and name "HB2 ") OR {11232} (segid " " and resid "48 " and name "HD11") (segid " " and resid "48 " and name "HB2 ") ASSI {11233} (segid " " and resid "48 " and name "HD13") (segid " " and resid "48 " and name "HG ") 3.300 3.300 0.000 peak 11233 weight 0.10000E+01 volume -0.28620E+01 ppm1 0.818 ppm2 1.748 OR {11233} (segid " " and resid "48 " and name "HD11") (segid " " and resid "48 " and name "HG ") OR {11233} (segid " " and resid "48 " and name "HD12") (segid " " and resid "48 " and name "HG ") ASSI {11234} (segid " " and resid "48 " and name "HD13") (segid " " and resid "69 " and name "HA ") 5.000 5.000 0.000 peak 11234 weight 0.10000E+01 volume -0.16080E+01 ppm1 0.819 ppm2 4.407 OR {11234} (segid " " and resid "48 " and name "HD12") (segid " " and resid "69 " and name "HA ") OR {11234} (segid " " and resid "48 " and name "HD11") (segid " " and resid "69 " and name "HA ") ASSI {11235} (segid " " and resid "48 " and name "HD21") (segid " " and resid "48 " and name "HA ") 3.300 3.300 0.000 peak 11235 weight 0.10000E+01 volume -0.27730E+01 ppm1 0.793 ppm2 3.783 OR {11235} (segid " " and resid "48 " and name "HD23") (segid " " and resid "48 " and name "HA ") OR {11235} (segid " " and resid "48 " and name "HD22") (segid " " and resid "48 " and name "HA ") ASSI {11236} (segid " " and resid "48 " and name "HD22") (segid " " and resid "48 " and name "HB1 ") 3.300 3.300 0.000 peak 11236 weight 0.10000E+01 volume -0.26930E+01 ppm1 0.792 ppm2 1.566 OR {11236} (segid " " and resid "48 " and name "HD23") (segid " " and resid "48 " and name "HB1 ") OR {11236} (segid " " and resid "48 " and name "HD21") (segid " " and resid "48 " and name "HB1 ") ASSI {11237} (segid " " and resid "48 " and name "HD22") (segid " " and resid "48 " and name "HG ") 2.700 2.700 0.000 peak 11237 weight 0.10000E+01 volume -0.42290E+01 ppm1 0.791 ppm2 1.748 OR {11237} (segid " " and resid "48 " and name "HD23") (segid " " and resid "48 " and name "HG ") OR {11237} (segid " " and resid "48 " and name "HD21") (segid " " and resid "48 " and name "HG ") ASSI {11238} (segid " " and resid "48 " and name "HD22") (segid " " and resid "69 " and name "HA ") 5.000 5.000 0.000 peak 11238 weight 0.10000E+01 volume -0.46500E+00 ppm1 0.796 ppm2 4.405 OR {11238} (segid " " and resid "48 " and name "HD23") (segid " " and resid "69 " and name "HA ") OR {11238} (segid " " and resid "48 " and name "HD21") (segid " " and resid "69 " and name "HA ") ASSI {11239} (segid " " and resid "48 " and name "HG ") (segid " " and resid "48 " and name "HB2 ") 3.300 3.300 0.000 peak 11239 weight 0.10000E+01 volume -0.20040E+01 ppm1 1.753 ppm2 1.406 ASSI {11240} (segid " " and resid "48 " and name "HG ") (segid " " and resid "48 " and name "HD13") 2.700 2.700 0.000 peak 11240 weight 0.10000E+01 volume -0.50530E+01 ppm1 1.753 ppm2 0.819 OR {11240} (segid " " and resid "48 " and name "HG ") (segid " " and resid "48 " and name "HD22") OR {11240} (segid " " and resid "48 " and name "HG ") (segid " " and resid "48 " and name "HD23") OR {11240} (segid " " and resid "48 " and name "HG ") (segid " " and resid "48 " and name "HD11") OR {11240} (segid " " and resid "48 " and name "HG ") (segid " " and resid "48 " and name "HD21") OR {11240} (segid " " and resid "48 " and name "HG ") (segid " " and resid "48 " and name "HD12") ASSI {11241} (segid " " and resid "49 " and name "HG1 ") (segid " " and resid "49 " and name "HA ") 6.000 6.000 0.000 peak 11241 weight 0.10000E+01 volume 0.20400E+00 ppm1 2.706 ppm2 4.197 ASSI {11242} (segid " " and resid "49 " and name "HG1 ") (segid " " and resid "49 " and name "HG2 ") 5.000 5.000 0.000 peak 11242 weight 0.10000E+01 volume 0.65300E+00 ppm1 2.715 ppm2 2.221 ASSI {11243} (segid " " and resid "50 " and name "HA ") (segid " " and resid "50 " and name "HB ") 3.300 3.300 0.000 peak 11243 weight 0.10000E+01 volume -0.22790E+01 ppm1 4.654 ppm2 2.511 ASSI {11244} (segid " " and resid "50 " and name "HA ") (segid " " and resid "50 " and name "HG12") 3.300 3.300 0.000 peak 11244 weight 0.10000E+01 volume -0.28440E+01 ppm1 4.652 ppm2 0.849 OR {11244} (segid " " and resid "50 " and name "HA ") (segid " " and resid "50 " and name "HG13") OR {11244} (segid " " and resid "50 " and name "HA ") (segid " " and resid "50 " and name "HG11") ASSI {11245} (segid " " and resid "50 " and name "HA ") (segid " " and resid "50 " and name "HG23") 5.000 5.000 0.000 peak 11245 weight 0.10000E+01 volume -0.19940E+01 ppm1 4.652 ppm2 0.917 OR {11245} (segid " " and resid "50 " and name "HA ") (segid " " and resid "50 " and name "HG22") OR {11245} (segid " " and resid "50 " and name "HA ") (segid " " and resid "50 " and name "HG21") ASSI {11247} (segid " " and resid "50 " and name "HB ") (segid " " and resid "50 " and name "HG12") 3.300 3.300 0.000 peak 11247 weight 0.10000E+01 volume -0.33530E+01 ppm1 2.516 ppm2 0.849 OR {11247} (segid " " and resid "50 " and name "HB ") (segid " " and resid "50 " and name "HG13") OR {11247} (segid " " and resid "50 " and name "HB ") (segid " " and resid "50 " and name "HG11") ASSI {11248} (segid " " and resid "50 " and name "HB ") (segid " " and resid "50 " and name "HG22") 3.300 3.300 0.000 peak 11248 weight 0.10000E+01 volume -0.33200E+01 ppm1 2.514 ppm2 0.921 OR {11248} (segid " " and resid "50 " and name "HB ") (segid " " and resid "50 " and name "HG23") OR {11248} (segid " " and resid "50 " and name "HB ") (segid " " and resid "50 " and name "HG21") ASSI {11249} (segid " " and resid "50 " and name "HG13") (segid " " and resid "45 " and name "HE2 ") 5.000 5.000 0.000 peak 11249 weight 0.10000E+01 volume -0.67500E+00 ppm1 0.859 ppm2 2.954 OR {11249} (segid " " and resid "50 " and name "HG12") (segid " " and resid "45 " and name "HE2 ") OR {11249} (segid " " and resid "50 " and name "HG13") (segid " " and resid "45 " and name "HE1 ") OR {11249} (segid " " and resid "50 " and name "HG12") (segid " " and resid "45 " and name "HE1 ") OR {11249} (segid " " and resid "50 " and name "HG11") (segid " " and resid "45 " and name "HE2 ") OR {11249} (segid " " and resid "50 " and name "HG11") (segid " " and resid "45 " and name "HE1 ") ASSI {11254} (segid " " and resid "50 " and name "HG23") (segid " " and resid "51 " and name "HA ") 6.000 6.000 0.000 peak 11254 weight 0.10000E+01 volume -0.26100E+00 ppm1 0.926 ppm2 3.434 OR {11254} (segid " " and resid "50 " and name "HG22") (segid " " and resid "51 " and name "HA ") OR {11254} (segid " " and resid "50 " and name "HG21") (segid " " and resid "51 " and name "HA ") ASSI {11259} (segid " " and resid "51 " and name "HA ") (segid " " and resid "51 " and name "HB1 ") 5.000 5.000 0.000 peak 11259 weight 0.10000E+01 volume 0.68000E+00 ppm1 3.444 ppm2 1.964 ASSI {11260} (segid " " and resid "51 " and name "HA ") (segid " " and resid "51 " and name "HB2 ") 5.000 5.000 0.000 peak 11260 weight 0.10000E+01 volume 0.98500E+00 ppm1 3.441 ppm2 1.443 ASSI {11261} (segid " " and resid "51 " and name "HA ") (segid " " and resid "51 " and name "HG1 ") 6.000 6.000 0.000 peak 11261 weight 0.10000E+01 volume 0.26800E+00 ppm1 3.438 ppm2 2.324 ASSI {11262} (segid " " and resid "51 " and name "HA ") (segid " " and resid "51 " and name "HG2 ") 5.000 5.000 0.000 peak 11262 weight 0.10000E+01 volume 0.38800E+00 ppm1 3.440 ppm2 1.193 ASSI {11265} (segid " " and resid "51 " and name "HB2 ") (segid " " and resid "51 " and name "HB1 ") 5.000 5.000 0.000 peak 11265 weight 0.10000E+01 volume 0.58600E+00 ppm1 1.450 ppm2 1.948 ASSI {11267} (segid " " and resid "51 " and name "HB2 ") (segid " " and resid "51 " and name "HG1 ") 5.000 5.000 0.000 peak 11267 weight 0.10000E+01 volume 0.41800E+00 ppm1 1.443 ppm2 2.332 ASSI {11268} (segid " " and resid "51 " and name "HB1 ") (segid " " and resid "51 " and name "HG2 ") 5.000 5.000 0.000 peak 11268 weight 0.10000E+01 volume 0.48600E+00 ppm1 1.967 ppm2 1.169 ASSI {11269} (segid " " and resid "51 " and name "HB2 ") (segid " " and resid "51 " and name "HG2 ") 5.000 5.000 0.000 peak 11269 weight 0.10000E+01 volume 0.53800E+00 ppm1 1.443 ppm2 1.176 ASSI {11270} (segid " " and resid "51 " and name "HE2 ") (segid " " and resid "53 " and name "HA ") 5.000 5.000 0.000 peak 11270 weight 0.10000E+01 volume -0.10920E+01 ppm1 1.688 ppm2 3.912 OR {11270} (segid " " and resid "51 " and name "HE1 ") (segid " " and resid "53 " and name "HA ") OR {11270} (segid " " and resid "51 " and name "HE3 ") (segid " " and resid "53 " and name "HA ") ASSI {11272} (segid " " and resid "51 " and name "HG1 ") (segid " " and resid "51 " and name "HE3 ") 5.000 5.000 0.000 peak 11272 weight 0.10000E+01 volume -0.77400E+00 ppm1 2.333 ppm2 1.691 OR {11272} (segid " " and resid "51 " and name "HG1 ") (segid " " and resid "51 " and name "HE2 ") OR {11272} (segid " " and resid "51 " and name "HG1 ") (segid " " and resid "51 " and name "HE1 ") ASSI {11273} (segid " " and resid "51 " and name "HG2 ") (segid " " and resid "51 " and name "HE3 ") 5.000 5.000 0.000 peak 11273 weight 0.10000E+01 volume -0.61100E+00 ppm1 1.182 ppm2 1.690 OR {11273} (segid " " and resid "51 " and name "HG2 ") (segid " " and resid "51 " and name "HE2 ") OR {11273} (segid " " and resid "51 " and name "HG2 ") (segid " " and resid "51 " and name "HE1 ") ASSI {11274} (segid " " and resid "52 " and name "HA ") (segid " " and resid "52 " and name "HB2 ") 5.000 5.000 0.000 peak 11274 weight 0.10000E+01 volume 0.19440E+01 ppm1 4.251 ppm2 1.860 ASSI {11275} (segid " " and resid "52 " and name "HA ") (segid " " and resid "52 " and name "HG2 ") 5.000 5.000 0.000 peak 11275 weight 0.10000E+01 volume 0.11990E+01 ppm1 4.245 ppm2 2.555 OR {11275} (segid " " and resid "52 " and name "HA ") (segid " " and resid "52 " and name "HG1 ") ASSI {11276} (segid " " and resid "52 " and name "HB1 ") (segid " " and resid "52 " and name "HA ") 5.000 5.000 0.000 peak 11276 weight 0.10000E+01 volume -0.19010E+01 ppm1 2.127 ppm2 4.235 ASSI {11277} (segid " " and resid "52 " and name "HB1 ") (segid " " and resid "52 " and name "HB2 ") 3.300 3.300 0.000 peak 11277 weight 0.10000E+01 volume -0.36660E+01 ppm1 2.127 ppm2 1.860 ASSI {11279} (segid " " and resid "53 " and name "HA ") (segid " " and resid "53 " and name "HB1 ") 5.000 5.000 0.000 peak 11279 weight 0.10000E+01 volume -0.84500E+00 ppm1 3.907 ppm2 2.838 ASSI {11280} (segid " " and resid "53 " and name "HA ") (segid " " and resid "53 " and name "HB2 ") 5.000 5.000 0.000 peak 11280 weight 0.10000E+01 volume -0.96100E+00 ppm1 3.907 ppm2 2.730 ASSI {11281} (segid " " and resid "53 " and name "HA ") (segid " " and resid "53 " and name "HD2 ") 5.000 5.000 0.000 peak 11281 weight 0.10000E+01 volume -0.55700E+00 ppm1 3.913 ppm2 7.198 OR {11281} (segid " " and resid "53 " and name "HA ") (segid " " and resid "53 " and name "HD1 ") ASSI {11284} (segid " " and resid "53 " and name "HB1 ") (segid " " and resid "53 " and name "HD2 ") 5.000 5.000 0.000 peak 11284 weight 0.10000E+01 volume 0.49700E+00 ppm1 2.833 ppm2 7.204 OR {11284} (segid " " and resid "53 " and name "HB1 ") (segid " " and resid "53 " and name "HD1 ") ASSI {11285} (segid " " and resid "53 " and name "HB2 ") (segid " " and resid "53 " and name "HD2 ") 5.000 5.000 0.000 peak 11285 weight 0.10000E+01 volume 0.37700E+00 ppm1 2.735 ppm2 7.200 OR {11285} (segid " " and resid "53 " and name "HB2 ") (segid " " and resid "53 " and name "HD1 ") ASSI {11289} (segid " " and resid "53 " and name "HD1 ") (segid " " and resid "95 " and name "HD13") 6.000 6.000 0.000 peak 11289 weight 0.10000E+01 volume -0.17600E+00 ppm1 7.197 ppm2 0.766 OR {11289} (segid " " and resid "53 " and name "HD2 ") (segid " " and resid "95 " and name "HD12") OR {11289} (segid " " and resid "53 " and name "HD2 ") (segid " " and resid "95 " and name "HD11") OR {11289} (segid " " and resid "53 " and name "HD2 ") (segid " " and resid "95 " and name "HD13") OR {11289} (segid " " and resid "53 " and name "HD1 ") (segid " " and resid "95 " and name "HD11") OR {11289} (segid " " and resid "53 " and name "HD1 ") (segid " " and resid "95 " and name "HD12") ASSI {11290} (segid " " and resid "53 " and name "HD1 ") (segid " " and resid "96 " and name "HB ") 6.000 6.000 0.000 peak 11290 weight 0.10000E+01 volume -0.20900E+00 ppm1 7.201 ppm2 2.333 OR {11290} (segid " " and resid "53 " and name "HD2 ") (segid " " and resid "96 " and name "HB ") ASSI {11291} (segid " " and resid "53 " and name "HD1 ") (segid " " and resid "96 " and name "HG12") 5.000 5.000 0.000 peak 11291 weight 0.10000E+01 volume -0.11440E+01 ppm1 7.197 ppm2 1.139 OR {11291} (segid " " and resid "53 " and name "HD1 ") (segid " " and resid "96 " and name "HG11") OR {11291} (segid " " and resid "53 " and name "HD1 ") (segid " " and resid "96 " and name "HG13") OR {11291} (segid " " and resid "53 " and name "HD2 ") (segid " " and resid "96 " and name "HG13") OR {11291} (segid " " and resid "53 " and name "HD2 ") (segid " " and resid "96 " and name "HG12") OR {11291} (segid " " and resid "53 " and name "HD2 ") (segid " " and resid "96 " and name "HG11") OR {11291} (segid " " and resid "53 " and name "HD1 ") (segid " " and resid "96 " and name "HG22") OR {11291} (segid " " and resid "53 " and name "HD2 ") (segid " " and resid "96 " and name "HG21") OR {11291} (segid " " and resid "53 " and name "HD2 ") (segid " " and resid "96 " and name "HG22") OR {11291} (segid " " and resid "53 " and name "HD1 ") (segid " " and resid "96 " and name "HG21") OR {11291} (segid " " and resid "53 " and name "HD1 ") (segid " " and resid "96 " and name "HG23") OR {11291} (segid " " and resid "53 " and name "HD2 ") (segid " " and resid "96 " and name "HG23") ASSI {11292} (segid " " and resid "55 " and name "HA ") (segid " " and resid "55 " and name "HB1 ") 3.300 3.300 0.000 peak 11292 weight 0.10000E+01 volume 0.20750E+01 ppm1 5.057 ppm2 3.999 ASSI {11293} (segid " " and resid "55 " and name "HA ") (segid " " and resid "55 " and name "HB2 ") 5.000 5.000 0.000 peak 11293 weight 0.10000E+01 volume 0.72500E+00 ppm1 5.055 ppm2 3.681 ASSI {11294} (segid " " and resid "55 " and name "HA ") (segid " " and resid "56 " and name "HD2 ") 5.000 5.000 0.000 peak 11294 weight 0.10000E+01 volume 0.92000E+00 ppm1 5.057 ppm2 3.360 ASSI {11295} (segid " " and resid "55 " and name "HA ") (segid " " and resid "56 " and name "HG1 ") 5.000 5.000 0.000 peak 11295 weight 0.10000E+01 volume 0.10160E+01 ppm1 5.052 ppm2 2.047 OR {11295} (segid " " and resid "55 " and name "HA ") (segid " " and resid "56 " and name "HG2 ") ASSI {11298} (segid " " and resid "55 " and name "HB2 ") (segid " " and resid "55 " and name "HB1 ") 2.700 2.700 0.000 peak 11298 weight 0.10000E+01 volume -0.54700E+01 ppm1 3.689 ppm2 3.985 ASSI {11300} (segid " " and resid "56 " and name "HA ") (segid " " and resid "55 " and name "HA ") 6.000 6.000 0.000 peak 11300 weight 0.10000E+01 volume -0.13400E+00 ppm1 4.315 ppm2 5.055 ASSI {11301} (segid " " and resid "56 " and name "HA ") (segid " " and resid "56 " and name "HD2 ") 6.000 6.000 0.000 peak 11301 weight 0.10000E+01 volume -0.21800E+00 ppm1 4.302 ppm2 3.369 ASSI {11302} (segid " " and resid "56 " and name "HD1 ") (segid " " and resid "55 " and name "HA ") 5.000 5.000 0.000 peak 11302 weight 0.10000E+01 volume 0.11970E+01 ppm1 4.013 ppm2 5.057 ASSI {11304} (segid " " and resid "56 " and name "HD1 ") (segid " " and resid "56 " and name "HA ") 5.000 5.000 0.000 peak 11304 weight 0.10000E+01 volume 0.31300E+00 ppm1 4.018 ppm2 4.285 ASSI {11306} (segid " " and resid "56 " and name "HD2 ") (segid " " and resid "56 " and name "HD1 ") 5.000 5.000 0.000 peak 11306 weight 0.10000E+01 volume 0.14000E+01 ppm1 3.362 ppm2 4.000 ASSI {11308} (segid " " and resid "56 " and name "HD1 ") (segid " " and resid "56 " and name "HG1 ") 5.000 5.000 0.000 peak 11308 weight 0.10000E+01 volume 0.17780E+01 ppm1 4.015 ppm2 2.048 OR {11308} (segid " " and resid "56 " and name "HD1 ") (segid " " and resid "56 " and name "HG2 ") ASSI {11309} (segid " " and resid "56 " and name "HD2 ") (segid " " and resid "56 " and name "HG2 ") 5.000 5.000 0.000 peak 11309 weight 0.10000E+01 volume 0.10540E+01 ppm1 3.360 ppm2 2.044 OR {11309} (segid " " and resid "56 " and name "HD2 ") (segid " " and resid "56 " and name "HG1 ") ASSI {11313} (segid " " and resid "56 " and name "HG1 ") (segid " " and resid "90 " and name "HB1 ") 5.000 5.000 0.000 peak 11313 weight 0.10000E+01 volume -0.77900E+00 ppm1 2.047 ppm2 2.757 OR {11313} (segid " " and resid "56 " and name "HG2 ") (segid " " and resid "90 " and name "HB1 ") ASSI {11314} (segid " " and resid "56 " and name "HG1 ") (segid " " and resid "90 " and name "HB2 ") 5.000 5.000 0.000 peak 11314 weight 0.10000E+01 volume -0.86500E+00 ppm1 2.047 ppm2 2.580 OR {11314} (segid " " and resid "56 " and name "HG2 ") (segid " " and resid "90 " and name "HB2 ") ASSI {11315} (segid " " and resid "58 " and name "HA ") (segid " " and resid "58 " and name "HB ") 5.000 5.000 0.000 peak 11315 weight 0.10000E+01 volume -0.50200E+00 ppm1 3.421 ppm2 2.329 ASSI {11317} (segid " " and resid "58 " and name "HG22") (segid " " and resid "58 " and name "HA ") 3.300 3.300 0.000 peak 11317 weight 0.10000E+01 volume -0.27170E+01 ppm1 0.952 ppm2 3.425 OR {11317} (segid " " and resid "58 " and name "HG21") (segid " " and resid "58 " and name "HA ") OR {11317} (segid " " and resid "58 " and name "HG23") (segid " " and resid "58 " and name "HA ") ASSI {11318} (segid " " and resid "58 " and name "HG21") (segid " " and resid "58 " and name "HB ") 2.700 2.700 0.000 peak 11318 weight 0.10000E+01 volume -0.58120E+01 ppm1 0.955 ppm2 2.324 OR {11318} (segid " " and resid "58 " and name "HG22") (segid " " and resid "58 " and name "HB ") OR {11318} (segid " " and resid "58 " and name "HG23") (segid " " and resid "58 " and name "HB ") ASSI {11319} (segid " " and resid "60 " and name "HA ") (segid " " and resid "60 " and name "HB1 ") 5.000 5.000 0.000 peak 11319 weight 0.10000E+01 volume 0.99600E+00 ppm1 3.632 ppm2 1.801 ASSI {11320} (segid " " and resid "60 " and name "HA ") (segid " " and resid "60 " and name "HB2 ") 5.000 5.000 0.000 peak 11320 weight 0.10000E+01 volume 0.14290E+01 ppm1 3.629 ppm2 1.609 ASSI {11321} (segid " " and resid "60 " and name "HA ") (segid " " and resid "60 " and name "HD21") 3.300 3.300 0.000 peak 11321 weight 0.10000E+01 volume 0.37900E+01 ppm1 3.628 ppm2 0.963 OR {11321} (segid " " and resid "60 " and name "HA ") (segid " " and resid "60 " and name "HD23") OR {11321} (segid " " and resid "60 " and name "HA ") (segid " " and resid "60 " and name "HD11") OR {11321} (segid " " and resid "60 " and name "HA ") (segid " " and resid "60 " and name "HD13") OR {11321} (segid " " and resid "60 " and name "HA ") (segid " " and resid "60 " and name "HD22") OR {11321} (segid " " and resid "60 " and name "HA ") (segid " " and resid "60 " and name "HD12") ASSI {11324} (segid " " and resid "60 " and name "HB1 ") (segid " " and resid "60 " and name "HD13") 2.700 2.700 0.000 peak 11324 weight 0.10000E+01 volume 0.41190E+01 ppm1 1.798 ppm2 0.960 OR {11324} (segid " " and resid "60 " and name "HB1 ") (segid " " and resid "60 " and name "HD23") OR {11324} (segid " " and resid "60 " and name "HB1 ") (segid " " and resid "60 " and name "HD22") OR {11324} (segid " " and resid "60 " and name "HB1 ") (segid " " and resid "60 " and name "HD11") OR {11324} (segid " " and resid "60 " and name "HB1 ") (segid " " and resid "60 " and name "HD21") OR {11324} (segid " " and resid "60 " and name "HB1 ") (segid " " and resid "60 " and name "HD12") ASSI {11325} (segid " " and resid "60 " and name "HD21") (segid " " and resid "60 " and name "HA ") 3.300 3.300 0.000 peak 11325 weight 0.10000E+01 volume -0.32720E+01 ppm1 0.959 ppm2 3.629 OR {11325} (segid " " and resid "60 " and name "HD23") (segid " " and resid "60 " and name "HA ") OR {11325} (segid " " and resid "60 " and name "HD22") (segid " " and resid "60 " and name "HA ") ASSI {11326} (segid " " and resid "60 " and name "HD21") (segid " " and resid "60 " and name "HG ") 2.700 2.700 0.000 peak 11326 weight 0.10000E+01 volume -0.70860E+01 ppm1 0.952 ppm2 1.513 OR {11326} (segid " " and resid "60 " and name "HD23") (segid " " and resid "60 " and name "HG ") OR {11326} (segid " " and resid "60 " and name "HD22") (segid " " and resid "60 " and name "HG ") ASSI {11327} (segid " " and resid "60 " and name "HG ") (segid " " and resid "60 " and name "HA ") 5.000 5.000 0.000 peak 11327 weight 0.10000E+01 volume -0.73100E+00 ppm1 1.526 ppm2 3.637 ASSI {11328} (segid " " and resid "61 " and name "HA ") (segid " " and resid "61 " and name "HG1 ") 5.000 5.000 0.000 peak 11328 weight 0.10000E+01 volume 0.12330E+01 ppm1 3.881 ppm2 2.442 ASSI {11329} (segid " " and resid "61 " and name "HA ") (segid " " and resid "64 " and name "HE1 ") 6.000 6.000 0.000 peak 11329 weight 0.10000E+01 volume 0.19300E+00 ppm1 3.881 ppm2 3.002 OR {11329} (segid " " and resid "61 " and name "HA ") (segid " " and resid "64 " and name "HE2 ") ASSI {11331} (segid " " and resid "61 " and name "HG2 ") (segid " " and resid "61 " and name "HA ") 6.000 6.000 0.000 peak 11331 weight 0.10000E+01 volume 0.24100E+00 ppm1 2.094 ppm2 3.866 ASSI {11332} (segid " " and resid "62 " and name "HA ") (segid " " and resid "62 " and name "HB1 ") 5.000 5.000 0.000 peak 11332 weight 0.10000E+01 volume 0.13900E+01 ppm1 3.783 ppm2 1.836 ASSI {11333} (segid " " and resid "62 " and name "HA ") (segid " " and resid "62 " and name "HG ") 5.000 5.000 0.000 peak 11333 weight 0.10000E+01 volume 0.14600E+01 ppm1 3.776 ppm2 1.723 ASSI {11334} (segid " " and resid "62 " and name "HB1 ") (segid " " and resid "62 " and name "HD11") 5.000 5.000 0.000 peak 11334 weight 0.10000E+01 volume 0.77700E+00 ppm1 1.854 ppm2 0.693 OR {11334} (segid " " and resid "62 " and name "HB1 ") (segid " " and resid "62 " and name "HD13") OR {11334} (segid " " and resid "62 " and name "HB1 ") (segid " " and resid "62 " and name "HD12") ASSI {11336} (segid " " and resid "63 " and name "HA ") (segid " " and resid "63 " and name "HG ") 5.000 5.000 0.000 peak 11336 weight 0.10000E+01 volume 0.16760E+01 ppm1 3.898 ppm2 1.604 ASSI {11337} (segid " " and resid "63 " and name "HB1 ") (segid " " and resid "63 " and name "HA ") 5.000 5.000 0.000 peak 11337 weight 0.10000E+01 volume 0.32600E+00 ppm1 1.217 ppm2 3.899 ASSI {11338} (segid " " and resid "63 " and name "HB2 ") (segid " " and resid "63 " and name "HA ") 5.000 5.000 0.000 peak 11338 weight 0.10000E+01 volume 0.31600E+00 ppm1 0.862 ppm2 3.909 ASSI {11339} (segid " " and resid "63 " and name "HB1 ") (segid " " and resid "63 " and name "HB2 ") 5.000 5.000 0.000 peak 11339 weight 0.10000E+01 volume 0.10740E+01 ppm1 1.216 ppm2 0.843 ASSI {11340} (segid " " and resid "63 " and name "HB1 ") (segid " " and resid "63 " and name "HG ") 6.000 6.000 0.000 peak 11340 weight 0.10000E+01 volume 0.28400E+00 ppm1 1.230 ppm2 1.601 ASSI {11341} (segid " " and resid "63 " and name "HB2 ") (segid " " and resid "63 " and name "HG ") 6.000 6.000 0.000 peak 11341 weight 0.10000E+01 volume 0.89000E-01 ppm1 0.856 ppm2 1.588 ASSI {11342} (segid " " and resid "63 " and name "HD13") (segid " " and resid "63 " and name "HA ") 5.000 5.000 0.000 peak 11342 weight 0.10000E+01 volume -0.14800E+01 ppm1 0.659 ppm2 3.915 OR {11342} (segid " " and resid "63 " and name "HD11") (segid " " and resid "63 " and name "HA ") OR {11342} (segid " " and resid "63 " and name "HD12") (segid " " and resid "63 " and name "HA ") ASSI {11343} (segid " " and resid "64 " and name "HA ") (segid " " and resid "64 " and name "HE2 ") 6.000 6.000 0.000 peak 11343 weight 0.10000E+01 volume -0.14400E+00 ppm1 4.102 ppm2 3.007 OR {11343} (segid " " and resid "64 " and name "HA ") (segid " " and resid "64 " and name "HE1 ") ASSI {11344} (segid " " and resid "64 " and name "HB1 ") (segid " " and resid "64 " and name "HA ") 3.300 3.300 0.000 peak 11344 weight 0.10000E+01 volume -0.23840E+01 ppm1 1.990 ppm2 4.111 ASSI {11345} (segid " " and resid "64 " and name "HB2 ") (segid " " and resid "64 " and name "HA ") 3.300 3.300 0.000 peak 11345 weight 0.10000E+01 volume -0.27540E+01 ppm1 1.902 ppm2 4.111 ASSI {11346} (segid " " and resid "64 " and name "HB1 ") (segid " " and resid "64 " and name "HE1 ") 5.000 5.000 0.000 peak 11346 weight 0.10000E+01 volume -0.37100E+00 ppm1 1.992 ppm2 2.995 OR {11346} (segid " " and resid "64 " and name "HB1 ") (segid " " and resid "64 " and name "HE2 ") ASSI {11347} (segid " " and resid "64 " and name "HB2 ") (segid " " and resid "64 " and name "HE1 ") 5.000 5.000 0.000 peak 11347 weight 0.10000E+01 volume -0.30400E+00 ppm1 1.886 ppm2 2.981 OR {11347} (segid " " and resid "64 " and name "HB2 ") (segid " " and resid "64 " and name "HE2 ") ASSI {11352} (segid " " and resid "64 " and name "HE2 ") (segid " " and resid "64 " and name "HD1 ") 3.300 3.300 0.000 peak 11352 weight 0.10000E+01 volume 0.31930E+01 ppm1 2.990 ppm2 1.701 OR {11352} (segid " " and resid "64 " and name "HE1 ") (segid " " and resid "64 " and name "HD2 ") OR {11352} (segid " " and resid "64 " and name "HE2 ") (segid " " and resid "64 " and name "HD2 ") OR {11352} (segid " " and resid "64 " and name "HE1 ") (segid " " and resid "64 " and name "HD1 ") ASSI {11353} (segid " " and resid "64 " and name "HE1 ") (segid " " and resid "64 " and name "HG2 ") 3.300 3.300 0.000 peak 11353 weight 0.10000E+01 volume 0.22890E+01 ppm1 2.989 ppm2 1.619 OR {11353} (segid " " and resid "64 " and name "HE2 ") (segid " " and resid "64 " and name "HG1 ") OR {11353} (segid " " and resid "64 " and name "HE2 ") (segid " " and resid "64 " and name "HG2 ") OR {11353} (segid " " and resid "64 " and name "HE1 ") (segid " " and resid "64 " and name "HG1 ") ASSI {11354} (segid " " and resid "64 " and name "HG2 ") (segid " " and resid "64 " and name "HB1 ") 3.300 3.300 0.000 peak 11354 weight 0.10000E+01 volume -0.29180E+01 ppm1 1.640 ppm2 2.000 OR {11354} (segid " " and resid "64 " and name "HG1 ") (segid " " and resid "64 " and name "HB1 ") ASSI {11355} (segid " " and resid "64 " and name "HG1 ") (segid " " and resid "64 " and name "HB2 ") 3.300 3.300 0.000 peak 11355 weight 0.10000E+01 volume -0.35000E+01 ppm1 1.637 ppm2 1.893 OR {11355} (segid " " and resid "64 " and name "HG2 ") (segid " " and resid "64 " and name "HB2 ") ASSI {11357} (segid " " and resid "65 " and name "HA ") (segid " " and resid "65 " and name "HB1 ") 5.000 5.000 0.000 peak 11357 weight 0.10000E+01 volume 0.12140E+01 ppm1 4.518 ppm2 2.176 ASSI {11358} (segid " " and resid "65 " and name "HA ") (segid " " and resid "65 " and name "HB2 ") 5.000 5.000 0.000 peak 11358 weight 0.10000E+01 volume 0.13530E+01 ppm1 4.509 ppm2 2.032 ASSI {11359} (segid " " and resid "65 " and name "HA ") (segid " " and resid "65 " and name "HG1 ") 5.000 5.000 0.000 peak 11359 weight 0.10000E+01 volume 0.42900E+00 ppm1 4.510 ppm2 2.576 ASSI {11360} (segid " " and resid "65 " and name "HA ") (segid " " and resid "65 " and name "HG2 ") 5.000 5.000 0.000 peak 11360 weight 0.10000E+01 volume 0.54100E+00 ppm1 4.504 ppm2 2.449 ASSI {11363} (segid " " and resid "65 " and name "HG1 ") (segid " " and resid "30 " and name "HB2 ") 5.000 5.000 0.000 peak 11363 weight 0.10000E+01 volume 0.39000E+00 ppm1 2.578 ppm2 1.004 ASSI {11364} (segid " " and resid "65 " and name "HG2 ") (segid " " and resid "30 " and name "HB2 ") 5.000 5.000 0.000 peak 11364 weight 0.10000E+01 volume 0.46400E+00 ppm1 2.443 ppm2 1.008 ASSI {11365} (segid " " and resid "65 " and name "HG1 ") (segid " " and resid "30 " and name "HD13") 5.000 5.000 0.000 peak 11365 weight 0.10000E+01 volume 0.44300E+00 ppm1 2.580 ppm2 0.668 OR {11365} (segid " " and resid "65 " and name "HG1 ") (segid " " and resid "30 " and name "HD11") OR {11365} (segid " " and resid "65 " and name "HG1 ") (segid " " and resid "30 " and name "HD12") ASSI {11366} (segid " " and resid "65 " and name "HG2 ") (segid " " and resid "30 " and name "HD12") 5.000 5.000 0.000 peak 11366 weight 0.10000E+01 volume 0.49800E+00 ppm1 2.450 ppm2 0.665 OR {11366} (segid " " and resid "65 " and name "HG2 ") (segid " " and resid "30 " and name "HD13") OR {11366} (segid " " and resid "65 " and name "HG2 ") (segid " " and resid "30 " and name "HD11") ASSI {11367} (segid " " and resid "65 " and name "HG1 ") (segid " " and resid "30 " and name "HD21") 5.000 5.000 0.000 peak 11367 weight 0.10000E+01 volume 0.53300E+00 ppm1 2.578 ppm2 0.771 OR {11367} (segid " " and resid "65 " and name "HG1 ") (segid " " and resid "30 " and name "HD23") OR {11367} (segid " " and resid "65 " and name "HG1 ") (segid " " and resid "30 " and name "HD22") ASSI {11368} (segid " " and resid "65 " and name "HG2 ") (segid " " and resid "30 " and name "HD21") 5.000 5.000 0.000 peak 11368 weight 0.10000E+01 volume 0.59400E+00 ppm1 2.450 ppm2 0.767 OR {11368} (segid " " and resid "65 " and name "HG2 ") (segid " " and resid "30 " and name "HD23") OR {11368} (segid " " and resid "65 " and name "HG2 ") (segid " " and resid "30 " and name "HD22") ASSI {11371} (segid " " and resid "65 " and name "HG1 ") (segid " " and resid "65 " and name "HB2 ") 5.000 5.000 0.000 peak 11371 weight 0.10000E+01 volume 0.10790E+01 ppm1 2.582 ppm2 2.029 ASSI {11372} (segid " " and resid "66 " and name "HA2 ") (segid " " and resid "66 " and name "HA1 ") 5.000 5.000 0.000 peak 11372 weight 0.10000E+01 volume 0.16920E+01 ppm1 3.776 ppm2 4.391 ASSI {11374} (segid " " and resid "67 " and name "HA ") (segid " " and resid "67 " and name "HB3 ") 3.300 3.300 0.000 peak 11374 weight 0.10000E+01 volume 0.28240E+01 ppm1 4.020 ppm2 1.129 OR {11374} (segid " " and resid "67 " and name "HA ") (segid " " and resid "67 " and name "HB1 ") OR {11374} (segid " " and resid "67 " and name "HA ") (segid " " and resid "67 " and name "HB2 ") ASSI {11375} (segid " " and resid "68 " and name "HA ") (segid " " and resid "68 " and name "HB1 ") 5.000 5.000 0.000 peak 11375 weight 0.10000E+01 volume 0.17500E+01 ppm1 4.767 ppm2 3.951 OR {11375} (segid " " and resid "68 " and name "HA ") (segid " " and resid "68 " and name "HB2 ") ASSI {11376} (segid " " and resid "68 " and name "HA ") (segid " " and resid "69 " and name "HD2 ") 3.300 3.300 0.000 peak 11376 weight 0.10000E+01 volume 0.27360E+01 ppm1 4.767 ppm2 4.099 OR {11376} (segid " " and resid "68 " and name "HA ") (segid " " and resid "69 " and name "HD1 ") ASSI {11378} (segid " " and resid "69 " and name "HA ") (segid " " and resid "69 " and name "HB2 ") 5.000 5.000 0.000 peak 11378 weight 0.10000E+01 volume -0.89800E+00 ppm1 4.410 ppm2 1.703 ASSI {11380} (segid " " and resid "69 " and name "HD1 ") (segid " " and resid "69 " and name "HA ") 6.000 6.000 0.000 peak 11380 weight 0.10000E+01 volume 0.21900E+00 ppm1 4.094 ppm2 4.413 OR {11380} (segid " " and resid "69 " and name "HD2 ") (segid " " and resid "69 " and name "HA ") ASSI {11381} (segid " " and resid "69 " and name "HD1 ") (segid " " and resid "69 " and name "HB1 ") 5.000 5.000 0.000 peak 11381 weight 0.10000E+01 volume 0.78700E+00 ppm1 4.094 ppm2 1.929 OR {11381} (segid " " and resid "69 " and name "HD2 ") (segid " " and resid "69 " and name "HB1 ") ASSI {11382} (segid " " and resid "69 " and name "HD2 ") (segid " " and resid "69 " and name "HB2 ") 5.000 5.000 0.000 peak 11382 weight 0.10000E+01 volume 0.34100E+00 ppm1 4.095 ppm2 1.708 OR {11382} (segid " " and resid "69 " and name "HD1 ") (segid " " and resid "69 " and name "HB2 ") ASSI {11383} (segid " " and resid "69 " and name "HD1 ") (segid " " and resid "69 " and name "HG1 ") 5.000 5.000 0.000 peak 11383 weight 0.10000E+01 volume 0.97800E+00 ppm1 4.101 ppm2 2.123 OR {11383} (segid " " and resid "69 " and name "HD2 ") (segid " " and resid "69 " and name "HG1 ") ASSI {11384} (segid " " and resid "69 " and name "HD2 ") (segid " " and resid "69 " and name "HG2 ") 5.000 5.000 0.000 peak 11384 weight 0.10000E+01 volume 0.77300E+00 ppm1 4.103 ppm2 1.835 OR {11384} (segid " " and resid "69 " and name "HD1 ") (segid " " and resid "69 " and name "HG2 ") ASSI {11385} (segid " " and resid "69 " and name "HG1 ") (segid " " and resid "69 " and name "HA ") 6.000 6.000 0.000 peak 11385 weight 0.10000E+01 volume -0.27100E+00 ppm1 2.127 ppm2 4.404 ASSI {11386} (segid " " and resid "69 " and name "HG2 ") (segid " " and resid "69 " and name "HA ") 6.000 6.000 0.000 peak 11386 weight 0.10000E+01 volume -0.23300E+00 ppm1 1.836 ppm2 4.408 ASSI {11387} (segid " " and resid "69 " and name "HG1 ") (segid " " and resid "69 " and name "HB2 ") 5.000 5.000 0.000 peak 11387 weight 0.10000E+01 volume -0.79700E+00 ppm1 2.123 ppm2 1.706 ASSI {11390} (segid " " and resid "69 " and name "HG2 ") (segid " " and resid "69 " and name "HG1 ") 5.000 5.000 0.000 peak 11390 weight 0.10000E+01 volume -0.13800E+01 ppm1 1.833 ppm2 2.127 ASSI {11392} (segid " " and resid "70 " and name "HA ") (segid " " and resid "70 " and name "HB1 ") 5.000 5.000 0.000 peak 11392 weight 0.10000E+01 volume 0.67200E+00 ppm1 5.143 ppm2 3.006 ASSI {11393} (segid " " and resid "70 " and name "HA ") (segid " " and resid "70 " and name "HB2 ") 5.000 5.000 0.000 peak 11393 weight 0.10000E+01 volume 0.56600E+00 ppm1 5.147 ppm2 2.796 ASSI {11396} (segid " " and resid "70 " and name "HB2 ") (segid " " and resid "70 " and name "HB1 ") 5.000 5.000 0.000 peak 11396 weight 0.10000E+01 volume 0.16620E+01 ppm1 2.794 ppm2 3.007 ASSI {11398} (segid " " and resid "71 " and name "HA ") (segid " " and resid "71 " and name "HB ") 3.300 3.300 0.000 peak 11398 weight 0.10000E+01 volume -0.28140E+01 ppm1 4.335 ppm2 2.054 ASSI {11399} (segid " " and resid "71 " and name "HA ") (segid " " and resid "71 " and name "HG12") 3.300 3.300 0.000 peak 11399 weight 0.10000E+01 volume -0.31290E+01 ppm1 4.337 ppm2 0.928 OR {11399} (segid " " and resid "71 " and name "HA ") (segid " " and resid "71 " and name "HG11") OR {11399} (segid " " and resid "71 " and name "HA ") (segid " " and resid "71 " and name "HG13") ASSI {11400} (segid " " and resid "71 " and name "HA ") (segid " " and resid "71 " and name "HG22") 3.300 3.300 0.000 peak 11400 weight 0.10000E+01 volume -0.22040E+01 ppm1 4.335 ppm2 0.847 OR {11400} (segid " " and resid "71 " and name "HA ") (segid " " and resid "71 " and name "HG21") OR {11400} (segid " " and resid "71 " and name "HA ") (segid " " and resid "71 " and name "HG23") ASSI {11403} (segid " " and resid "71 " and name "HB ") (segid " " and resid "71 " and name "HG21") 3.300 3.300 0.000 peak 11403 weight 0.10000E+01 volume 0.31160E+01 ppm1 2.051 ppm2 0.846 OR {11403} (segid " " and resid "71 " and name "HB ") (segid " " and resid "71 " and name "HG23") OR {11403} (segid " " and resid "71 " and name "HB ") (segid " " and resid "71 " and name "HG22") ASSI {11404} (segid " " and resid "71 " and name "HG12") (segid " " and resid "70 " and name "HA ") 6.000 6.000 0.000 peak 11404 weight 0.10000E+01 volume -0.11900E+00 ppm1 0.926 ppm2 5.142 OR {11404} (segid " " and resid "71 " and name "HG13") (segid " " and resid "70 " and name "HA ") OR {11404} (segid " " and resid "71 " and name "HG11") (segid " " and resid "70 " and name "HA ") ASSI {11406} (segid " " and resid "71 " and name "HG12") (segid " " and resid "71 " and name "HB ") 2.700 2.700 0.000 peak 11406 weight 0.10000E+01 volume -0.56130E+01 ppm1 0.926 ppm2 2.047 OR {11406} (segid " " and resid "71 " and name "HG13") (segid " " and resid "71 " and name "HB ") OR {11406} (segid " " and resid "71 " and name "HG11") (segid " " and resid "71 " and name "HB ") ASSI {11407} (segid " " and resid "71 " and name "HG13") (segid " " and resid "72 " and name "HA ") 6.000 6.000 0.000 peak 11407 weight 0.10000E+01 volume -0.17800E+00 ppm1 0.923 ppm2 4.994 OR {11407} (segid " " and resid "71 " and name "HG12") (segid " " and resid "72 " and name "HA ") OR {11407} (segid " " and resid "71 " and name "HG11") (segid " " and resid "72 " and name "HA ") ASSI {11408} (segid " " and resid "71 " and name "HG12") (segid " " and resid "78 " and name "HA ") 6.000 6.000 0.000 peak 11408 weight 0.10000E+01 volume 0.21000E-01 ppm1 0.930 ppm2 5.862 OR {11408} (segid " " and resid "71 " and name "HG13") (segid " " and resid "78 " and name "HA ") OR {11408} (segid " " and resid "71 " and name "HG11") (segid " " and resid "78 " and name "HA ") ASSI {11409} (segid " " and resid "71 " and name "HG23") (segid " " and resid "70 " and name "HA ") 6.000 6.000 0.000 peak 11409 weight 0.10000E+01 volume -0.86000E-01 ppm1 0.846 ppm2 5.142 OR {11409} (segid " " and resid "71 " and name "HG22") (segid " " and resid "70 " and name "HA ") OR {11409} (segid " " and resid "71 " and name "HG21") (segid " " and resid "70 " and name "HA ") ASSI {11412} (segid " " and resid "71 " and name "HG21") (segid " " and resid "72 " and name "HA ") 6.000 6.000 0.000 peak 11412 weight 0.10000E+01 volume -0.15400E+00 ppm1 0.846 ppm2 4.990 OR {11412} (segid " " and resid "71 " and name "HG22") (segid " " and resid "72 " and name "HA ") OR {11412} (segid " " and resid "71 " and name "HG23") (segid " " and resid "72 " and name "HA ") ASSI {11413} (segid " " and resid "71 " and name "HG23") (segid " " and resid "78 " and name "HA ") 6.000 6.000 0.000 peak 11413 weight 0.10000E+01 volume -0.25300E+00 ppm1 0.846 ppm2 5.854 OR {11413} (segid " " and resid "71 " and name "HG22") (segid " " and resid "78 " and name "HA ") OR {11413} (segid " " and resid "71 " and name "HG21") (segid " " and resid "78 " and name "HA ") ASSI {11414} (segid " " and resid "71 " and name "HG23") (segid " " and resid "78 " and name "HB1 ") 5.000 5.000 0.000 peak 11414 weight 0.10000E+01 volume -0.42900E+00 ppm1 0.849 ppm2 4.441 OR {11414} (segid " " and resid "71 " and name "HG22") (segid " " and resid "78 " and name "HB1 ") OR {11414} (segid " " and resid "71 " and name "HG21") (segid " " and resid "78 " and name "HB1 ") ASSI {11416} (segid " " and resid "72 " and name "HA ") (segid " " and resid "72 " and name "HB1 ") 5.000 5.000 0.000 peak 11416 weight 0.10000E+01 volume 0.11320E+01 ppm1 5.000 ppm2 1.976 ASSI {11417} (segid " " and resid "72 " and name "HA ") (segid " " and resid "72 " and name "HB2 ") 5.000 5.000 0.000 peak 11417 weight 0.10000E+01 volume 0.76400E+00 ppm1 4.998 ppm2 1.834 ASSI {11418} (segid " " and resid "72 " and name "HA ") (segid " " and resid "72 " and name "HG1 ") 5.000 5.000 0.000 peak 11418 weight 0.10000E+01 volume 0.12370E+01 ppm1 5.003 ppm2 2.249 OR {11418} (segid " " and resid "72 " and name "HA ") (segid " " and resid "72 " and name "HG2 ") ASSI {11419} (segid " " and resid "72 " and name "HA ") (segid " " and resid "78 " and name "HA ") 5.000 5.000 0.000 peak 11419 weight 0.10000E+01 volume 0.54900E+00 ppm1 4.998 ppm2 5.861 ASSI {11422} (segid " " and resid "72 " and name "HB2 ") (segid " " and resid "72 " and name "HB1 ") 3.300 3.300 0.000 peak 11422 weight 0.10000E+01 volume 0.37590E+01 ppm1 1.830 ppm2 1.971 ASSI {11423} (segid " " and resid "72 " and name "HB1 ") (segid " " and resid "72 " and name "HG2 ") 3.300 3.300 0.000 peak 11423 weight 0.10000E+01 volume 0.22440E+01 ppm1 1.968 ppm2 2.244 OR {11423} (segid " " and resid "72 " and name "HB1 ") (segid " " and resid "72 " and name "HG1 ") ASSI {11424} (segid " " and resid "72 " and name "HB2 ") (segid " " and resid "72 " and name "HG1 ") 5.000 5.000 0.000 peak 11424 weight 0.10000E+01 volume 0.15240E+01 ppm1 1.827 ppm2 2.244 OR {11424} (segid " " and resid "72 " and name "HB2 ") (segid " " and resid "72 " and name "HG2 ") ASSI {11426} (segid " " and resid "72 " and name "HG2 ") (segid " " and resid "78 " and name "HA ") 6.000 6.000 0.000 peak 11426 weight 0.10000E+01 volume 0.16100E+00 ppm1 2.246 ppm2 5.856 OR {11426} (segid " " and resid "72 " and name "HG1 ") (segid " " and resid "78 " and name "HA ") ASSI {11427} (segid " " and resid "72 " and name "HG2 ") (segid " " and resid "78 " and name "HB1 ") 5.000 5.000 0.000 peak 11427 weight 0.10000E+01 volume 0.99400E+00 ppm1 2.247 ppm2 4.475 OR {11427} (segid " " and resid "72 " and name "HG1 ") (segid " " and resid "78 " and name "HB1 ") ASSI {11428} (segid " " and resid "72 " and name "HG2 ") (segid " " and resid "78 " and name "HB2 ") 5.000 5.000 0.000 peak 11428 weight 0.10000E+01 volume 0.80600E+00 ppm1 2.244 ppm2 4.299 OR {11428} (segid " " and resid "72 " and name "HG1 ") (segid " " and resid "78 " and name "HB2 ") ASSI {11429} (segid " " and resid "73 " and name "HA ") (segid " " and resid "73 " and name "HB1 ") 5.000 5.000 0.000 peak 11429 weight 0.10000E+01 volume 0.12180E+01 ppm1 4.913 ppm2 3.514 ASSI {11430} (segid " " and resid "73 " and name "HA ") (segid " " and resid "73 " and name "HB2 ") 5.000 5.000 0.000 peak 11430 weight 0.10000E+01 volume 0.11440E+01 ppm1 4.921 ppm2 2.658 ASSI {11433} (segid " " and resid "73 " and name "HB2 ") (segid " " and resid "73 " and name "HB1 ") 5.000 5.000 0.000 peak 11433 weight 0.10000E+01 volume 0.10960E+01 ppm1 2.653 ppm2 3.525 ASSI {11435} (segid " " and resid "75 " and name "HA ") (segid " " and resid "75 " and name "HB1 ") 3.300 3.300 0.000 peak 11435 weight 0.10000E+01 volume 0.28650E+01 ppm1 4.661 ppm2 4.097 ASSI {11436} (segid " " and resid "75 " and name "HA ") (segid " " and resid "75 " and name "HB2 ") 3.300 3.300 0.000 peak 11436 weight 0.10000E+01 volume 0.32230E+01 ppm1 4.661 ppm2 4.017 ASSI {11439} (segid " " and resid "76 " and name "HA2 ") (segid " " and resid "76 " and name "HA1 ") 3.300 3.300 0.000 peak 11439 weight 0.10000E+01 volume 0.20190E+01 ppm1 3.780 ppm2 4.224 ASSI {11441} (segid " " and resid "77 " and name "HA ") (segid " " and resid "77 " and name "HB ") 5.000 5.000 0.000 peak 11441 weight 0.10000E+01 volume -0.82000E+00 ppm1 3.778 ppm2 4.250 ASSI {11445} (segid " " and resid "77 " and name "HG23") (segid " " and resid "77 " and name "HA ") 2.700 2.700 0.000 peak 11445 weight 0.10000E+01 volume -0.46680E+01 ppm1 1.246 ppm2 3.781 OR {11445} (segid " " and resid "77 " and name "HG21") (segid " " and resid "77 " and name "HA ") OR {11445} (segid " " and resid "77 " and name "HG22") (segid " " and resid "77 " and name "HA ") ASSI {11446} (segid " " and resid "77 " and name "HG22") (segid " " and resid "77 " and name "HB ") 2.700 2.700 0.000 peak 11446 weight 0.10000E+01 volume -0.48250E+01 ppm1 1.246 ppm2 4.235 OR {11446} (segid " " and resid "77 " and name "HG21") (segid " " and resid "77 " and name "HB ") OR {11446} (segid " " and resid "77 " and name "HG23") (segid " " and resid "77 " and name "HB ") ASSI {11449} (segid " " and resid "78 " and name "HA ") (segid " " and resid "78 " and name "HB2 ") 5.000 5.000 0.000 peak 11449 weight 0.10000E+01 volume 0.12030E+01 ppm1 5.862 ppm2 4.297 ASSI {11450} (segid " " and resid "78 " and name "HB1 ") (segid " " and resid "78 " and name "HA ") 5.000 5.000 0.000 peak 11450 weight 0.10000E+01 volume -0.51700E+00 ppm1 4.448 ppm2 5.863 ASSI {11453} (segid " " and resid "78 " and name "HB1 ") (segid " " and resid "78 " and name "HB2 ") 3.300 3.300 0.000 peak 11453 weight 0.10000E+01 volume -0.28630E+01 ppm1 4.448 ppm2 4.288 ASSI {11454} (segid " " and resid "79 " and name "HA ") (segid " " and resid "79 " and name "HB1 ") 5.000 5.000 0.000 peak 11454 weight 0.10000E+01 volume -0.86700E+00 ppm1 4.742 ppm2 2.447 ASSI {11455} (segid " " and resid "79 " and name "HA ") (segid " " and resid "79 " and name "HB2 ") 5.000 5.000 0.000 peak 11455 weight 0.10000E+01 volume -0.13910E+01 ppm1 4.742 ppm2 1.967 ASSI {11458} (segid " " and resid "79 " and name "HB2 ") (segid " " and resid "79 " and name "HB1 ") 5.000 5.000 0.000 peak 11458 weight 0.10000E+01 volume -0.15440E+01 ppm1 1.967 ppm2 2.447 ASSI {11460} (segid " " and resid "80 " and name "HA ") (segid " " and resid "80 " and name "HB ") 5.000 5.000 0.000 peak 11460 weight 0.10000E+01 volume -0.14450E+01 ppm1 3.684 ppm2 1.913 ASSI {11462} (segid " " and resid "80 " and name "HG23") (segid " " and resid "80 " and name "HA ") 3.300 3.300 0.000 peak 11462 weight 0.10000E+01 volume -0.31420E+01 ppm1 0.830 ppm2 3.685 OR {11462} (segid " " and resid "80 " and name "HG22") (segid " " and resid "80 " and name "HA ") OR {11462} (segid " " and resid "80 " and name "HG21") (segid " " and resid "80 " and name "HA ") ASSI {11463} (segid " " and resid "80 " and name "HG21") (segid " " and resid "80 " and name "HB ") 2.700 2.700 0.000 peak 11463 weight 0.10000E+01 volume -0.50770E+01 ppm1 0.828 ppm2 1.914 OR {11463} (segid " " and resid "80 " and name "HG23") (segid " " and resid "80 " and name "HB ") OR {11463} (segid " " and resid "80 " and name "HG22") (segid " " and resid "80 " and name "HB ") ASSI {11464} (segid " " and resid "81 " and name "HA ") (segid " " and resid "81 " and name "HB2 ") 5.000 5.000 0.000 peak 11464 weight 0.10000E+01 volume -0.82200E+00 ppm1 3.888 ppm2 3.271 ASSI {11465} (segid " " and resid "81 " and name "HA ") (segid " " and resid "81 " and name "HD2 ") 6.000 6.000 0.000 peak 11465 weight 0.10000E+01 volume -0.29900E+00 ppm1 3.893 ppm2 6.514 ASSI {11466} (segid " " and resid "81 " and name "HB2 ") (segid " " and resid "81 " and name "HB1 ") 5.000 5.000 0.000 peak 11466 weight 0.10000E+01 volume -0.74900E+00 ppm1 3.274 ppm2 3.771 ASSI {11468} (segid " " and resid "81 " and name "HB1 ") (segid " " and resid "81 " and name "HD2 ") 6.000 6.000 0.000 peak 11468 weight 0.10000E+01 volume -0.16900E+00 ppm1 3.768 ppm2 6.516 ASSI {11473} (segid " " and resid "81 " and name "HD2 ") (segid " " and resid "115 " and name "HD12") 5.000 5.000 0.000 peak 11473 weight 0.10000E+01 volume -0.12120E+01 ppm1 6.530 ppm2 1.225 OR {11473} (segid " " and resid "81 " and name "HD2 ") (segid " " and resid "115 " and name "HD13") OR {11473} (segid " " and resid "81 " and name "HD2 ") (segid " " and resid "115 " and name "HD11") ASSI {11474} (segid " " and resid "81 " and name "HD2 ") (segid " " and resid "115 " and name "HD21") 6.000 6.000 0.000 peak 11474 weight 0.10000E+01 volume -0.97000E-01 ppm1 6.530 ppm2 0.969 OR {11474} (segid " " and resid "81 " and name "HD2 ") (segid " " and resid "115 " and name "HD22") OR {11474} (segid " " and resid "81 " and name "HD2 ") (segid " " and resid "115 " and name "HD23") ASSI {11475} (segid " " and resid "81 " and name "HD2 ") (segid " " and resid "115 " and name "HG ") 6.000 6.000 0.000 peak 11475 weight 0.10000E+01 volume -0.89000E-01 ppm1 6.529 ppm2 2.029 ASSI {11476} (segid " " and resid "81 " and name "HE1 ") (segid " " and resid "104 " and name "HB1 ") 5.000 5.000 0.000 peak 11476 weight 0.10000E+01 volume -0.15840E+01 ppm1 7.454 ppm2 1.326 OR {11476} (segid " " and resid "81 " and name "HE1 ") (segid " " and resid "104 " and name "HB3 ") OR {11476} (segid " " and resid "81 " and name "HE1 ") (segid " " and resid "104 " and name "HB2 ") ASSI {11477} (segid " " and resid "82 " and name "HA ") (segid " " and resid "82 " and name "HB1 ") 5.000 5.000 0.000 peak 11477 weight 0.10000E+01 volume 0.11280E+01 ppm1 4.448 ppm2 2.297 ASSI {11478} (segid " " and resid "82 " and name "HA ") (segid " " and resid "82 " and name "HB2 ") 5.000 5.000 0.000 peak 11478 weight 0.10000E+01 volume 0.18080E+01 ppm1 4.445 ppm2 1.951 ASSI {11481} (segid " " and resid "82 " and name "HB2 ") (segid " " and resid "82 " and name "HB1 ") 5.000 5.000 0.000 peak 11481 weight 0.10000E+01 volume 0.15780E+01 ppm1 1.956 ppm2 2.289 ASSI {11483} (segid " " and resid "84 " and name "HA ") (segid " " and resid "84 " and name "HB2 ") 2.700 2.700 0.000 peak 11483 weight 0.10000E+01 volume 0.48570E+01 ppm1 4.001 ppm2 1.453 OR {11483} (segid " " and resid "84 " and name "HA ") (segid " " and resid "84 " and name "HB3 ") OR {11483} (segid " " and resid "84 " and name "HA ") (segid " " and resid "84 " and name "HB1 ") ASSI {11485} (segid " " and resid "85 " and name "HA ") (segid " " and resid "85 " and name "HB1 ") 5.000 5.000 0.000 peak 11485 weight 0.10000E+01 volume 0.18080E+01 ppm1 3.752 ppm2 2.054 OR {11485} (segid " " and resid "85 " and name "HA ") (segid " " and resid "85 " and name "HB2 ") ASSI {11487} (segid " " and resid "86 " and name "HA ") (segid " " and resid "86 " and name "HG22") 3.300 3.300 0.000 peak 11487 weight 0.10000E+01 volume -0.29430E+01 ppm1 4.332 ppm2 1.331 OR {11487} (segid " " and resid "86 " and name "HA ") (segid " " and resid "86 " and name "HG21") OR {11487} (segid " " and resid "86 " and name "HA ") (segid " " and resid "86 " and name "HG23") ASSI {11488} (segid " " and resid "86 " and name "HB ") (segid " " and resid "86 " and name "HG23") 3.300 3.300 0.000 peak 11488 weight 0.10000E+01 volume -0.22410E+01 ppm1 4.368 ppm2 1.334 OR {11488} (segid " " and resid "86 " and name "HB ") (segid " " and resid "86 " and name "HG21") OR {11488} (segid " " and resid "86 " and name "HB ") (segid " " and resid "86 " and name "HG22") ASSI {11489} (segid " " and resid "87 " and name "HA2 ") (segid " " and resid "87 " and name "HA1 ") 5.000 5.000 0.000 peak 11489 weight 0.10000E+01 volume 0.17700E+01 ppm1 2.570 ppm2 2.765 ASSI {11491} (segid " " and resid "88 " and name "HA ") (segid " " and resid "88 " and name "HB1 ") 5.000 5.000 0.000 peak 11491 weight 0.10000E+01 volume 0.90300E+00 ppm1 4.658 ppm2 3.445 ASSI {11492} (segid " " and resid "88 " and name "HA ") (segid " " and resid "88 " and name "HB2 ") 5.000 5.000 0.000 peak 11492 weight 0.10000E+01 volume 0.13540E+01 ppm1 4.660 ppm2 2.541 ASSI {11493} (segid " " and resid "88 " and name "HA ") (segid " " and resid "88 " and name "HD2 ") 5.000 5.000 0.000 peak 11493 weight 0.10000E+01 volume 0.10220E+01 ppm1 4.663 ppm2 7.437 OR {11493} (segid " " and resid "88 " and name "HA ") (segid " " and resid "88 " and name "HD1 ") ASSI {11496} (segid " " and resid "88 " and name "HB2 ") (segid " " and resid "88 " and name "HB1 ") 5.000 5.000 0.000 peak 11496 weight 0.10000E+01 volume 0.59000E+00 ppm1 2.533 ppm2 3.434 ASSI {11498} (segid " " and resid "88 " and name "HB1 ") (segid " " and resid "88 " and name "HD2 ") 6.000 6.000 0.000 peak 11498 weight 0.10000E+01 volume 0.24600E+00 ppm1 3.452 ppm2 7.435 OR {11498} (segid " " and resid "88 " and name "HB1 ") (segid " " and resid "88 " and name "HD1 ") ASSI {11499} (segid " " and resid "88 " and name "HB2 ") (segid " " and resid "88 " and name "HD1 ") 6.000 6.000 0.000 peak 11499 weight 0.10000E+01 volume 0.27200E+00 ppm1 2.535 ppm2 7.441 OR {11499} (segid " " and resid "88 " and name "HB2 ") (segid " " and resid "88 " and name "HD2 ") ASSI {11503} (segid " " and resid "89 " and name "HA ") (segid " " and resid "89 " and name "HB1 ") 5.000 5.000 0.000 peak 11503 weight 0.10000E+01 volume 0.91300E+00 ppm1 3.725 ppm2 1.827 ASSI {11504} (segid " " and resid "89 " and name "HA ") (segid " " and resid "89 " and name "HD23") 3.300 3.300 0.000 peak 11504 weight 0.10000E+01 volume 0.26440E+01 ppm1 3.716 ppm2 0.605 OR {11504} (segid " " and resid "89 " and name "HA ") (segid " " and resid "89 " and name "HD21") OR {11504} (segid " " and resid "89 " and name "HA ") (segid " " and resid "89 " and name "HD22") ASSI {11505} (segid " " and resid "89 " and name "HA ") (segid " " and resid "89 " and name "HG ") 5.000 5.000 0.000 peak 11505 weight 0.10000E+01 volume 0.13900E+01 ppm1 3.712 ppm2 1.283 ASSI {11507} (segid " " and resid "89 " and name "HB2 ") (segid " " and resid "89 " and name "HA ") 5.000 5.000 0.000 peak 11507 weight 0.10000E+01 volume 0.50300E+00 ppm1 1.237 ppm2 3.728 ASSI {11508} (segid " " and resid "89 " and name "HB2 ") (segid " " and resid "89 " and name "HB1 ") 5.000 5.000 0.000 peak 11508 weight 0.10000E+01 volume 0.16440E+01 ppm1 1.228 ppm2 1.817 ASSI {11509} (segid " " and resid "89 " and name "HB1 ") (segid " " and resid "89 " and name "HD11") 5.000 5.000 0.000 peak 11509 weight 0.10000E+01 volume 0.18530E+01 ppm1 1.825 ppm2 0.820 OR {11509} (segid " " and resid "89 " and name "HB1 ") (segid " " and resid "89 " and name "HD12") OR {11509} (segid " " and resid "89 " and name "HB1 ") (segid " " and resid "89 " and name "HD13") ASSI {11510} (segid " " and resid "89 " and name "HB2 ") (segid " " and resid "89 " and name "HD11") 5.000 5.000 0.000 peak 11510 weight 0.10000E+01 volume 0.10390E+01 ppm1 1.233 ppm2 0.823 OR {11510} (segid " " and resid "89 " and name "HB2 ") (segid " " and resid "89 " and name "HD12") OR {11510} (segid " " and resid "89 " and name "HB2 ") (segid " " and resid "89 " and name "HD13") ASSI {11511} (segid " " and resid "89 " and name "HB1 ") (segid " " and resid "89 " and name "HD23") 5.000 5.000 0.000 peak 11511 weight 0.10000E+01 volume 0.81300E+00 ppm1 1.822 ppm2 0.609 OR {11511} (segid " " and resid "89 " and name "HB1 ") (segid " " and resid "89 " and name "HD21") OR {11511} (segid " " and resid "89 " and name "HB1 ") (segid " " and resid "89 " and name "HD22") ASSI {11512} (segid " " and resid "89 " and name "HB2 ") (segid " " and resid "89 " and name "HD22") 5.000 5.000 0.000 peak 11512 weight 0.10000E+01 volume 0.77700E+00 ppm1 1.235 ppm2 0.604 OR {11512} (segid " " and resid "89 " and name "HB2 ") (segid " " and resid "89 " and name "HD23") OR {11512} (segid " " and resid "89 " and name "HB2 ") (segid " " and resid "89 " and name "HD21") ASSI {11513} (segid " " and resid "89 " and name "HD13") (segid " " and resid "89 " and name "HD21") 2.700 2.700 0.000 peak 11513 weight 0.10000E+01 volume -0.70620E+01 ppm1 0.819 ppm2 0.605 OR {11513} (segid " " and resid "89 " and name "HD11") (segid " " and resid "89 " and name "HD21") OR {11513} (segid " " and resid "89 " and name "HD13") (segid " " and resid "89 " and name "HD22") OR {11513} (segid " " and resid "89 " and name "HD11") (segid " " and resid "89 " and name "HD23") OR {11513} (segid " " and resid "89 " and name "HD11") (segid " " and resid "89 " and name "HD22") OR {11513} (segid " " and resid "89 " and name "HD12") (segid " " and resid "89 " and name "HD22") OR {11513} (segid " " and resid "89 " and name "HD12") (segid " " and resid "89 " and name "HD23") OR {11513} (segid " " and resid "89 " and name "HD13") (segid " " and resid "89 " and name "HD23") OR {11513} (segid " " and resid "89 " and name "HD12") (segid " " and resid "89 " and name "HD21") ASSI {11514} (segid " " and resid "89 " and name "HD13") (segid " " and resid "89 " and name "HG ") 2.700 2.700 0.000 peak 11514 weight 0.10000E+01 volume -0.72340E+01 ppm1 0.819 ppm2 1.299 OR {11514} (segid " " and resid "89 " and name "HD12") (segid " " and resid "89 " and name "HG ") OR {11514} (segid " " and resid "89 " and name "HD11") (segid " " and resid "89 " and name "HG ") ASSI {11517} (segid " " and resid "89 " and name "HD22") (segid " " and resid "89 " and name "HG ") 3.300 3.300 0.000 peak 11517 weight 0.10000E+01 volume -0.33820E+01 ppm1 0.605 ppm2 1.299 OR {11517} (segid " " and resid "89 " and name "HD21") (segid " " and resid "89 " and name "HG ") OR {11517} (segid " " and resid "89 " and name "HD23") (segid " " and resid "89 " and name "HG ") ASSI {11518} (segid " " and resid "89 " and name "HD21") (segid " " and resid "92 " and name "HB1 ") 5.000 5.000 0.000 peak 11518 weight 0.10000E+01 volume -0.61600E+00 ppm1 0.605 ppm2 2.073 OR {11518} (segid " " and resid "89 " and name "HD22") (segid " " and resid "92 " and name "HB1 ") OR {11518} (segid " " and resid "89 " and name "HD23") (segid " " and resid "92 " and name "HB1 ") ASSI {11519} (segid " " and resid "89 " and name "HD22") (segid " " and resid "127 " and name "HA ") 5.000 5.000 0.000 peak 11519 weight 0.10000E+01 volume -0.13020E+01 ppm1 0.606 ppm2 4.300 OR {11519} (segid " " and resid "89 " and name "HD21") (segid " " and resid "127 " and name "HA ") OR {11519} (segid " " and resid "89 " and name "HD23") (segid " " and resid "127 " and name "HA ") ASSI {11520} (segid " " and resid "89 " and name "HD21") (segid " " and resid "127 " and name "HB1 ") 5.000 5.000 0.000 peak 11520 weight 0.10000E+01 volume -0.76200E+00 ppm1 0.605 ppm2 3.415 OR {11520} (segid " " and resid "89 " and name "HD22") (segid " " and resid "127 " and name "HB1 ") OR {11520} (segid " " and resid "89 " and name "HD23") (segid " " and resid "127 " and name "HB1 ") ASSI {11521} (segid " " and resid "89 " and name "HD22") (segid " " and resid "127 " and name "HB2 ") 5.000 5.000 0.000 peak 11521 weight 0.10000E+01 volume -0.59000E+00 ppm1 0.604 ppm2 2.948 OR {11521} (segid " " and resid "89 " and name "HD21") (segid " " and resid "127 " and name "HB2 ") OR {11521} (segid " " and resid "89 " and name "HD23") (segid " " and resid "127 " and name "HB2 ") ASSI {11522} (segid " " and resid "89 " and name "HD23") (segid " " and resid "127 " and name "HD1 ") 5.000 5.000 0.000 peak 11522 weight 0.10000E+01 volume -0.48800E+00 ppm1 0.605 ppm2 7.120 OR {11522} (segid " " and resid "89 " and name "HD21") (segid " " and resid "127 " and name "HD1 ") OR {11522} (segid " " and resid "89 " and name "HD22") (segid " " and resid "127 " and name "HD1 ") OR {11522} (segid " " and resid "89 " and name "HD22") (segid " " and resid "127 " and name "HD2 ") OR {11522} (segid " " and resid "89 " and name "HD23") (segid " " and resid "127 " and name "HD2 ") OR {11522} (segid " " and resid "89 " and name "HD21") (segid " " and resid "127 " and name "HD2 ") ASSI {11523} (segid " " and resid "89 " and name "HD23") (segid " " and resid "127 " and name "HE1 ") 6.000 6.000 0.000 peak 11523 weight 0.10000E+01 volume -0.22300E+00 ppm1 0.608 ppm2 7.226 OR {11523} (segid " " and resid "89 " and name "HD21") (segid " " and resid "127 " and name "HE1 ") OR {11523} (segid " " and resid "89 " and name "HD22") (segid " " and resid "127 " and name "HE1 ") OR {11523} (segid " " and resid "89 " and name "HD22") (segid " " and resid "127 " and name "HE2 ") OR {11523} (segid " " and resid "89 " and name "HD23") (segid " " and resid "127 " and name "HE2 ") OR {11523} (segid " " and resid "89 " and name "HD21") (segid " " and resid "127 " and name "HE2 ") ASSI {11526} (segid " " and resid "90 " and name "HA ") (segid " " and resid "90 " and name "HB1 ") 5.000 5.000 0.000 peak 11526 weight 0.10000E+01 volume 0.15490E+01 ppm1 4.257 ppm2 2.751 ASSI {11527} (segid " " and resid "90 " and name "HA ") (segid " " and resid "90 " and name "HB2 ") 5.000 5.000 0.000 peak 11527 weight 0.10000E+01 volume 0.19080E+01 ppm1 4.257 ppm2 2.578 ASSI {11532} (segid " " and resid "90 " and name "HB2 ") (segid " " and resid "90 " and name "HB1 ") 3.300 3.300 0.000 peak 11532 weight 0.10000E+01 volume 0.26780E+01 ppm1 2.576 ppm2 2.751 ASSI {11534} (segid " " and resid "91 " and name "HA ") (segid " " and resid "91 " and name "HB ") 5.000 5.000 0.000 peak 11534 weight 0.10000E+01 volume -0.57500E+00 ppm1 3.762 ppm2 4.205 ASSI {11535} (segid " " and resid "91 " and name "HA ") (segid " " and resid "91 " and name "HG21") 3.300 3.300 0.000 peak 11535 weight 0.10000E+01 volume -0.32490E+01 ppm1 3.758 ppm2 1.138 OR {11535} (segid " " and resid "91 " and name "HA ") (segid " " and resid "91 " and name "HG23") OR {11535} (segid " " and resid "91 " and name "HA ") (segid " " and resid "91 " and name "HG22") ASSI {11537} (segid " " and resid "91 " and name "HB ") (segid " " and resid "91 " and name "HG21") 3.300 3.300 0.000 peak 11537 weight 0.10000E+01 volume -0.21200E+01 ppm1 4.208 ppm2 1.139 OR {11537} (segid " " and resid "91 " and name "HB ") (segid " " and resid "91 " and name "HG23") OR {11537} (segid " " and resid "91 " and name "HB ") (segid " " and resid "91 " and name "HG22") ASSI {11540} (segid " " and resid "92 " and name "HB1 ") (segid " " and resid "92 " and name "HA ") 5.000 5.000 0.000 peak 11540 weight 0.10000E+01 volume 0.54500E+00 ppm1 2.077 ppm2 3.881 ASSI {11541} (segid " " and resid "92 " and name "HB2 ") (segid " " and resid "92 " and name "HA ") 5.000 5.000 0.000 peak 11541 weight 0.10000E+01 volume 0.90300E+00 ppm1 1.381 ppm2 3.879 ASSI {11543} (segid " " and resid "92 " and name "HB1 ") (segid " " and resid "92 " and name "HB2 ") 3.300 3.300 0.000 peak 11543 weight 0.10000E+01 volume 0.23710E+01 ppm1 2.081 ppm2 1.380 ASSI {11544} (segid " " and resid "92 " and name "HD12") (segid " " and resid "92 " and name "HA ") 5.000 5.000 0.000 peak 11544 weight 0.10000E+01 volume -0.12560E+01 ppm1 0.951 ppm2 3.872 OR {11544} (segid " " and resid "92 " and name "HD13") (segid " " and resid "92 " and name "HA ") OR {11544} (segid " " and resid "92 " and name "HD11") (segid " " and resid "92 " and name "HA ") ASSI {11545} (segid " " and resid "92 " and name "HD13") (segid " " and resid "92 " and name "HB1 ") 3.300 3.300 0.000 peak 11545 weight 0.10000E+01 volume -0.26050E+01 ppm1 0.961 ppm2 2.074 OR {11545} (segid " " and resid "92 " and name "HD11") (segid " " and resid "92 " and name "HB1 ") OR {11545} (segid " " and resid "92 " and name "HD12") (segid " " and resid "92 " and name "HB1 ") ASSI {11546} (segid " " and resid "92 " and name "HD11") (segid " " and resid "92 " and name "HG ") 5.000 5.000 0.000 peak 11546 weight 0.10000E+01 volume -0.18380E+01 ppm1 0.958 ppm2 1.627 OR {11546} (segid " " and resid "92 " and name "HD13") (segid " " and resid "92 " and name "HG ") OR {11546} (segid " " and resid "92 " and name "HD12") (segid " " and resid "92 " and name "HG ") ASSI {11547} (segid " " and resid "92 " and name "HD21") (segid " " and resid "92 " and name "HA ") 3.300 3.300 0.000 peak 11547 weight 0.10000E+01 volume -0.32230E+01 ppm1 1.010 ppm2 3.874 OR {11547} (segid " " and resid "92 " and name "HD22") (segid " " and resid "92 " and name "HA ") OR {11547} (segid " " and resid "92 " and name "HD23") (segid " " and resid "92 " and name "HA ") ASSI {11548} (segid " " and resid "92 " and name "HD21") (segid " " and resid "92 " and name "HB1 ") 3.300 3.300 0.000 peak 11548 weight 0.10000E+01 volume -0.22640E+01 ppm1 1.006 ppm2 2.078 OR {11548} (segid " " and resid "92 " and name "HD22") (segid " " and resid "92 " and name "HB1 ") OR {11548} (segid " " and resid "92 " and name "HD23") (segid " " and resid "92 " and name "HB1 ") ASSI {11549} (segid " " and resid "92 " and name "HG ") (segid " " and resid "92 " and name "HA ") 5.000 5.000 0.000 peak 11549 weight 0.10000E+01 volume -0.15730E+01 ppm1 1.625 ppm2 3.887 ASSI {11550} (segid " " and resid "93 " and name "HA ") (segid " " and resid "93 " and name "HB1 ") 5.000 5.000 0.000 peak 11550 weight 0.10000E+01 volume -0.16820E+01 ppm1 3.701 ppm2 1.753 ASSI {11551} (segid " " and resid "93 " and name "HA ") (segid " " and resid "93 " and name "HB2 ") 5.000 5.000 0.000 peak 11551 weight 0.10000E+01 volume -0.17270E+01 ppm1 3.701 ppm2 1.673 ASSI {11552} (segid " " and resid "93 " and name "HA ") (segid " " and resid "127 " and name "HE1 ") 5.000 5.000 0.000 peak 11552 weight 0.10000E+01 volume -0.60200E+00 ppm1 3.701 ppm2 7.224 OR {11552} (segid " " and resid "93 " and name "HA ") (segid " " and resid "127 " and name "HE2 ") ASSI {11553} (segid " " and resid "93 " and name "HA ") (segid " " and resid "127 " and name "HZ ") 5.000 5.000 0.000 peak 11553 weight 0.10000E+01 volume -0.61500E+00 ppm1 3.708 ppm2 7.331 ASSI {11556} (segid " " and resid "93 " and name "HB1 ") (segid " " and resid "93 " and name "HD2 ") 5.000 5.000 0.000 peak 11556 weight 0.10000E+01 volume -0.16780E+01 ppm1 1.761 ppm2 1.459 OR {11556} (segid " " and resid "93 " and name "HB1 ") (segid " " and resid "93 " and name "HD1 ") ASSI {11557} (segid " " and resid "93 " and name "HB1 ") (segid " " and resid "93 " and name "HE1 ") 6.000 6.000 0.000 peak 11557 weight 0.10000E+01 volume -0.25100E+00 ppm1 1.763 ppm2 2.740 ASSI {11558} (segid " " and resid "93 " and name "HB2 ") (segid " " and resid "93 " and name "HE1 ") 6.000 6.000 0.000 peak 11558 weight 0.10000E+01 volume -0.19800E+00 ppm1 1.673 ppm2 2.740 ASSI {11559} (segid " " and resid "93 " and name "HB2 ") (segid " " and resid "93 " and name "HE2 ") 5.000 5.000 0.000 peak 11559 weight 0.10000E+01 volume -0.54200E+00 ppm1 1.673 ppm2 2.607 ASSI {11560} (segid " " and resid "93 " and name "HD1 ") (segid " " and resid "93 " and name "HA ") 5.000 5.000 0.000 peak 11560 weight 0.10000E+01 volume -0.57400E+00 ppm1 1.455 ppm2 3.711 OR {11560} (segid " " and resid "93 " and name "HD2 ") (segid " " and resid "93 " and name "HA ") ASSI {11561} (segid " " and resid "93 " and name "HD2 ") (segid " " and resid "93 " and name "HE1 ") 5.000 5.000 0.000 peak 11561 weight 0.10000E+01 volume -0.11900E+01 ppm1 1.452 ppm2 2.730 OR {11561} (segid " " and resid "93 " and name "HD1 ") (segid " " and resid "93 " and name "HE1 ") ASSI {11562} (segid " " and resid "93 " and name "HD1 ") (segid " " and resid "93 " and name "HE2 ") 5.000 5.000 0.000 peak 11562 weight 0.10000E+01 volume -0.11030E+01 ppm1 1.442 ppm2 2.592 OR {11562} (segid " " and resid "93 " and name "HD2 ") (segid " " and resid "93 " and name "HE2 ") ASSI {11563} (segid " " and resid "93 " and name "HE1 ") (segid " " and resid "93 " and name "HA ") 6.000 6.000 0.000 peak 11563 weight 0.10000E+01 volume 0.10900E+00 ppm1 2.735 ppm2 3.712 ASSI {11564} (segid " " and resid "93 " and name "HE2 ") (segid " " and resid "93 " and name "HA ") 6.000 6.000 0.000 peak 11564 weight 0.10000E+01 volume 0.11100E+00 ppm1 2.590 ppm2 3.721 ASSI {11566} (segid " " and resid "93 " and name "HE2 ") (segid " " and resid "93 " and name "HB1 ") 6.000 6.000 0.000 peak 11566 weight 0.10000E+01 volume 0.24800E+00 ppm1 2.581 ppm2 1.775 ASSI {11571} (segid " " and resid "93 " and name "HE1 ") (segid " " and resid "93 " and name "HE2 ") 2.700 2.700 0.000 peak 11571 weight 0.10000E+01 volume 0.75080E+01 ppm1 2.743 ppm2 2.591 ASSI {11572} (segid " " and resid "93 " and name "HE1 ") (segid " " and resid "93 " and name "HG1 ") 5.000 5.000 0.000 peak 11572 weight 0.10000E+01 volume 0.49900E+00 ppm1 2.730 ppm2 1.092 ASSI {11573} (segid " " and resid "93 " and name "HE2 ") (segid " " and resid "93 " and name "HG1 ") 5.000 5.000 0.000 peak 11573 weight 0.10000E+01 volume 0.52300E+00 ppm1 2.583 ppm2 1.088 ASSI {11574} (segid " " and resid "93 " and name "HE1 ") (segid " " and resid "93 " and name "HG2 ") 5.000 5.000 0.000 peak 11574 weight 0.10000E+01 volume 0.72600E+00 ppm1 2.737 ppm2 0.612 ASSI {11575} (segid " " and resid "93 " and name "HE2 ") (segid " " and resid "93 " and name "HG2 ") 5.000 5.000 0.000 peak 11575 weight 0.10000E+01 volume 0.86600E+00 ppm1 2.585 ppm2 0.610 ASSI {11576} (segid " " and resid "93 " and name "HG1 ") (segid " " and resid "93 " and name "HA ") 5.000 5.000 0.000 peak 11576 weight 0.10000E+01 volume -0.11170E+01 ppm1 1.099 ppm2 3.713 ASSI {11577} (segid " " and resid "93 " and name "HG2 ") (segid " " and resid "93 " and name "HA ") 5.000 5.000 0.000 peak 11577 weight 0.10000E+01 volume -0.60700E+00 ppm1 0.631 ppm2 3.713 ASSI {11578} (segid " " and resid "93 " and name "HG2 ") (segid " " and resid "93 " and name "HB1 ") 5.000 5.000 0.000 peak 11578 weight 0.10000E+01 volume -0.88700E+00 ppm1 0.632 ppm2 1.761 ASSI {11579} (segid " " and resid "93 " and name "HG2 ") (segid " " and resid "93 " and name "HB2 ") 5.000 5.000 0.000 peak 11579 weight 0.10000E+01 volume -0.81500E+00 ppm1 0.632 ppm2 1.673 ASSI {11580} (segid " " and resid "93 " and name "HG2 ") (segid " " and resid "93 " and name "HD1 ") 5.000 5.000 0.000 peak 11580 weight 0.10000E+01 volume -0.96600E+00 ppm1 0.630 ppm2 1.453 OR {11580} (segid " " and resid "93 " and name "HG2 ") (segid " " and resid "93 " and name "HD2 ") ASSI {11585} (segid " " and resid "94 " and name "HA ") (segid " " and resid "94 " and name "HB ") 3.300 3.300 0.000 peak 11585 weight 0.10000E+01 volume -0.21650E+01 ppm1 4.048 ppm2 2.260 ASSI {11586} (segid " " and resid "94 " and name "HA ") (segid " " and resid "94 " and name "HG11") 3.300 3.300 0.000 peak 11586 weight 0.10000E+01 volume -0.21770E+01 ppm1 4.048 ppm2 1.193 OR {11586} (segid " " and resid "94 " and name "HA ") (segid " " and resid "94 " and name "HG12") OR {11586} (segid " " and resid "94 " and name "HA ") (segid " " and resid "94 " and name "HG13") ASSI {11587} (segid " " and resid "94 " and name "HA ") (segid " " and resid "94 " and name "HG22") 3.300 3.300 0.000 peak 11587 weight 0.10000E+01 volume -0.21450E+01 ppm1 4.048 ppm2 0.979 OR {11587} (segid " " and resid "94 " and name "HA ") (segid " " and resid "94 " and name "HG23") OR {11587} (segid " " and resid "94 " and name "HA ") (segid " " and resid "94 " and name "HG21") ASSI {11589} (segid " " and resid "94 " and name "HB ") (segid " " and resid "94 " and name "HG12") 3.300 3.300 0.000 peak 11589 weight 0.10000E+01 volume -0.33190E+01 ppm1 2.260 ppm2 1.195 OR {11589} (segid " " and resid "94 " and name "HB ") (segid " " and resid "94 " and name "HG13") OR {11589} (segid " " and resid "94 " and name "HB ") (segid " " and resid "94 " and name "HG11") ASSI {11592} (segid " " and resid "94 " and name "HG13") (segid " " and resid "94 " and name "HG22") 2.700 2.700 0.000 peak 11592 weight 0.10000E+01 volume -0.13686E+02 ppm1 1.193 ppm2 0.966 OR {11592} (segid " " and resid "94 " and name "HG12") (segid " " and resid "94 " and name "HG22") OR {11592} (segid " " and resid "94 " and name "HG11") (segid " " and resid "94 " and name "HG23") OR {11592} (segid " " and resid "94 " and name "HG11") (segid " " and resid "94 " and name "HG21") OR {11592} (segid " " and resid "94 " and name "HG11") (segid " " and resid "94 " and name "HG22") OR {11592} (segid " " and resid "94 " and name "HG12") (segid " " and resid "94 " and name "HG23") OR {11592} (segid " " and resid "94 " and name "HG12") (segid " " and resid "94 " and name "HG21") OR {11592} (segid " " and resid "94 " and name "HG13") (segid " " and resid "94 " and name "HG21") OR {11592} (segid " " and resid "94 " and name "HG13") (segid " " and resid "94 " and name "HG23") ASSI {11593} (segid " " and resid "94 " and name "HG23") (segid " " and resid "94 " and name "HB ") 2.700 2.700 0.000 peak 11593 weight 0.10000E+01 volume -0.48500E+01 ppm1 0.975 ppm2 2.265 OR {11593} (segid " " and resid "94 " and name "HG21") (segid " " and resid "94 " and name "HB ") OR {11593} (segid " " and resid "94 " and name "HG22") (segid " " and resid "94 " and name "HB ") ASSI {11594} (segid " " and resid "95 " and name "HA ") (segid " " and resid "95 " and name "HB2 ") 5.000 5.000 0.000 peak 11594 weight 0.10000E+01 volume 0.18810E+01 ppm1 3.918 ppm2 1.168 ASSI {11596} (segid " " and resid "95 " and name "HB2 ") (segid " " and resid "95 " and name "HB1 ") 5.000 5.000 0.000 peak 11596 weight 0.10000E+01 volume 0.74100E+00 ppm1 1.167 ppm2 2.260 ASSI {11598} (segid " " and resid "95 " and name "HB1 ") (segid " " and resid "95 " and name "HD11") 5.000 5.000 0.000 peak 11598 weight 0.10000E+01 volume 0.81900E+00 ppm1 2.260 ppm2 0.770 OR {11598} (segid " " and resid "95 " and name "HB1 ") (segid " " and resid "95 " and name "HD13") OR {11598} (segid " " and resid "95 " and name "HB1 ") (segid " " and resid "95 " and name "HD12") ASSI {11599} (segid " " and resid "95 " and name "HB1 ") (segid " " and resid "95 " and name "HG ") 5.000 5.000 0.000 peak 11599 weight 0.10000E+01 volume 0.51200E+00 ppm1 2.264 ppm2 1.748 ASSI {11600} (segid " " and resid "95 " and name "HB2 ") (segid " " and resid "95 " and name "HG ") 5.000 5.000 0.000 peak 11600 weight 0.10000E+01 volume 0.56000E+00 ppm1 1.163 ppm2 1.731 ASSI {11605} (segid " " and resid "95 " and name "HG ") (segid " " and resid "95 " and name "HA ") 5.000 5.000 0.000 peak 11605 weight 0.10000E+01 volume -0.16210E+01 ppm1 1.753 ppm2 3.915 ASSI {11606} (segid " " and resid "96 " and name "HA ") (segid " " and resid "96 " and name "HB ") 5.000 5.000 0.000 peak 11606 weight 0.10000E+01 volume -0.89300E+00 ppm1 3.761 ppm2 2.342 ASSI {11607} (segid " " and resid "96 " and name "HG13") (segid " " and resid "96 " and name "HB ") 3.300 3.300 0.000 peak 11607 weight 0.10000E+01 volume -0.32200E+01 ppm1 1.139 ppm2 2.340 OR {11607} (segid " " and resid "96 " and name "HG11") (segid " " and resid "96 " and name "HB ") OR {11607} (segid " " and resid "96 " and name "HG12") (segid " " and resid "96 " and name "HB ") ASSI {11608} (segid " " and resid "96 " and name "HG23") (segid " " and resid "96 " and name "HB ") 3.300 3.300 0.000 peak 11608 weight 0.10000E+01 volume -0.33700E+01 ppm1 1.113 ppm2 2.340 OR {11608} (segid " " and resid "96 " and name "HG21") (segid " " and resid "96 " and name "HB ") OR {11608} (segid " " and resid "96 " and name "HG22") (segid " " and resid "96 " and name "HB ") ASSI {11609} (segid " " and resid "96 " and name "HG22") (segid " " and resid "127 " and name "HD1 ") 6.000 6.000 0.000 peak 11609 weight 0.10000E+01 volume -0.22500E+00 ppm1 1.118 ppm2 7.124 OR {11609} (segid " " and resid "96 " and name "HG22") (segid " " and resid "127 " and name "HD2 ") OR {11609} (segid " " and resid "96 " and name "HG23") (segid " " and resid "127 " and name "HD2 ") OR {11609} (segid " " and resid "96 " and name "HG23") (segid " " and resid "127 " and name "HD1 ") OR {11609} (segid " " and resid "96 " and name "HG21") (segid " " and resid "127 " and name "HD1 ") OR {11609} (segid " " and resid "96 " and name "HG21") (segid " " and resid "127 " and name "HD2 ") ASSI {11610} (segid " " and resid "96 " and name "HG22") (segid " " and resid "127 " and name "HE1 ") 5.000 5.000 0.000 peak 11610 weight 0.10000E+01 volume -0.68300E+00 ppm1 1.124 ppm2 7.215 OR {11610} (segid " " and resid "96 " and name "HG22") (segid " " and resid "127 " and name "HE2 ") OR {11610} (segid " " and resid "96 " and name "HG23") (segid " " and resid "127 " and name "HE2 ") OR {11610} (segid " " and resid "96 " and name "HG23") (segid " " and resid "127 " and name "HE1 ") OR {11610} (segid " " and resid "96 " and name "HG21") (segid " " and resid "127 " and name "HE2 ") OR {11610} (segid " " and resid "96 " and name "HG21") (segid " " and resid "127 " and name "HE1 ") ASSI {11611} (segid " " and resid "96 " and name "HG23") (segid " " and resid "127 " and name "HZ ") 5.000 5.000 0.000 peak 11611 weight 0.10000E+01 volume -0.63500E+00 ppm1 1.113 ppm2 7.332 OR {11611} (segid " " and resid "96 " and name "HG21") (segid " " and resid "127 " and name "HZ ") OR {11611} (segid " " and resid "96 " and name "HG22") (segid " " and resid "127 " and name "HZ ") ASSI {11612} (segid " " and resid "97 " and name "HB2 ") (segid " " and resid "97 " and name "HA ") 3.300 3.300 0.000 peak 11612 weight 0.10000E+01 volume -0.25220E+01 ppm1 2.020 ppm2 4.102 ASSI {11613} (segid " " and resid "97 " and name "HB2 ") (segid " " and resid "97 " and name "HB1 ") 2.700 2.700 0.000 peak 11613 weight 0.10000E+01 volume -0.71440E+01 ppm1 2.020 ppm2 2.260 ASSI {11614} (segid " " and resid "97 " and name "HB2 ") (segid " " and resid "97 " and name "HG1 ") 3.300 3.300 0.000 peak 11614 weight 0.10000E+01 volume -0.37460E+01 ppm1 2.020 ppm2 2.420 ASSI {11615} (segid " " and resid "97 " and name "HG1 ") (segid " " and resid "97 " and name "HA ") 5.000 5.000 0.000 peak 11615 weight 0.10000E+01 volume 0.81500E+00 ppm1 2.410 ppm2 4.095 ASSI {11616} (segid " " and resid "97 " and name "HG2 ") (segid " " and resid "97 " and name "HA ") 5.000 5.000 0.000 peak 11616 weight 0.10000E+01 volume 0.90500E+00 ppm1 2.088 ppm2 4.105 ASSI {11617} (segid " " and resid "98 " and name "HA ") (segid " " and resid "98 " and name "HB1 ") 5.000 5.000 0.000 peak 11617 weight 0.10000E+01 volume 0.94100E+00 ppm1 4.579 ppm2 3.711 ASSI {11618} (segid " " and resid "98 " and name "HA ") (segid " " and resid "98 " and name "HB2 ") 5.000 5.000 0.000 peak 11618 weight 0.10000E+01 volume 0.76600E+00 ppm1 4.582 ppm2 2.845 ASSI {11620} (segid " " and resid "98 " and name "HB1 ") (segid " " and resid "98 " and name "HB2 ") 5.000 5.000 0.000 peak 11620 weight 0.10000E+01 volume -0.30700E+00 ppm1 3.722 ppm2 2.855 ASSI {11621} (segid " " and resid "99 " and name "HA2 ") (segid " " and resid "99 " and name "HA1 ") 5.000 5.000 0.000 peak 11621 weight 0.10000E+01 volume 0.19240E+01 ppm1 3.844 ppm2 4.340 ASSI {11623} (segid " " and resid "100 " and name "HA ") (segid " " and resid "69 " and name "HG1 ") 5.000 5.000 0.000 peak 11623 weight 0.10000E+01 volume 0.33000E+00 ppm1 4.234 ppm2 2.127 ASSI {11624} (segid " " and resid "100 " and name "HA ") (segid " " and resid "69 " and name "HG2 ") 5.000 5.000 0.000 peak 11624 weight 0.10000E+01 volume 0.65000E+00 ppm1 4.226 ppm2 1.835 ASSI {11625} (segid " " and resid "100 " and name "HA ") (segid " " and resid "100 " and name "HB1 ") 3.300 3.300 0.000 peak 11625 weight 0.10000E+01 volume 0.30610E+01 ppm1 4.230 ppm2 1.131 OR {11625} (segid " " and resid "100 " and name "HA ") (segid " " and resid "100 " and name "HB2 ") OR {11625} (segid " " and resid "100 " and name "HA ") (segid " " and resid "100 " and name "HB3 ") ASSI {11626} (segid " " and resid "101 " and name "HA ") (segid " " and resid "101 " and name "HB1 ") 5.000 5.000 0.000 peak 11626 weight 0.10000E+01 volume 0.13730E+01 ppm1 4.647 ppm2 2.768 ASSI {11627} (segid " " and resid "101 " and name "HA ") (segid " " and resid "101 " and name "HB2 ") 5.000 5.000 0.000 peak 11627 weight 0.10000E+01 volume 0.19000E+01 ppm1 4.648 ppm2 2.649 ASSI {11630} (segid " " and resid "102 " and name "HA ") (segid " " and resid "102 " and name "HB ") 3.300 3.300 0.000 peak 11630 weight 0.10000E+01 volume -0.21430E+01 ppm1 3.888 ppm2 2.207 ASSI {11631} (segid " " and resid "102 " and name "HA ") (segid " " and resid "102 " and name "HG11") 2.700 2.700 0.000 peak 11631 weight 0.10000E+01 volume -0.76540E+01 ppm1 3.888 ppm2 0.872 OR {11631} (segid " " and resid "102 " and name "HA ") (segid " " and resid "102 " and name "HG12") OR {11631} (segid " " and resid "102 " and name "HA ") (segid " " and resid "102 " and name "HG22") OR {11631} (segid " " and resid "102 " and name "HA ") (segid " " and resid "102 " and name "HG13") OR {11631} (segid " " and resid "102 " and name "HA ") (segid " " and resid "102 " and name "HG21") OR {11631} (segid " " and resid "102 " and name "HA ") (segid " " and resid "102 " and name "HG23") ASSI {11633} (segid " " and resid "102 " and name "HG11") (segid " " and resid "102 " and name "HA ") 2.700 2.700 0.000 peak 11633 weight 0.10000E+01 volume -0.73440E+01 ppm1 0.872 ppm2 3.892 OR {11633} (segid " " and resid "102 " and name "HG12") (segid " " and resid "102 " and name "HA ") OR {11633} (segid " " and resid "102 " and name "HG13") (segid " " and resid "102 " and name "HA ") ASSI {11634} (segid " " and resid "102 " and name "HG12") (segid " " and resid "102 " and name "HB ") 2.700 2.700 0.000 peak 11634 weight 0.10000E+01 volume -0.50540E+01 ppm1 0.879 ppm2 2.207 OR {11634} (segid " " and resid "102 " and name "HG11") (segid " " and resid "102 " and name "HB ") OR {11634} (segid " " and resid "102 " and name "HG13") (segid " " and resid "102 " and name "HB ") ASSI {11635} (segid " " and resid "102 " and name "HG13") (segid " " and resid "132 " and name "HA ") 6.000 6.000 0.000 peak 11635 weight 0.10000E+01 volume -0.24200E+00 ppm1 0.878 ppm2 5.102 OR {11635} (segid " " and resid "102 " and name "HG11") (segid " " and resid "132 " and name "HA ") OR {11635} (segid " " and resid "102 " and name "HG12") (segid " " and resid "132 " and name "HA ") ASSI {11636} (segid " " and resid "102 " and name "HG22") (segid " " and resid "102 " and name "HA ") 5.000 5.000 0.000 peak 11636 weight 0.10000E+01 volume -0.12230E+01 ppm1 0.872 ppm2 3.888 OR {11636} (segid " " and resid "102 " and name "HG21") (segid " " and resid "102 " and name "HA ") OR {11636} (segid " " and resid "102 " and name "HG23") (segid " " and resid "102 " and name "HA ") ASSI {11637} (segid " " and resid "102 " and name "HG21") (segid " " and resid "102 " and name "HB ") 3.300 3.300 0.000 peak 11637 weight 0.10000E+01 volume -0.32430E+01 ppm1 0.868 ppm2 2.207 OR {11637} (segid " " and resid "102 " and name "HG23") (segid " " and resid "102 " and name "HB ") OR {11637} (segid " " and resid "102 " and name "HG22") (segid " " and resid "102 " and name "HB ") ASSI {11638} (segid " " and resid "102 " and name "HG23") (segid " " and resid "132 " and name "HA ") 5.000 5.000 0.000 peak 11638 weight 0.10000E+01 volume -0.73200E+00 ppm1 0.860 ppm2 5.099 OR {11638} (segid " " and resid "102 " and name "HG21") (segid " " and resid "132 " and name "HA ") OR {11638} (segid " " and resid "102 " and name "HG22") (segid " " and resid "132 " and name "HA ") ASSI {11639} (segid " " and resid "103 " and name "HA ") (segid " " and resid "103 " and name "HB1 ") 5.000 5.000 0.000 peak 11639 weight 0.10000E+01 volume 0.50900E+00 ppm1 5.338 ppm2 2.951 ASSI {11640} (segid " " and resid "103 " and name "HA ") (segid " " and resid "103 " and name "HB2 ") 5.000 5.000 0.000 peak 11640 weight 0.10000E+01 volume 0.38500E+00 ppm1 5.345 ppm2 2.572 ASSI {11643} (segid " " and resid "104 " and name "HA ") (segid " " and resid "104 " and name "HB3 ") 2.700 2.700 0.000 peak 11643 weight 0.10000E+01 volume 0.48150E+01 ppm1 4.151 ppm2 1.325 OR {11643} (segid " " and resid "104 " and name "HA ") (segid " " and resid "104 " and name "HB1 ") OR {11643} (segid " " and resid "104 " and name "HA ") (segid " " and resid "104 " and name "HB2 ") ASSI {11644} (segid " " and resid "104 " and name "HA ") (segid " " and resid "105 " and name "HD22") 6.000 6.000 0.000 peak 11644 weight 0.10000E+01 volume 0.10300E+00 ppm1 4.154 ppm2 0.395 OR {11644} (segid " " and resid "104 " and name "HA ") (segid " " and resid "105 " and name "HD23") OR {11644} (segid " " and resid "104 " and name "HA ") (segid " " and resid "105 " and name "HD21") ASSI {11646} (segid " " and resid "104 " and name "HB2 ") (segid " " and resid "101 " and name "HB1 ") 5.000 5.000 0.000 peak 11646 weight 0.10000E+01 volume -0.34800E+00 ppm1 1.326 ppm2 2.781 OR {11646} (segid " " and resid "104 " and name "HB1 ") (segid " " and resid "101 " and name "HB1 ") OR {11646} (segid " " and resid "104 " and name "HB3 ") (segid " " and resid "101 " and name "HB1 ") ASSI {11647} (segid " " and resid "104 " and name "HB3 ") (segid " " and resid "101 " and name "HB2 ") 5.000 5.000 0.000 peak 11647 weight 0.10000E+01 volume -0.34900E+00 ppm1 1.326 ppm2 2.665 OR {11647} (segid " " and resid "104 " and name "HB2 ") (segid " " and resid "101 " and name "HB2 ") OR {11647} (segid " " and resid "104 " and name "HB1 ") (segid " " and resid "101 " and name "HB2 ") ASSI {11649} (segid " " and resid "105 " and name "HA ") (segid " " and resid "105 " and name "HB1 ") 5.000 5.000 0.000 peak 11649 weight 0.10000E+01 volume 0.74200E+00 ppm1 4.935 ppm2 1.822 ASSI {11650} (segid " " and resid "105 " and name "HA ") (segid " " and resid "105 " and name "HB2 ") 5.000 5.000 0.000 peak 11650 weight 0.10000E+01 volume 0.88500E+00 ppm1 4.938 ppm2 1.295 ASSI {11651} (segid " " and resid "105 " and name "HA ") (segid " " and resid "105 " and name "HD13") 5.000 5.000 0.000 peak 11651 weight 0.10000E+01 volume 0.64100E+00 ppm1 4.932 ppm2 0.843 OR {11651} (segid " " and resid "105 " and name "HA ") (segid " " and resid "105 " and name "HD11") OR {11651} (segid " " and resid "105 " and name "HA ") (segid " " and resid "105 " and name "HD12") ASSI {11652} (segid " " and resid "105 " and name "HA ") (segid " " and resid "105 " and name "HD21") 3.300 3.300 0.000 peak 11652 weight 0.10000E+01 volume 0.23820E+01 ppm1 4.937 ppm2 0.391 OR {11652} (segid " " and resid "105 " and name "HA ") (segid " " and resid "105 " and name "HD23") OR {11652} (segid " " and resid "105 " and name "HA ") (segid " " and resid "105 " and name "HD22") ASSI {11653} (segid " " and resid "105 " and name "HA ") (segid " " and resid "105 " and name "HG ") 5.000 5.000 0.000 peak 11653 weight 0.10000E+01 volume 0.49100E+00 ppm1 4.939 ppm2 1.651 ASSI {11656} (segid " " and resid "105 " and name "HB2 ") (segid " " and resid "105 " and name "HB1 ") 5.000 5.000 0.000 peak 11656 weight 0.10000E+01 volume 0.13490E+01 ppm1 1.283 ppm2 1.808 ASSI {11659} (segid " " and resid "105 " and name "HB2 ") (segid " " and resid "105 " and name "HD11") 6.000 6.000 0.000 peak 11659 weight 0.10000E+01 volume -0.19700E+00 ppm1 1.276 ppm2 0.836 OR {11659} (segid " " and resid "105 " and name "HB2 ") (segid " " and resid "105 " and name "HD13") OR {11659} (segid " " and resid "105 " and name "HB2 ") (segid " " and resid "105 " and name "HD12") ASSI {11660} (segid " " and resid "105 " and name "HB1 ") (segid " " and resid "105 " and name "HD23") 5.000 5.000 0.000 peak 11660 weight 0.10000E+01 volume 0.52000E+00 ppm1 1.815 ppm2 0.391 OR {11660} (segid " " and resid "105 " and name "HB1 ") (segid " " and resid "105 " and name "HD21") OR {11660} (segid " " and resid "105 " and name "HB1 ") (segid " " and resid "105 " and name "HD22") ASSI {11661} (segid " " and resid "105 " and name "HB2 ") (segid " " and resid "105 " and name "HD21") 5.000 5.000 0.000 peak 11661 weight 0.10000E+01 volume 0.48000E+00 ppm1 1.282 ppm2 0.388 OR {11661} (segid " " and resid "105 " and name "HB2 ") (segid " " and resid "105 " and name "HD23") OR {11661} (segid " " and resid "105 " and name "HB2 ") (segid " " and resid "105 " and name "HD22") ASSI {11662} (segid " " and resid "105 " and name "HB1 ") (segid " " and resid "105 " and name "HG ") 6.000 6.000 0.000 peak 11662 weight 0.10000E+01 volume 0.19200E+00 ppm1 1.821 ppm2 1.649 ASSI {11663} (segid " " and resid "105 " and name "HB2 ") (segid " " and resid "105 " and name "HG ") 6.000 6.000 0.000 peak 11663 weight 0.10000E+01 volume -0.80000E-01 ppm1 1.283 ppm2 1.637 ASSI {11665} (segid " " and resid "105 " and name "HD12") (segid " " and resid "105 " and name "HB1 ") 2.700 2.700 0.000 peak 11665 weight 0.10000E+01 volume -0.73730E+01 ppm1 0.840 ppm2 1.829 OR {11665} (segid " " and resid "105 " and name "HD13") (segid " " and resid "105 " and name "HB1 ") OR {11665} (segid " " and resid "105 " and name "HD11") (segid " " and resid "105 " and name "HB1 ") ASSI {11666} (segid " " and resid "105 " and name "HD11") (segid " " and resid "105 " and name "HD21") 3.300 3.300 0.000 peak 11666 weight 0.10000E+01 volume -0.27640E+01 ppm1 0.846 ppm2 0.393 OR {11666} (segid " " and resid "105 " and name "HD11") (segid " " and resid "105 " and name "HD22") OR {11666} (segid " " and resid "105 " and name "HD12") (segid " " and resid "105 " and name "HD22") OR {11666} (segid " " and resid "105 " and name "HD11") (segid " " and resid "105 " and name "HD23") OR {11666} (segid " " and resid "105 " and name "HD13") (segid " " and resid "105 " and name "HD21") OR {11666} (segid " " and resid "105 " and name "HD12") (segid " " and resid "105 " and name "HD23") OR {11666} (segid " " and resid "105 " and name "HD12") (segid " " and resid "105 " and name "HD21") OR {11666} (segid " " and resid "105 " and name "HD13") (segid " " and resid "105 " and name "HD22") OR {11666} (segid " " and resid "105 " and name "HD13") (segid " " and resid "105 " and name "HD23") ASSI {11667} (segid " " and resid "105 " and name "HD13") (segid " " and resid "105 " and name "HG ") 2.700 2.700 0.000 peak 11667 weight 0.10000E+01 volume -0.56200E+01 ppm1 0.842 ppm2 1.664 OR {11667} (segid " " and resid "105 " and name "HD11") (segid " " and resid "105 " and name "HG ") OR {11667} (segid " " and resid "105 " and name "HD12") (segid " " and resid "105 " and name "HG ") ASSI {11673} (segid " " and resid "105 " and name "HD21") (segid " " and resid "105 " and name "HG ") 5.000 5.000 0.000 peak 11673 weight 0.10000E+01 volume -0.16610E+01 ppm1 0.392 ppm2 1.653 OR {11673} (segid " " and resid "105 " and name "HD22") (segid " " and resid "105 " and name "HG ") OR {11673} (segid " " and resid "105 " and name "HD23") (segid " " and resid "105 " and name "HG ") ASSI {11674} (segid " " and resid "105 " and name "HD23") (segid " " and resid "109 " and name "HA1 ") 6.000 6.000 0.000 peak 11674 weight 0.10000E+01 volume -0.19100E+00 ppm1 0.392 ppm2 4.300 OR {11674} (segid " " and resid "105 " and name "HD21") (segid " " and resid "109 " and name "HA1 ") OR {11674} (segid " " and resid "105 " and name "HD22") (segid " " and resid "109 " and name "HA1 ") ASSI {11675} (segid " " and resid "105 " and name "HD21") (segid " " and resid "109 " and name "HA2 ") 6.000 6.000 0.000 peak 11675 weight 0.10000E+01 volume -0.13200E+00 ppm1 0.392 ppm2 3.808 OR {11675} (segid " " and resid "105 " and name "HD23") (segid " " and resid "109 " and name "HA2 ") OR {11675} (segid " " and resid "105 " and name "HD22") (segid " " and resid "109 " and name "HA2 ") ASSI {11676} (segid " " and resid "105 " and name "HD23") (segid " " and resid "111 " and name "HA ") 6.000 6.000 0.000 peak 11676 weight 0.10000E+01 volume -0.29300E+00 ppm1 0.392 ppm2 5.293 OR {11676} (segid " " and resid "105 " and name "HD21") (segid " " and resid "111 " and name "HA ") OR {11676} (segid " " and resid "105 " and name "HD22") (segid " " and resid "111 " and name "HA ") ASSI {11678} (segid " " and resid "105 " and name "HD21") (segid " " and resid "111 " and name "HG ") 5.000 5.000 0.000 peak 11678 weight 0.10000E+01 volume -0.54500E+00 ppm1 0.392 ppm2 1.967 OR {11678} (segid " " and resid "105 " and name "HD22") (segid " " and resid "111 " and name "HG ") OR {11678} (segid " " and resid "105 " and name "HD23") (segid " " and resid "111 " and name "HG ") ASSI {11679} (segid " " and resid "105 " and name "HD22") (segid " " and resid "136 " and name "HD2 ") 6.000 6.000 0.000 peak 11679 weight 0.10000E+01 volume -0.19800E+00 ppm1 0.392 ppm2 6.744 OR {11679} (segid " " and resid "105 " and name "HD21") (segid " " and resid "136 " and name "HD2 ") OR {11679} (segid " " and resid "105 " and name "HD23") (segid " " and resid "136 " and name "HD2 ") ASSI {11682} (segid " " and resid "106 " and name "HA ") (segid " " and resid "106 " and name "HB1 ") 5.000 5.000 0.000 peak 11682 weight 0.10000E+01 volume 0.94700E+00 ppm1 4.927 ppm2 2.899 ASSI {11683} (segid " " and resid "106 " and name "HA ") (segid " " and resid "106 " and name "HB2 ") 5.000 5.000 0.000 peak 11683 weight 0.10000E+01 volume 0.99200E+00 ppm1 4.910 ppm2 1.363 ASSI {11686} (segid " " and resid "106 " and name "HB2 ") (segid " " and resid "106 " and name "HB1 ") 5.000 5.000 0.000 peak 11686 weight 0.10000E+01 volume 0.96100E+00 ppm1 1.369 ppm2 2.885 ASSI {11688} (segid " " and resid "107 " and name "HA ") (segid " " and resid "107 " and name "HB2 ") 2.700 2.700 0.000 peak 11688 weight 0.10000E+01 volume -0.79930E+01 ppm1 4.288 ppm2 4.021 OR {11688} (segid " " and resid "107 " and name "HA ") (segid " " and resid "107 " and name "HB1 ") ASSI {11690} (segid " " and resid "108 " and name "HA ") (segid " " and resid "108 " and name "HG21") 3.300 3.300 0.000 peak 11690 weight 0.10000E+01 volume -0.30370E+01 ppm1 4.622 ppm2 1.151 OR {11690} (segid " " and resid "108 " and name "HA ") (segid " " and resid "108 " and name "HG23") OR {11690} (segid " " and resid "108 " and name "HA ") (segid " " and resid "108 " and name "HG22") ASSI {11691} (segid " " and resid "108 " and name "HB ") (segid " " and resid "108 " and name "HG21") 3.300 3.300 0.000 peak 11691 weight 0.10000E+01 volume -0.33770E+01 ppm1 4.555 ppm2 1.145 OR {11691} (segid " " and resid "108 " and name "HB ") (segid " " and resid "108 " and name "HG22") OR {11691} (segid " " and resid "108 " and name "HB ") (segid " " and resid "108 " and name "HG23") ASSI {11694} (segid " " and resid "109 " and name "HA2 ") (segid " " and resid "109 " and name "HA1 ") 3.300 3.300 0.000 peak 11694 weight 0.10000E+01 volume 0.23930E+01 ppm1 3.803 ppm2 4.315 ASSI {11696} (segid " " and resid "110 " and name "HA ") (segid " " and resid "110 " and name "HB2 ") 5.000 5.000 0.000 peak 11696 weight 0.10000E+01 volume -0.14420E+01 ppm1 4.075 ppm2 3.701 ASSI {11698} (segid " " and resid "111 " and name "HA ") (segid " " and resid "111 " and name "HB1 ") 6.000 6.000 0.000 peak 11698 weight 0.10000E+01 volume 0.12300E+00 ppm1 5.284 ppm2 2.438 ASSI {11699} (segid " " and resid "111 " and name "HA ") (segid " " and resid "111 " and name "HB2 ") 5.000 5.000 0.000 peak 11699 weight 0.10000E+01 volume 0.42600E+00 ppm1 5.284 ppm2 1.965 ASSI {11703} (segid " " and resid "111 " and name "HB2 ") (segid " " and resid "111 " and name "HB1 ") 5.000 5.000 0.000 peak 11703 weight 0.10000E+01 volume 0.41400E+00 ppm1 1.992 ppm2 2.445 ASSI {11704} (segid " " and resid "111 " and name "HB1 ") (segid " " and resid "111 " and name "HD12") 5.000 5.000 0.000 peak 11704 weight 0.10000E+01 volume 0.43900E+00 ppm1 2.446 ppm2 1.188 OR {11704} (segid " " and resid "111 " and name "HB1 ") (segid " " and resid "111 " and name "HD13") OR {11704} (segid " " and resid "111 " and name "HB1 ") (segid " " and resid "111 " and name "HD11") ASSI {11705} (segid " " and resid "111 " and name "HB1 ") (segid " " and resid "111 " and name "HD23") 6.000 6.000 0.000 peak 11705 weight 0.10000E+01 volume 0.29200E+00 ppm1 2.436 ppm2 0.956 OR {11705} (segid " " and resid "111 " and name "HB1 ") (segid " " and resid "111 " and name "HD22") OR {11705} (segid " " and resid "111 " and name "HB1 ") (segid " " and resid "111 " and name "HD21") ASSI {11707} (segid " " and resid "111 " and name "HD12") (segid " " and resid "105 " and name "HD22") 6.000 6.000 0.000 peak 11707 weight 0.10000E+01 volume -0.26100E+00 ppm1 1.193 ppm2 0.392 OR {11707} (segid " " and resid "111 " and name "HD12") (segid " " and resid "105 " and name "HD21") OR {11707} (segid " " and resid "111 " and name "HD11") (segid " " and resid "105 " and name "HD21") OR {11707} (segid " " and resid "111 " and name "HD12") (segid " " and resid "105 " and name "HD23") OR {11707} (segid " " and resid "111 " and name "HD11") (segid " " and resid "105 " and name "HD23") OR {11707} (segid " " and resid "111 " and name "HD11") (segid " " and resid "105 " and name "HD22") OR {11707} (segid " " and resid "111 " and name "HD13") (segid " " and resid "105 " and name "HD21") OR {11707} (segid " " and resid "111 " and name "HD13") (segid " " and resid "105 " and name "HD22") OR {11707} (segid " " and resid "111 " and name "HD13") (segid " " and resid "105 " and name "HD23") ASSI {11709} (segid " " and resid "111 " and name "HD11") (segid " " and resid "136 " and name "HD2 ") 6.000 6.000 0.000 peak 11709 weight 0.10000E+01 volume -0.27000E+00 ppm1 1.193 ppm2 6.744 OR {11709} (segid " " and resid "111 " and name "HD13") (segid " " and resid "136 " and name "HD2 ") OR {11709} (segid " " and resid "111 " and name "HD12") (segid " " and resid "136 " and name "HD2 ") ASSI {11710} (segid " " and resid "111 " and name "HD23") (segid " " and resid "105 " and name "HD22") 3.300 3.300 0.000 peak 11710 weight 0.10000E+01 volume -0.28530E+01 ppm1 0.964 ppm2 0.397 OR {11710} (segid " " and resid "111 " and name "HD21") (segid " " and resid "105 " and name "HD23") OR {11710} (segid " " and resid "111 " and name "HD21") (segid " " and resid "105 " and name "HD21") OR {11710} (segid " " and resid "111 " and name "HD22") (segid " " and resid "105 " and name "HD21") OR {11710} (segid " " and resid "111 " and name "HD23") (segid " " and resid "105 " and name "HD23") OR {11710} (segid " " and resid "111 " and name "HD22") (segid " " and resid "105 " and name "HD22") OR {11710} (segid " " and resid "111 " and name "HD21") (segid " " and resid "105 " and name "HD22") OR {11710} (segid " " and resid "111 " and name "HD22") (segid " " and resid "105 " and name "HD23") OR {11710} (segid " " and resid "111 " and name "HD23") (segid " " and resid "105 " and name "HD21") ASSI {11711} (segid " " and resid "111 " and name "HD21") (segid " " and resid "111 " and name "HA ") 3.300 3.300 0.000 peak 11711 weight 0.10000E+01 volume -0.27880E+01 ppm1 0.963 ppm2 5.276 OR {11711} (segid " " and resid "111 " and name "HD22") (segid " " and resid "111 " and name "HA ") OR {11711} (segid " " and resid "111 " and name "HD23") (segid " " and resid "111 " and name "HA ") ASSI {11712} (segid " " and resid "111 " and name "HD21") (segid " " and resid "111 " and name "HD13") 2.700 2.700 0.000 peak 11712 weight 0.10000E+01 volume -0.95100E+01 ppm1 0.961 ppm2 1.193 OR {11712} (segid " " and resid "111 " and name "HD21") (segid " " and resid "111 " and name "HD12") OR {11712} (segid " " and resid "111 " and name "HD21") (segid " " and resid "111 " and name "HD11") OR {11712} (segid " " and resid "111 " and name "HD23") (segid " " and resid "111 " and name "HD13") OR {11712} (segid " " and resid "111 " and name "HD22") (segid " " and resid "111 " and name "HD12") OR {11712} (segid " " and resid "111 " and name "HD23") (segid " " and resid "111 " and name "HD12") OR {11712} (segid " " and resid "111 " and name "HD22") (segid " " and resid "111 " and name "HD13") OR {11712} (segid " " and resid "111 " and name "HD23") (segid " " and resid "111 " and name "HD11") OR {11712} (segid " " and resid "111 " and name "HD22") (segid " " and resid "111 " and name "HD11") ASSI {11713} (segid " " and resid "111 " and name "HD22") (segid " " and resid "114 " and name "HE1 ") 6.000 6.000 0.000 peak 11713 weight 0.10000E+01 volume -0.24900E+00 ppm1 0.964 ppm2 7.823 OR {11713} (segid " " and resid "111 " and name "HD21") (segid " " and resid "114 " and name "HE1 ") OR {11713} (segid " " and resid "111 " and name "HD23") (segid " " and resid "114 " and name "HE1 ") ASSI {11714} (segid " " and resid "111 " and name "HD21") (segid " " and resid "136 " and name "HD2 ") 6.000 6.000 0.000 peak 11714 weight 0.10000E+01 volume -0.29800E+00 ppm1 0.971 ppm2 6.744 OR {11714} (segid " " and resid "111 " and name "HD23") (segid " " and resid "136 " and name "HD2 ") OR {11714} (segid " " and resid "111 " and name "HD22") (segid " " and resid "136 " and name "HD2 ") ASSI {11716} (segid " " and resid "111 " and name "HG ") (segid " " and resid "111 " and name "HA ") 6.000 6.000 0.000 peak 11716 weight 0.10000E+01 volume -0.13300E+00 ppm1 1.967 ppm2 5.302 ASSI {11717} (segid " " and resid "111 " and name "HG ") (segid " " and resid "111 " and name "HD11") 5.000 5.000 0.000 peak 11717 weight 0.10000E+01 volume -0.16190E+01 ppm1 1.967 ppm2 1.193 OR {11717} (segid " " and resid "111 " and name "HG ") (segid " " and resid "111 " and name "HD13") OR {11717} (segid " " and resid "111 " and name "HG ") (segid " " and resid "111 " and name "HD12") ASSI {11718} (segid " " and resid "111 " and name "HG ") (segid " " and resid "114 " and name "HE1 ") 6.000 6.000 0.000 peak 11718 weight 0.10000E+01 volume -0.13200E+00 ppm1 1.967 ppm2 7.836 ASSI {11719} (segid " " and resid "111 " and name "HG ") (segid " " and resid "136 " and name "HD2 ") 6.000 6.000 0.000 peak 11719 weight 0.10000E+01 volume -0.22700E+00 ppm1 1.971 ppm2 6.745 ASSI {11720} (segid " " and resid "112 " and name "HA ") (segid " " and resid "81 " and name "HD2 ") 5.000 5.000 0.000 peak 11720 weight 0.10000E+01 volume -0.62300E+00 ppm1 4.134 ppm2 6.515 ASSI {11722} (segid " " and resid "112 " and name "HB1 ") (segid " " and resid "112 " and name "HA ") 3.300 3.300 0.000 peak 11722 weight 0.10000E+01 volume -0.24190E+01 ppm1 1.993 ppm2 4.128 ASSI {11723} (segid " " and resid "112 " and name "HD2 ") (segid " " and resid "112 " and name "HD1 ") 5.000 5.000 0.000 peak 11723 weight 0.10000E+01 volume 0.46300E+00 ppm1 3.964 ppm2 4.289 ASSI {11726} (segid " " and resid "113 " and name "HA ") (segid " " and resid "113 " and name "HB ") 5.000 5.000 0.000 peak 11726 weight 0.10000E+01 volume -0.12880E+01 ppm1 3.835 ppm2 1.735 ASSI {11729} (segid " " and resid "113 " and name "HB ") (segid " " and resid "113 " and name "HG11") 5.000 5.000 0.000 peak 11729 weight 0.10000E+01 volume 0.73900E+00 ppm1 1.734 ppm2 1.455 ASSI {11730} (segid " " and resid "113 " and name "HB ") (segid " " and resid "113 " and name "HG12") 5.000 5.000 0.000 peak 11730 weight 0.10000E+01 volume 0.55700E+00 ppm1 1.735 ppm2 1.354 ASSI {11731} (segid " " and resid "113 " and name "HD13") (segid " " and resid "113 " and name "HA ") 5.000 5.000 0.000 peak 11731 weight 0.10000E+01 volume -0.16650E+01 ppm1 0.739 ppm2 3.846 OR {11731} (segid " " and resid "113 " and name "HD12") (segid " " and resid "113 " and name "HA ") OR {11731} (segid " " and resid "113 " and name "HD11") (segid " " and resid "113 " and name "HA ") ASSI {11732} (segid " " and resid "113 " and name "HD13") (segid " " and resid "113 " and name "HB ") 3.300 3.300 0.000 peak 11732 weight 0.10000E+01 volume -0.25800E+01 ppm1 0.741 ppm2 1.739 OR {11732} (segid " " and resid "113 " and name "HD12") (segid " " and resid "113 " and name "HB ") OR {11732} (segid " " and resid "113 " and name "HD11") (segid " " and resid "113 " and name "HB ") ASSI {11733} (segid " " and resid "113 " and name "HD11") (segid " " and resid "113 " and name "HG11") 5.000 5.000 0.000 peak 11733 weight 0.10000E+01 volume -0.19240E+01 ppm1 0.744 ppm2 1.446 OR {11733} (segid " " and resid "113 " and name "HD13") (segid " " and resid "113 " and name "HG11") OR {11733} (segid " " and resid "113 " and name "HD12") (segid " " and resid "113 " and name "HG11") ASSI {11734} (segid " " and resid "113 " and name "HD12") (segid " " and resid "113 " and name "HG12") 5.000 5.000 0.000 peak 11734 weight 0.10000E+01 volume -0.16370E+01 ppm1 0.741 ppm2 1.335 OR {11734} (segid " " and resid "113 " and name "HD11") (segid " " and resid "113 " and name "HG12") OR {11734} (segid " " and resid "113 " and name "HD13") (segid " " and resid "113 " and name "HG12") ASSI {11737} (segid " " and resid "113 " and name "HG11") (segid " " and resid "113 " and name "HA ") 5.000 5.000 0.000 peak 11737 weight 0.10000E+01 volume -0.44000E+00 ppm1 1.439 ppm2 3.835 ASSI {11738} (segid " " and resid "113 " and name "HG12") (segid " " and resid "113 " and name "HA ") 5.000 5.000 0.000 peak 11738 weight 0.10000E+01 volume -0.33000E+00 ppm1 1.326 ppm2 3.835 ASSI {11739} (segid " " and resid "113 " and name "HG23") (segid " " and resid "113 " and name "HA ") 5.000 5.000 0.000 peak 11739 weight 0.10000E+01 volume -0.80000E+00 ppm1 0.739 ppm2 3.838 OR {11739} (segid " " and resid "113 " and name "HG22") (segid " " and resid "113 " and name "HA ") OR {11739} (segid " " and resid "113 " and name "HG21") (segid " " and resid "113 " and name "HA ") ASSI {11740} (segid " " and resid "113 " and name "HG23") (segid " " and resid "113 " and name "HB ") 3.300 3.300 0.000 peak 11740 weight 0.10000E+01 volume -0.26640E+01 ppm1 0.750 ppm2 1.736 OR {11740} (segid " " and resid "113 " and name "HG21") (segid " " and resid "113 " and name "HB ") OR {11740} (segid " " and resid "113 " and name "HG22") (segid " " and resid "113 " and name "HB ") ASSI {11741} (segid " " and resid "113 " and name "HG23") (segid " " and resid "113 " and name "HG12") 5.000 5.000 0.000 peak 11741 weight 0.10000E+01 volume -0.91800E+00 ppm1 0.739 ppm2 1.326 OR {11741} (segid " " and resid "113 " and name "HG21") (segid " " and resid "113 " and name "HG12") OR {11741} (segid " " and resid "113 " and name "HG22") (segid " " and resid "113 " and name "HG12") ASSI {11742} (segid " " and resid "114 " and name "HA ") (segid " " and resid "114 " and name "HB1 ") 5.000 5.000 0.000 peak 11742 weight 0.10000E+01 volume -0.17020E+01 ppm1 3.976 ppm2 3.656 ASSI {11743} (segid " " and resid "114 " and name "HA ") (segid " " and resid "114 " and name "HB2 ") 5.000 5.000 0.000 peak 11743 weight 0.10000E+01 volume -0.10750E+01 ppm1 3.978 ppm2 3.511 ASSI {11744} (segid " " and resid "114 " and name "HA ") (segid " " and resid "114 " and name "HD2 ") 6.000 6.000 0.000 peak 11744 weight 0.10000E+01 volume -0.26000E+00 ppm1 3.968 ppm2 6.957 ASSI {11746} (segid " " and resid "114 " and name "HB2 ") (segid " " and resid "114 " and name "HB1 ") 5.000 5.000 0.000 peak 11746 weight 0.10000E+01 volume -0.43800E+00 ppm1 3.507 ppm2 3.693 ASSI {11747} (segid " " and resid "114 " and name "HB1 ") (segid " " and resid "114 " and name "HD2 ") 6.000 6.000 0.000 peak 11747 weight 0.10000E+01 volume -0.13200E+00 ppm1 3.691 ppm2 6.954 ASSI {11748} (segid " " and resid "114 " and name "HB2 ") (segid " " and resid "114 " and name "HD2 ") 6.000 6.000 0.000 peak 11748 weight 0.10000E+01 volume -0.13700E+00 ppm1 3.506 ppm2 6.958 ASSI {11754} (segid " " and resid "114 " and name "HE1 ") (segid " " and resid "111 " and name "HD12") 5.000 5.000 0.000 peak 11754 weight 0.10000E+01 volume -0.33100E+00 ppm1 7.825 ppm2 1.200 OR {11754} (segid " " and resid "114 " and name "HE1 ") (segid " " and resid "111 " and name "HD11") OR {11754} (segid " " and resid "114 " and name "HE1 ") (segid " " and resid "111 " and name "HD13") ASSI {11756} (segid " " and resid "114 " and name "HE1 ") (segid " " and resid "136 " and name "HD2 ") 5.000 5.000 0.000 peak 11756 weight 0.10000E+01 volume -0.93600E+00 ppm1 7.826 ppm2 6.742 ASSI {11757} (segid " " and resid "115 " and name "HA ") (segid " " and resid "115 " and name "HB1 ") 5.000 5.000 0.000 peak 11757 weight 0.10000E+01 volume 0.12340E+01 ppm1 4.064 ppm2 2.210 ASSI {11758} (segid " " and resid "115 " and name "HA ") (segid " " and resid "115 " and name "HB2 ") 5.000 5.000 0.000 peak 11758 weight 0.10000E+01 volume 0.12790E+01 ppm1 4.064 ppm2 1.384 ASSI {11759} (segid " " and resid "115 " and name "HA ") (segid " " and resid "115 " and name "HD11") 5.000 5.000 0.000 peak 11759 weight 0.10000E+01 volume 0.78900E+00 ppm1 4.057 ppm2 1.222 OR {11759} (segid " " and resid "115 " and name "HA ") (segid " " and resid "115 " and name "HD12") OR {11759} (segid " " and resid "115 " and name "HA ") (segid " " and resid "115 " and name "HD13") ASSI {11760} (segid " " and resid "115 " and name "HA ") (segid " " and resid "115 " and name "HD23") 3.300 3.300 0.000 peak 11760 weight 0.10000E+01 volume 0.33200E+01 ppm1 4.064 ppm2 0.960 OR {11760} (segid " " and resid "115 " and name "HA ") (segid " " and resid "115 " and name "HD22") OR {11760} (segid " " and resid "115 " and name "HA ") (segid " " and resid "115 " and name "HD21") ASSI {11763} (segid " " and resid "115 " and name "HB2 ") (segid " " and resid "115 " and name "HB1 ") 5.000 5.000 0.000 peak 11763 weight 0.10000E+01 volume 0.89800E+00 ppm1 1.395 ppm2 2.208 ASSI {11765} (segid " " and resid "115 " and name "HB2 ") (segid " " and resid "115 " and name "HD12") 5.000 5.000 0.000 peak 11765 weight 0.10000E+01 volume 0.75600E+00 ppm1 1.389 ppm2 1.229 OR {11765} (segid " " and resid "115 " and name "HB2 ") (segid " " and resid "115 " and name "HD13") OR {11765} (segid " " and resid "115 " and name "HB2 ") (segid " " and resid "115 " and name "HD11") ASSI {11766} (segid " " and resid "115 " and name "HB1 ") (segid " " and resid "115 " and name "HD23") 5.000 5.000 0.000 peak 11766 weight 0.10000E+01 volume 0.12280E+01 ppm1 2.215 ppm2 0.954 OR {11766} (segid " " and resid "115 " and name "HB1 ") (segid " " and resid "115 " and name "HD21") OR {11766} (segid " " and resid "115 " and name "HB1 ") (segid " " and resid "115 " and name "HD22") ASSI {11767} (segid " " and resid "115 " and name "HB2 ") (segid " " and resid "115 " and name "HG ") 5.000 5.000 0.000 peak 11767 weight 0.10000E+01 volume 0.82700E+00 ppm1 1.400 ppm2 2.053 ASSI {11770} (segid " " and resid "115 " and name "HD12") (segid " " and resid "115 " and name "HB1 ") 5.000 5.000 0.000 peak 11770 weight 0.10000E+01 volume -0.10130E+01 ppm1 1.218 ppm2 2.224 OR {11770} (segid " " and resid "115 " and name "HD13") (segid " " and resid "115 " and name "HB1 ") OR {11770} (segid " " and resid "115 " and name "HD11") (segid " " and resid "115 " and name "HB1 ") ASSI {11771} (segid " " and resid "115 " and name "HD11") (segid " " and resid "115 " and name "HD23") 2.700 2.700 0.000 peak 11771 weight 0.10000E+01 volume -0.74730E+01 ppm1 1.219 ppm2 0.963 OR {11771} (segid " " and resid "115 " and name "HD11") (segid " " and resid "115 " and name "HD22") OR {11771} (segid " " and resid "115 " and name "HD11") (segid " " and resid "115 " and name "HD21") OR {11771} (segid " " and resid "115 " and name "HD12") (segid " " and resid "115 " and name "HD21") OR {11771} (segid " " and resid "115 " and name "HD13") (segid " " and resid "115 " and name "HD23") OR {11771} (segid " " and resid "115 " and name "HD12") (segid " " and resid "115 " and name "HD22") OR {11771} (segid " " and resid "115 " and name "HD13") (segid " " and resid "115 " and name "HD21") OR {11771} (segid " " and resid "115 " and name "HD12") (segid " " and resid "115 " and name "HD23") OR {11771} (segid " " and resid "115 " and name "HD13") (segid " " and resid "115 " and name "HD22") ASSI {11773} (segid " " and resid "115 " and name "HG ") (segid " " and resid "115 " and name "HD11") 5.000 5.000 0.000 peak 11773 weight 0.10000E+01 volume -0.19790E+01 ppm1 2.021 ppm2 1.227 OR {11773} (segid " " and resid "115 " and name "HG ") (segid " " and resid "115 " and name "HD13") OR {11773} (segid " " and resid "115 " and name "HG ") (segid " " and resid "115 " and name "HD12") ASSI {11774} (segid " " and resid "115 " and name "HG ") (segid " " and resid "115 " and name "HD21") 3.300 3.300 0.000 peak 11774 weight 0.10000E+01 volume -0.25700E+01 ppm1 2.024 ppm2 0.960 OR {11774} (segid " " and resid "115 " and name "HG ") (segid " " and resid "115 " and name "HD22") OR {11774} (segid " " and resid "115 " and name "HG ") (segid " " and resid "115 " and name "HD23") ASSI {11775} (segid " " and resid "116 " and name "HA ") (segid " " and resid "116 " and name "HB3 ") 2.700 2.700 0.000 peak 11775 weight 0.10000E+01 volume 0.11826E+02 ppm1 4.148 ppm2 1.492 OR {11775} (segid " " and resid "116 " and name "HA ") (segid " " and resid "116 " and name "HB1 ") OR {11775} (segid " " and resid "116 " and name "HA ") (segid " " and resid "116 " and name "HB2 ") ASSI {11776} (segid " " and resid "116 " and name "HA ") (segid " " and resid "121 " and name "HD2 ") 5.000 5.000 0.000 peak 11776 weight 0.10000E+01 volume 0.78500E+00 ppm1 4.153 ppm2 7.257 ASSI {11778} (segid " " and resid "116 " and name "HB3 ") (segid " " and resid "121 " and name "HD2 ") 5.000 5.000 0.000 peak 11778 weight 0.10000E+01 volume -0.43500E+00 ppm1 1.486 ppm2 7.257 OR {11778} (segid " " and resid "116 " and name "HB1 ") (segid " " and resid "121 " and name "HD2 ") OR {11778} (segid " " and resid "116 " and name "HB2 ") (segid " " and resid "121 " and name "HD2 ") ASSI {11779} (segid " " and resid "117 " and name "HA ") (segid " " and resid "117 " and name "HB ") 5.000 5.000 0.000 peak 11779 weight 0.10000E+01 volume -0.10420E+01 ppm1 3.514 ppm2 2.063 ASSI {11780} (segid " " and resid "117 " and name "HA ") (segid " " and resid "117 " and name "HD11") 5.000 5.000 0.000 peak 11780 weight 0.10000E+01 volume -0.15230E+01 ppm1 3.514 ppm2 0.899 OR {11780} (segid " " and resid "117 " and name "HA ") (segid " " and resid "117 " and name "HD13") OR {11780} (segid " " and resid "117 " and name "HA ") (segid " " and resid "117 " and name "HD12") ASSI {11781} (segid " " and resid "117 " and name "HA ") (segid " " and resid "117 " and name "HG22") 3.300 3.300 0.000 peak 11781 weight 0.10000E+01 volume -0.23140E+01 ppm1 3.514 ppm2 0.766 OR {11781} (segid " " and resid "117 " and name "HA ") (segid " " and resid "117 " and name "HG23") OR {11781} (segid " " and resid "117 " and name "HA ") (segid " " and resid "117 " and name "HG21") ASSI {11783} (segid " " and resid "117 " and name "HB ") (segid " " and resid "117 " and name "HD12") 3.300 3.300 0.000 peak 11783 weight 0.10000E+01 volume 0.22580E+01 ppm1 2.053 ppm2 0.894 OR {11783} (segid " " and resid "117 " and name "HB ") (segid " " and resid "117 " and name "HD13") OR {11783} (segid " " and resid "117 " and name "HB ") (segid " " and resid "117 " and name "HD11") ASSI {11784} (segid " " and resid "117 " and name "HB ") (segid " " and resid "117 " and name "HG21") 5.000 5.000 0.000 peak 11784 weight 0.10000E+01 volume 0.18250E+01 ppm1 2.066 ppm2 0.770 OR {11784} (segid " " and resid "117 " and name "HB ") (segid " " and resid "117 " and name "HG23") OR {11784} (segid " " and resid "117 " and name "HB ") (segid " " and resid "117 " and name "HG22") ASSI {11786} (segid " " and resid "117 " and name "HD12") (segid " " and resid "117 " and name "HG12") 2.700 2.700 0.000 peak 11786 weight 0.10000E+01 volume -0.14142E+02 ppm1 0.899 ppm2 0.766 OR {11786} (segid " " and resid "117 " and name "HD11") (segid " " and resid "117 " and name "HG12") OR {11786} (segid " " and resid "117 " and name "HD13") (segid " " and resid "117 " and name "HG12") ASSI {11787} (segid " " and resid "117 " and name "HG11") (segid " " and resid "117 " and name "HA ") 5.000 5.000 0.000 peak 11787 weight 0.10000E+01 volume -0.69000E+00 ppm1 2.060 ppm2 3.497 ASSI {11788} (segid " " and resid "117 " and name "HG12") (segid " " and resid "117 " and name "HA ") 6.000 6.000 0.000 peak 11788 weight 0.10000E+01 volume -0.23400E+00 ppm1 0.766 ppm2 3.514 ASSI {11789} (segid " " and resid "117 " and name "HG11") (segid " " and resid "117 " and name "HD11") 3.300 3.300 0.000 peak 11789 weight 0.10000E+01 volume -0.32440E+01 ppm1 2.066 ppm2 0.895 OR {11789} (segid " " and resid "117 " and name "HG11") (segid " " and resid "117 " and name "HD13") OR {11789} (segid " " and resid "117 " and name "HG11") (segid " " and resid "117 " and name "HD12") ASSI {11791} (segid " " and resid "117 " and name "HG12") (segid " " and resid "117 " and name "HG11") 5.000 5.000 0.000 peak 11791 weight 0.10000E+01 volume -0.70600E+00 ppm1 0.776 ppm2 2.064 ASSI {11792} (segid " " and resid "117 " and name "HG11") (segid " " and resid "117 " and name "HG22") 3.300 3.300 0.000 peak 11792 weight 0.10000E+01 volume -0.21300E+01 ppm1 2.070 ppm2 0.770 OR {11792} (segid " " and resid "117 " and name "HG11") (segid " " and resid "117 " and name "HG21") OR {11792} (segid " " and resid "117 " and name "HG11") (segid " " and resid "117 " and name "HG23") ASSI {11794} (segid " " and resid "117 " and name "HG23") (segid " " and resid "117 " and name "HD12") 2.700 2.700 0.000 peak 11794 weight 0.10000E+01 volume -0.63420E+01 ppm1 0.771 ppm2 0.903 OR {11794} (segid " " and resid "117 " and name "HG23") (segid " " and resid "117 " and name "HD11") OR {11794} (segid " " and resid "117 " and name "HG22") (segid " " and resid "117 " and name "HD11") OR {11794} (segid " " and resid "117 " and name "HG21") (segid " " and resid "117 " and name "HD12") OR {11794} (segid " " and resid "117 " and name "HG21") (segid " " and resid "117 " and name "HD11") OR {11794} (segid " " and resid "117 " and name "HG21") (segid " " and resid "117 " and name "HD13") OR {11794} (segid " " and resid "117 " and name "HG22") (segid " " and resid "117 " and name "HD12") OR {11794} (segid " " and resid "117 " and name "HG23") (segid " " and resid "117 " and name "HD13") OR {11794} (segid " " and resid "117 " and name "HG22") (segid " " and resid "117 " and name "HD13") ASSI {11796} (segid " " and resid "117 " and name "HG22") (segid " " and resid "151 " and name "HD1 ") 6.000 6.000 0.000 peak 11796 weight 0.10000E+01 volume -0.23800E+00 ppm1 0.776 ppm2 3.295 OR {11796} (segid " " and resid "117 " and name "HG21") (segid " " and resid "151 " and name "HD1 ") OR {11796} (segid " " and resid "117 " and name "HG23") (segid " " and resid "151 " and name "HD1 ") ASSI {11797} (segid " " and resid "117 " and name "HG23") (segid " " and resid "151 " and name "HD2 ") 5.000 5.000 0.000 peak 11797 weight 0.10000E+01 volume -0.32200E+00 ppm1 0.766 ppm2 2.981 OR {11797} (segid " " and resid "117 " and name "HG22") (segid " " and resid "151 " and name "HD2 ") OR {11797} (segid " " and resid "117 " and name "HG21") (segid " " and resid "151 " and name "HD2 ") ASSI {11799} (segid " " and resid "118 " and name "HA ") (segid " " and resid "118 " and name "HB1 ") 3.300 3.300 0.000 peak 11799 weight 0.10000E+01 volume -0.39540E+01 ppm1 3.677 ppm2 2.057 OR {11799} (segid " " and resid "118 " and name "HA ") (segid " " and resid "118 " and name "HB2 ") ASSI {11800} (segid " " and resid "118 " and name "HA ") (segid " " and resid "118 " and name "HD1 ") 5.000 5.000 0.000 peak 11800 weight 0.10000E+01 volume -0.86000E+00 ppm1 3.675 ppm2 3.278 ASSI {11801} (segid " " and resid "118 " and name "HA ") (segid " " and resid "118 " and name "HD2 ") 5.000 5.000 0.000 peak 11801 weight 0.10000E+01 volume -0.59100E+00 ppm1 3.680 ppm2 3.225 ASSI {11802} (segid " " and resid "118 " and name "HA ") (segid " " and resid "118 " and name "HG2 ") 5.000 5.000 0.000 peak 11802 weight 0.10000E+01 volume -0.13670E+01 ppm1 3.675 ppm2 1.620 ASSI {11803} (segid " " and resid "118 " and name "HA ") (segid " " and resid "151 " and name "HD2 ") 5.000 5.000 0.000 peak 11803 weight 0.10000E+01 volume -0.46600E+00 ppm1 3.675 ppm2 2.988 ASSI {11805} (segid " " and resid "118 " and name "HG1 ") (segid " " and resid "118 " and name "HA ") 5.000 5.000 0.000 peak 11805 weight 0.10000E+01 volume -0.83200E+00 ppm1 1.915 ppm2 3.676 ASSI {11807} (segid " " and resid "118 " and name "HG2 ") (segid " " and resid "118 " and name "HB1 ") 3.300 3.300 0.000 peak 11807 weight 0.10000E+01 volume -0.25660E+01 ppm1 1.620 ppm2 2.064 OR {11807} (segid " " and resid "118 " and name "HG2 ") (segid " " and resid "118 " and name "HB2 ") ASSI {11808} (segid " " and resid "118 " and name "HG2 ") (segid " " and resid "118 " and name "HG1 ") 2.700 2.700 0.000 peak 11808 weight 0.10000E+01 volume -0.49140E+01 ppm1 1.620 ppm2 1.914 ASSI {11810} (segid " " and resid "119 " and name "HA ") (segid " " and resid "119 " and name "HG1 ") 5.000 5.000 0.000 peak 11810 weight 0.10000E+01 volume 0.60100E+00 ppm1 4.263 ppm2 2.965 ASSI {11811} (segid " " and resid "119 " and name "HA ") (segid " " and resid "119 " and name "HG2 ") 5.000 5.000 0.000 peak 11811 weight 0.10000E+01 volume 0.79400E+00 ppm1 4.259 ppm2 2.422 ASSI {11812} (segid " " and resid "119 " and name "HB2 ") (segid " " and resid "119 " and name "HA ") 5.000 5.000 0.000 peak 11812 weight 0.10000E+01 volume -0.45700E+00 ppm1 1.576 ppm2 4.262 ASSI {11813} (segid " " and resid "119 " and name "HB2 ") (segid " " and resid "119 " and name "HB1 ") 5.000 5.000 0.000 peak 11813 weight 0.10000E+01 volume -0.18510E+01 ppm1 1.562 ppm2 2.067 ASSI {11814} (segid " " and resid "119 " and name "HB1 ") (segid " " and resid "119 " and name "HG1 ") 5.000 5.000 0.000 peak 11814 weight 0.10000E+01 volume -0.11540E+01 ppm1 2.062 ppm2 2.981 ASSI {11815} (segid " " and resid "119 " and name "HB2 ") (segid " " and resid "119 " and name "HG2 ") 5.000 5.000 0.000 peak 11815 weight 0.10000E+01 volume -0.46000E+00 ppm1 1.566 ppm2 2.420 ASSI {11819} (segid " " and resid "119 " and name "HG1 ") (segid " " and resid "119 " and name "HB2 ") 5.000 5.000 0.000 peak 11819 weight 0.10000E+01 volume 0.45300E+00 ppm1 2.964 ppm2 1.556 ASSI {11821} (segid " " and resid "119 " and name "HG2 ") (segid " " and resid "119 " and name "HG1 ") 5.000 5.000 0.000 peak 11821 weight 0.10000E+01 volume 0.93000E+00 ppm1 2.424 ppm2 2.960 ASSI {11823} (segid " " and resid "120 " and name "HA2 ") (segid " " and resid "120 " and name "HA1 ") 3.300 3.300 0.000 peak 11823 weight 0.10000E+01 volume 0.21450E+01 ppm1 3.535 ppm2 4.024 ASSI {11825} (segid " " and resid "121 " and name "HA ") (segid " " and resid "121 " and name "HB1 ") 5.000 5.000 0.000 peak 11825 weight 0.10000E+01 volume 0.10690E+01 ppm1 5.225 ppm2 3.148 ASSI {11826} (segid " " and resid "121 " and name "HA ") (segid " " and resid "121 " and name "HB2 ") 5.000 5.000 0.000 peak 11826 weight 0.10000E+01 volume 0.87300E+00 ppm1 5.223 ppm2 3.015 ASSI {11827} (segid " " and resid "121 " and name "HA ") (segid " " and resid "121 " and name "HD2 ") 6.000 6.000 0.000 peak 11827 weight 0.10000E+01 volume 0.39000E-01 ppm1 5.224 ppm2 7.258 ASSI {11833} (segid " " and resid "121 " and name "HD2 ") (segid " " and resid "121 " and name "HB1 ") 6.000 6.000 0.000 peak 11833 weight 0.10000E+01 volume -0.17300E+00 ppm1 7.263 ppm2 3.148 ASSI {11834} (segid " " and resid "121 " and name "HD2 ") (segid " " and resid "121 " and name "HB2 ") 5.000 5.000 0.000 peak 11834 weight 0.10000E+01 volume -0.31700E+00 ppm1 7.266 ppm2 3.010 ASSI {11835} (segid " " and resid "124 " and name "HA ") (segid " " and resid "124 " and name "HB ") 5.000 5.000 0.000 peak 11835 weight 0.10000E+01 volume -0.48700E+00 ppm1 3.755 ppm2 2.394 ASSI {11836} (segid " " and resid "124 " and name "HA ") (segid " " and resid "124 " and name "HG22") 2.700 2.700 0.000 peak 11836 weight 0.10000E+01 volume -0.56720E+01 ppm1 3.755 ppm2 0.956 OR {11836} (segid " " and resid "124 " and name "HA ") (segid " " and resid "124 " and name "HG23") OR {11836} (segid " " and resid "124 " and name "HA ") (segid " " and resid "124 " and name "HG21") OR {11836} (segid " " and resid "124 " and name "HA ") (segid " " and resid "124 " and name "HG12") OR {11836} (segid " " and resid "124 " and name "HA ") (segid " " and resid "124 " and name "HG13") OR {11836} (segid " " and resid "124 " and name "HA ") (segid " " and resid "124 " and name "HG11") ASSI {11837} (segid " " and resid "125 " and name "HA ") (segid " " and resid "125 " and name "HB ") 5.000 5.000 0.000 peak 11837 weight 0.10000E+01 volume -0.66100E+00 ppm1 3.367 ppm2 2.244 ASSI {11839} (segid " " and resid "127 " and name "HA ") (segid " " and resid "127 " and name "HB1 ") 5.000 5.000 0.000 peak 11839 weight 0.10000E+01 volume -0.15550E+01 ppm1 4.300 ppm2 3.407 ASSI {11840} (segid " " and resid "127 " and name "HA ") (segid " " and resid "127 " and name "HB2 ") 5.000 5.000 0.000 peak 11840 weight 0.10000E+01 volume -0.11950E+01 ppm1 4.303 ppm2 2.942 ASSI {11841} (segid " " and resid "127 " and name "HA ") (segid " " and resid "127 " and name "HD2 ") 5.000 5.000 0.000 peak 11841 weight 0.10000E+01 volume -0.16400E+01 ppm1 4.302 ppm2 7.128 OR {11841} (segid " " and resid "127 " and name "HA ") (segid " " and resid "127 " and name "HD1 ") ASSI {11846} (segid " " and resid "127 " and name "HB2 ") (segid " " and resid "127 " and name "HB1 ") 5.000 5.000 0.000 peak 11846 weight 0.10000E+01 volume 0.82200E+00 ppm1 2.943 ppm2 3.418 ASSI {11848} (segid " " and resid "127 " and name "HB1 ") (segid " " and resid "127 " and name "HD2 ") 5.000 5.000 0.000 peak 11848 weight 0.10000E+01 volume 0.54100E+00 ppm1 3.413 ppm2 7.129 OR {11848} (segid " " and resid "127 " and name "HB1 ") (segid " " and resid "127 " and name "HD1 ") ASSI {11849} (segid " " and resid "127 " and name "HB2 ") (segid " " and resid "127 " and name "HD2 ") 5.000 5.000 0.000 peak 11849 weight 0.10000E+01 volume 0.47900E+00 ppm1 2.949 ppm2 7.128 OR {11849} (segid " " and resid "127 " and name "HB2 ") (segid " " and resid "127 " and name "HD1 ") ASSI {11851} (segid " " and resid "127 " and name "HD1 ") (segid " " and resid "92 " and name "HD13") 5.000 5.000 0.000 peak 11851 weight 0.10000E+01 volume -0.97000E+00 ppm1 7.130 ppm2 0.952 OR {11851} (segid " " and resid "127 " and name "HD2 ") (segid " " and resid "92 " and name "HD11") OR {11851} (segid " " and resid "127 " and name "HD2 ") (segid " " and resid "92 " and name "HD13") OR {11851} (segid " " and resid "127 " and name "HD2 ") (segid " " and resid "92 " and name "HD12") OR {11851} (segid " " and resid "127 " and name "HD1 ") (segid " " and resid "92 " and name "HD11") OR {11851} (segid " " and resid "127 " and name "HD1 ") (segid " " and resid "92 " and name "HD12") ASSI {11852} (segid " " and resid "127 " and name "HD2 ") (segid " " and resid "96 " and name "HG11") 6.000 6.000 0.000 peak 11852 weight 0.10000E+01 volume -0.23400E+00 ppm1 7.134 ppm2 1.125 OR {11852} (segid " " and resid "127 " and name "HD1 ") (segid " " and resid "96 " and name "HG12") OR {11852} (segid " " and resid "127 " and name "HD2 ") (segid " " and resid "96 " and name "HG12") OR {11852} (segid " " and resid "127 " and name "HD2 ") (segid " " and resid "96 " and name "HG13") OR {11852} (segid " " and resid "127 " and name "HD1 ") (segid " " and resid "96 " and name "HG11") OR {11852} (segid " " and resid "127 " and name "HD1 ") (segid " " and resid "96 " and name "HG13") OR {11852} (segid " " and resid "127 " and name "HD1 ") (segid " " and resid "96 " and name "HG22") OR {11852} (segid " " and resid "127 " and name "HD2 ") (segid " " and resid "96 " and name "HG22") OR {11852} (segid " " and resid "127 " and name "HD2 ") (segid " " and resid "96 " and name "HG23") OR {11852} (segid " " and resid "127 " and name "HD1 ") (segid " " and resid "96 " and name "HG23") OR {11852} (segid " " and resid "127 " and name "HD1 ") (segid " " and resid "96 " and name "HG21") OR {11852} (segid " " and resid "127 " and name "HD2 ") (segid " " and resid "96 " and name "HG21") ASSI {11856} (segid " " and resid "127 " and name "HD1 ") (segid " " and resid "128 " and name "HG ") 6.000 6.000 0.000 peak 11856 weight 0.10000E+01 volume -0.24500E+00 ppm1 7.138 ppm2 2.013 OR {11856} (segid " " and resid "127 " and name "HD2 ") (segid " " and resid "128 " and name "HG ") ASSI {11858} (segid " " and resid "127 " and name "HE1 ") (segid " " and resid "96 " and name "HG12") 5.000 5.000 0.000 peak 11858 weight 0.10000E+01 volume -0.93900E+00 ppm1 7.214 ppm2 1.127 OR {11858} (segid " " and resid "127 " and name "HE1 ") (segid " " and resid "96 " and name "HG11") OR {11858} (segid " " and resid "127 " and name "HE2 ") (segid " " and resid "96 " and name "HG11") OR {11858} (segid " " and resid "127 " and name "HE1 ") (segid " " and resid "96 " and name "HG22") OR {11858} (segid " " and resid "127 " and name "HE2 ") (segid " " and resid "96 " and name "HG12") OR {11858} (segid " " and resid "127 " and name "HE2 ") (segid " " and resid "96 " and name "HG22") OR {11858} (segid " " and resid "127 " and name "HE2 ") (segid " " and resid "96 " and name "HG23") OR {11858} (segid " " and resid "127 " and name "HE2 ") (segid " " and resid "96 " and name "HG13") OR {11858} (segid " " and resid "127 " and name "HE1 ") (segid " " and resid "96 " and name "HG13") OR {11858} (segid " " and resid "127 " and name "HE1 ") (segid " " and resid "96 " and name "HG23") OR {11858} (segid " " and resid "127 " and name "HE2 ") (segid " " and resid "96 " and name "HG21") OR {11858} (segid " " and resid "127 " and name "HE1 ") (segid " " and resid "96 " and name "HG21") ASSI {11860} (segid " " and resid "127 " and name "HZ ") (segid " " and resid "96 " and name "HB ") 6.000 6.000 0.000 peak 11860 weight 0.10000E+01 volume -0.15700E+00 ppm1 7.329 ppm2 2.341 ASSI {11861} (segid " " and resid "127 " and name "HZ ") (segid " " and resid "96 " and name "HG13") 5.000 5.000 0.000 peak 11861 weight 0.10000E+01 volume -0.42300E+00 ppm1 7.334 ppm2 1.119 OR {11861} (segid " " and resid "127 " and name "HZ ") (segid " " and resid "96 " and name "HG12") OR {11861} (segid " " and resid "127 " and name "HZ ") (segid " " and resid "96 " and name "HG23") OR {11861} (segid " " and resid "127 " and name "HZ ") (segid " " and resid "96 " and name "HG11") OR {11861} (segid " " and resid "127 " and name "HZ ") (segid " " and resid "96 " and name "HG21") OR {11861} (segid " " and resid "127 " and name "HZ ") (segid " " and resid "96 " and name "HG22") ASSI {11862} (segid " " and resid "128 " and name "HB1 ") (segid " " and resid "128 " and name "HA ") 6.000 6.000 0.000 peak 11862 weight 0.10000E+01 volume 0.26000E+00 ppm1 1.731 ppm2 3.864 ASSI {11863} (segid " " and resid "128 " and name "HB2 ") (segid " " and resid "128 " and name "HA ") 5.000 5.000 0.000 peak 11863 weight 0.10000E+01 volume 0.39100E+00 ppm1 1.220 ppm2 3.859 ASSI {11864} (segid " " and resid "128 " and name "HB1 ") (segid " " and resid "128 " and name "HD11") 5.000 5.000 0.000 peak 11864 weight 0.10000E+01 volume 0.13030E+01 ppm1 1.730 ppm2 0.722 OR {11864} (segid " " and resid "128 " and name "HB1 ") (segid " " and resid "128 " and name "HD13") OR {11864} (segid " " and resid "128 " and name "HB1 ") (segid " " and resid "128 " and name "HD12") ASSI {11865} (segid " " and resid "128 " and name "HB2 ") (segid " " and resid "128 " and name "HD11") 5.000 5.000 0.000 peak 11865 weight 0.10000E+01 volume 0.14560E+01 ppm1 1.223 ppm2 0.718 OR {11865} (segid " " and resid "128 " and name "HB2 ") (segid " " and resid "128 " and name "HD13") OR {11865} (segid " " and resid "128 " and name "HB2 ") (segid " " and resid "128 " and name "HD12") ASSI {11867} (segid " " and resid "128 " and name "HG ") (segid " " and resid "128 " and name "HA ") 5.000 5.000 0.000 peak 11867 weight 0.10000E+01 volume -0.65200E+00 ppm1 2.020 ppm2 3.861 ASSI {11868} (segid " " and resid "130 " and name "HA ") (segid " " and resid "130 " and name "HB1 ") 5.000 5.000 0.000 peak 11868 weight 0.10000E+01 volume -0.14940E+01 ppm1 4.155 ppm2 2.287 ASSI {11869} (segid " " and resid "130 " and name "HA ") (segid " " and resid "130 " and name "HB2 ") 5.000 5.000 0.000 peak 11869 weight 0.10000E+01 volume -0.15350E+01 ppm1 4.155 ppm2 1.886 ASSI {11870} (segid " " and resid "130 " and name "HA ") (segid " " and resid "130 " and name "HD1 ") 6.000 6.000 0.000 peak 11870 weight 0.10000E+01 volume -0.18400E+00 ppm1 4.168 ppm2 3.476 ASSI {11871} (segid " " and resid "130 " and name "HA ") (segid " " and resid "130 " and name "HD2 ") 6.000 6.000 0.000 peak 11871 weight 0.10000E+01 volume -0.13600E+00 ppm1 4.166 ppm2 3.057 ASSI {11872} (segid " " and resid "130 " and name "HA ") (segid " " and resid "130 " and name "HG2 ") 5.000 5.000 0.000 peak 11872 weight 0.10000E+01 volume -0.66700E+00 ppm1 4.155 ppm2 1.753 ASSI {11876} (segid " " and resid "130 " and name "HB1 ") (segid " " and resid "130 " and name "HB2 ") 2.700 2.700 0.000 peak 11876 weight 0.10000E+01 volume -0.42040E+01 ppm1 2.287 ppm2 1.886 ASSI {11877} (segid " " and resid "130 " and name "HB1 ") (segid " " and resid "130 " and name "HD2 ") 5.000 5.000 0.000 peak 11877 weight 0.10000E+01 volume -0.35100E+00 ppm1 2.287 ppm2 3.061 ASSI {11878} (segid " " and resid "130 " and name "HB2 ") (segid " " and resid "130 " and name "HD2 ") 5.000 5.000 0.000 peak 11878 weight 0.10000E+01 volume -0.68700E+00 ppm1 1.886 ppm2 3.061 ASSI {11879} (segid " " and resid "130 " and name "HB1 ") (segid " " and resid "130 " and name "HG2 ") 3.300 3.300 0.000 peak 11879 weight 0.10000E+01 volume -0.23360E+01 ppm1 2.286 ppm2 1.764 ASSI {11880} (segid " " and resid "130 " and name "HD1 ") (segid " " and resid "130 " and name "HB1 ") 6.000 6.000 0.000 peak 11880 weight 0.10000E+01 volume 0.16500E+00 ppm1 3.462 ppm2 2.274 ASSI {11882} (segid " " and resid "130 " and name "HD2 ") (segid " " and resid "130 " and name "HD1 ") 5.000 5.000 0.000 peak 11882 weight 0.10000E+01 volume 0.16230E+01 ppm1 3.061 ppm2 3.470 ASSI {11884} (segid " " and resid "130 " and name "HD1 ") (segid " " and resid "130 " and name "HG1 ") 5.000 5.000 0.000 peak 11884 weight 0.10000E+01 volume 0.75400E+00 ppm1 3.477 ppm2 1.908 ASSI {11885} (segid " " and resid "130 " and name "HD2 ") (segid " " and resid "130 " and name "HG1 ") 5.000 5.000 0.000 peak 11885 weight 0.10000E+01 volume 0.55000E+00 ppm1 3.063 ppm2 1.908 ASSI {11886} (segid " " and resid "130 " and name "HD1 ") (segid " " and resid "130 " and name "HG2 ") 5.000 5.000 0.000 peak 11886 weight 0.10000E+01 volume 0.44300E+00 ppm1 3.464 ppm2 1.755 ASSI {11887} (segid " " and resid "130 " and name "HD2 ") (segid " " and resid "130 " and name "HG2 ") 5.000 5.000 0.000 peak 11887 weight 0.10000E+01 volume 0.43000E+00 ppm1 3.056 ppm2 1.759 ASSI {11888} (segid " " and resid "130 " and name "HG1 ") (segid " " and resid "130 " and name "HA ") 5.000 5.000 0.000 peak 11888 weight 0.10000E+01 volume -0.78100E+00 ppm1 1.913 ppm2 4.169 ASSI {11889} (segid " " and resid "130 " and name "HG1 ") (segid " " and resid "130 " and name "HB1 ") 5.000 5.000 0.000 peak 11889 weight 0.10000E+01 volume -0.19460E+01 ppm1 1.913 ppm2 2.287 ASSI {11894} (segid " " and resid "131 " and name "HA ") (segid " " and resid "131 " and name "HB1 ") 3.300 3.300 0.000 peak 11894 weight 0.10000E+01 volume 0.21520E+01 ppm1 4.551 ppm2 2.293 ASSI {11895} (segid " " and resid "131 " and name "HA ") (segid " " and resid "131 " and name "HB2 ") 5.000 5.000 0.000 peak 11895 weight 0.10000E+01 volume 0.14960E+01 ppm1 4.551 ppm2 1.485 ASSI {11896} (segid " " and resid "131 " and name "HA ") (segid " " and resid "131 " and name "HG1 ") 5.000 5.000 0.000 peak 11896 weight 0.10000E+01 volume 0.99300E+00 ppm1 4.550 ppm2 2.070 ASSI {11897} (segid " " and resid "131 " and name "HA ") (segid " " and resid "131 " and name "HG2 ") 5.000 5.000 0.000 peak 11897 weight 0.10000E+01 volume 0.10410E+01 ppm1 4.548 ppm2 1.972 ASSI {11900} (segid " " and resid "131 " and name "HB2 ") (segid " " and resid "131 " and name "HB1 ") 3.300 3.300 0.000 peak 11900 weight 0.10000E+01 volume -0.23920E+01 ppm1 1.486 ppm2 2.287 ASSI {11902} (segid " " and resid "131 " and name "HB2 ") (segid " " and resid "131 " and name "HG1 ") 5.000 5.000 0.000 peak 11902 weight 0.10000E+01 volume -0.14330E+01 ppm1 1.486 ppm2 2.062 ASSI {11903} (segid " " and resid "131 " and name "HB2 ") (segid " " and resid "131 " and name "HG2 ") 5.000 5.000 0.000 peak 11903 weight 0.10000E+01 volume -0.13360E+01 ppm1 1.486 ppm2 1.962 ASSI {11908} (segid " " and resid "132 " and name "HA ") (segid " " and resid "132 " and name "HB2 ") 5.000 5.000 0.000 peak 11908 weight 0.10000E+01 volume 0.15860E+01 ppm1 5.097 ppm2 3.525 OR {11908} (segid " " and resid "132 " and name "HA ") (segid " " and resid "132 " and name "HB1 ") ASSI {11910} (segid " " and resid "133 " and name "HA ") (segid " " and resid "133 " and name "HB1 ") 5.000 5.000 0.000 peak 11910 weight 0.10000E+01 volume 0.12990E+01 ppm1 4.682 ppm2 2.915 ASSI {11911} (segid " " and resid "133 " and name "HA ") (segid " " and resid "133 " and name "HB2 ") 5.000 5.000 0.000 peak 11911 weight 0.10000E+01 volume 0.17920E+01 ppm1 4.682 ppm2 2.579 ASSI {11914} (segid " " and resid "134 " and name "HB1 ") (segid " " and resid "134 " and name "HA ") 5.000 5.000 0.000 peak 11914 weight 0.10000E+01 volume 0.40900E+00 ppm1 1.676 ppm2 3.880 ASSI {11915} (segid " " and resid "134 " and name "HB2 ") (segid " " and resid "134 " and name "HA ") 5.000 5.000 0.000 peak 11915 weight 0.10000E+01 volume 0.43900E+00 ppm1 1.594 ppm2 3.882 ASSI {11916} (segid " " and resid "134 " and name "HB1 ") (segid " " and resid "134 " and name "HD13") 5.000 5.000 0.000 peak 11916 weight 0.10000E+01 volume 0.14420E+01 ppm1 1.678 ppm2 0.922 OR {11916} (segid " " and resid "134 " and name "HB1 ") (segid " " and resid "134 " and name "HD11") OR {11916} (segid " " and resid "134 " and name "HB1 ") (segid " " and resid "134 " and name "HD12") ASSI {11917} (segid " " and resid "134 " and name "HB2 ") (segid " " and resid "134 " and name "HD11") 3.300 3.300 0.000 peak 11917 weight 0.10000E+01 volume 0.20590E+01 ppm1 1.587 ppm2 0.915 OR {11917} (segid " " and resid "134 " and name "HB2 ") (segid " " and resid "134 " and name "HD13") OR {11917} (segid " " and resid "134 " and name "HB2 ") (segid " " and resid "134 " and name "HD12") ASSI {11918} (segid " " and resid "134 " and name "HB1 ") (segid " " and resid "134 " and name "HD22") 5.000 5.000 0.000 peak 11918 weight 0.10000E+01 volume 0.72300E+00 ppm1 1.676 ppm2 0.698 OR {11918} (segid " " and resid "134 " and name "HB1 ") (segid " " and resid "134 " and name "HD23") OR {11918} (segid " " and resid "134 " and name "HB1 ") (segid " " and resid "134 " and name "HD21") ASSI {11919} (segid " " and resid "134 " and name "HB2 ") (segid " " and resid "134 " and name "HD21") 5.000 5.000 0.000 peak 11919 weight 0.10000E+01 volume 0.65000E+00 ppm1 1.598 ppm2 0.692 OR {11919} (segid " " and resid "134 " and name "HB2 ") (segid " " and resid "134 " and name "HD22") OR {11919} (segid " " and resid "134 " and name "HB2 ") (segid " " and resid "134 " and name "HD23") ASSI {11920} (segid " " and resid "134 " and name "HB1 ") (segid " " and resid "134 " and name "HG ") 5.000 5.000 0.000 peak 11920 weight 0.10000E+01 volume 0.11220E+01 ppm1 1.677 ppm2 1.959 ASSI {11921} (segid " " and resid "134 " and name "HB2 ") (segid " " and resid "134 " and name "HG ") 5.000 5.000 0.000 peak 11921 weight 0.10000E+01 volume 0.71300E+00 ppm1 1.588 ppm2 1.961 ASSI {11922} (segid " " and resid "135 " and name "HA ") (segid " " and resid "135 " and name "HB1 ") 5.000 5.000 0.000 peak 11922 weight 0.10000E+01 volume 0.10440E+01 ppm1 4.716 ppm2 3.310 ASSI {11923} (segid " " and resid "135 " and name "HA ") (segid " " and resid "135 " and name "HB2 ") 5.000 5.000 0.000 peak 11923 weight 0.10000E+01 volume 0.91300E+00 ppm1 4.718 ppm2 3.076 ASSI {11926} (segid " " and resid "135 " and name "HB2 ") (segid " " and resid "135 " and name "HB1 ") 5.000 5.000 0.000 peak 11926 weight 0.10000E+01 volume -0.13910E+01 ppm1 3.087 ppm2 3.321 ASSI {11928} (segid " " and resid "135 " and name "HB2 ") (segid " " and resid "135 " and name "HD2 ") 6.000 6.000 0.000 peak 11928 weight 0.10000E+01 volume -0.47000E-01 ppm1 3.093 ppm2 7.079 ASSI {11929} (segid " " and resid "136 " and name "HA ") (segid " " and resid "136 " and name "HB1 ") 5.000 5.000 0.000 peak 11929 weight 0.10000E+01 volume 0.10790E+01 ppm1 4.262 ppm2 3.293 ASSI {11930} (segid " " and resid "136 " and name "HA ") (segid " " and resid "136 " and name "HB2 ") 5.000 5.000 0.000 peak 11930 weight 0.10000E+01 volume 0.15670E+01 ppm1 4.262 ppm2 3.053 ASSI {11931} (segid " " and resid "136 " and name "HA ") (segid " " and resid "136 " and name "HD2 ") 6.000 6.000 0.000 peak 11931 weight 0.10000E+01 volume 0.96000E-01 ppm1 4.267 ppm2 6.743 ASSI {11934} (segid " " and resid "136 " and name "HB2 ") (segid " " and resid "136 " and name "HB1 ") 3.300 3.300 0.000 peak 11934 weight 0.10000E+01 volume -0.20670E+01 ppm1 3.071 ppm2 3.287 ASSI {11936} (segid " " and resid "136 " and name "HB1 ") (segid " " and resid "136 " and name "HD2 ") 6.000 6.000 0.000 peak 11936 weight 0.10000E+01 volume -0.13000E+00 ppm1 3.291 ppm2 6.733 ASSI {11937} (segid " " and resid "136 " and name "HB2 ") (segid " " and resid "136 " and name "HD2 ") 6.000 6.000 0.000 peak 11937 weight 0.10000E+01 volume -0.75000E-01 ppm1 3.051 ppm2 6.752 ASSI {11945} (segid " " and resid "137 " and name "HA ") (segid " " and resid "137 " and name "HB2 ") 3.300 3.300 0.000 peak 11945 weight 0.10000E+01 volume 0.21320E+01 ppm1 4.219 ppm2 1.252 ASSI {11946} (segid " " and resid "137 " and name "HA ") (segid " " and resid "137 " and name "HD2 ") 5.000 5.000 0.000 peak 11946 weight 0.10000E+01 volume 0.61800E+00 ppm1 4.219 ppm2 3.148 OR {11946} (segid " " and resid "137 " and name "HA ") (segid " " and resid "137 " and name "HD1 ") ASSI {11947} (segid " " and resid "137 " and name "HA ") (segid " " and resid "137 " and name "HG1 ") 5.000 5.000 0.000 peak 11947 weight 0.10000E+01 volume 0.14120E+01 ppm1 4.224 ppm2 1.675 ASSI {11948} (segid " " and resid "137 " and name "HB1 ") (segid " " and resid "137 " and name "HA ") 5.000 5.000 0.000 peak 11948 weight 0.10000E+01 volume -0.50700E+00 ppm1 1.541 ppm2 4.227 ASSI {11950} (segid " " and resid "137 " and name "HB2 ") (segid " " and resid "137 " and name "HB1 ") 5.000 5.000 0.000 peak 11950 weight 0.10000E+01 volume -0.11860E+01 ppm1 1.262 ppm2 1.542 ASSI {11952} (segid " " and resid "137 " and name "HB1 ") (segid " " and resid "137 " and name "HD2 ") 5.000 5.000 0.000 peak 11952 weight 0.10000E+01 volume -0.70000E+00 ppm1 1.540 ppm2 3.167 OR {11952} (segid " " and resid "137 " and name "HB1 ") (segid " " and resid "137 " and name "HD1 ") ASSI {11953} (segid " " and resid "137 " and name "HB2 ") (segid " " and resid "137 " and name "HD2 ") 5.000 5.000 0.000 peak 11953 weight 0.10000E+01 volume -0.60600E+00 ppm1 1.273 ppm2 3.167 OR {11953} (segid " " and resid "137 " and name "HB2 ") (segid " " and resid "137 " and name "HD1 ") ASSI {11955} (segid " " and resid "137 " and name "HB2 ") (segid " " and resid "137 " and name "HG2 ") 5.000 5.000 0.000 peak 11955 weight 0.10000E+01 volume -0.90400E+00 ppm1 1.260 ppm2 1.438 ASSI {11956} (segid " " and resid "137 " and name "HG1 ") (segid " " and resid "137 " and name "HD2 ") 5.000 5.000 0.000 peak 11956 weight 0.10000E+01 volume -0.12970E+01 ppm1 1.673 ppm2 3.154 OR {11956} (segid " " and resid "137 " and name "HG1 ") (segid " " and resid "137 " and name "HD1 ") ASSI {11957} (segid " " and resid "137 " and name "HG2 ") (segid " " and resid "137 " and name "HD1 ") 5.000 5.000 0.000 peak 11957 weight 0.10000E+01 volume -0.77500E+00 ppm1 1.433 ppm2 3.141 OR {11957} (segid " " and resid "137 " and name "HG2 ") (segid " " and resid "137 " and name "HD2 ") ASSI {11958} (segid " " and resid "138 " and name "HA ") (segid " " and resid "138 " and name "HB1 ") 5.000 5.000 0.000 peak 11958 weight 0.10000E+01 volume 0.95600E+00 ppm1 4.578 ppm2 2.854 ASSI {11959} (segid " " and resid "138 " and name "HA ") (segid " " and resid "138 " and name "HB2 ") 5.000 5.000 0.000 peak 11959 weight 0.10000E+01 volume 0.99700E+00 ppm1 4.579 ppm2 1.624 ASSI {11962} (segid " " and resid "138 " and name "HB2 ") (segid " " and resid "138 " and name "HB1 ") 5.000 5.000 0.000 peak 11962 weight 0.10000E+01 volume 0.73900E+00 ppm1 1.621 ppm2 2.857 ASSI {11964} (segid " " and resid "140 " and name "HA ") (segid " " and resid "140 " and name "HB1 ") 3.300 3.300 0.000 peak 11964 weight 0.10000E+01 volume 0.23790E+01 ppm1 4.511 ppm2 4.103 ASSI {11965} (segid " " and resid "140 " and name "HA ") (segid " " and resid "140 " and name "HB2 ") 2.700 2.700 0.000 peak 11965 weight 0.10000E+01 volume 0.47180E+01 ppm1 4.520 ppm2 3.921 ASSI {11968} (segid " " and resid "140 " and name "HB2 ") (segid " " and resid "140 " and name "HB1 ") 2.700 2.700 0.000 peak 11968 weight 0.10000E+01 volume -0.83050E+01 ppm1 3.915 ppm2 4.102 ASSI {11970} (segid " " and resid "141 " and name "HA2 ") (segid " " and resid "141 " and name "HA1 ") 3.300 3.300 0.000 peak 11970 weight 0.10000E+01 volume 0.24470E+01 ppm1 3.691 ppm2 4.310 ASSI {11972} (segid " " and resid "142 " and name "HA ") (segid " " and resid "142 " and name "HB1 ") 5.000 5.000 0.000 peak 11972 weight 0.10000E+01 volume 0.81300E+00 ppm1 4.978 ppm2 2.070 ASSI {11973} (segid " " and resid "142 " and name "HA ") (segid " " and resid "142 " and name "HB2 ") 5.000 5.000 0.000 peak 11973 weight 0.10000E+01 volume 0.75900E+00 ppm1 4.966 ppm2 1.323 ASSI {11974} (segid " " and resid "142 " and name "HA ") (segid " " and resid "142 " and name "HD11") 5.000 5.000 0.000 peak 11974 weight 0.10000E+01 volume 0.50400E+00 ppm1 4.972 ppm2 0.890 OR {11974} (segid " " and resid "142 " and name "HA ") (segid " " and resid "142 " and name "HD12") OR {11974} (segid " " and resid "142 " and name "HA ") (segid " " and resid "142 " and name "HD13") ASSI {11975} (segid " " and resid "142 " and name "HA ") (segid " " and resid "142 " and name "HD23") 5.000 5.000 0.000 peak 11975 weight 0.10000E+01 volume 0.16560E+01 ppm1 4.975 ppm2 0.745 OR {11975} (segid " " and resid "142 " and name "HA ") (segid " " and resid "142 " and name "HD21") OR {11975} (segid " " and resid "142 " and name "HA ") (segid " " and resid "142 " and name "HD22") ASSI {11976} (segid " " and resid "142 " and name "HA ") (segid " " and resid "142 " and name "HG ") 5.000 5.000 0.000 peak 11976 weight 0.10000E+01 volume 0.62400E+00 ppm1 4.974 ppm2 1.511 ASSI {11980} (segid " " and resid "142 " and name "HB1 ") (segid " " and resid "142 " and name "HD23") 5.000 5.000 0.000 peak 11980 weight 0.10000E+01 volume 0.50200E+00 ppm1 2.047 ppm2 0.743 OR {11980} (segid " " and resid "142 " and name "HB1 ") (segid " " and resid "142 " and name "HD21") OR {11980} (segid " " and resid "142 " and name "HB1 ") (segid " " and resid "142 " and name "HD22") ASSI {11982} (segid " " and resid "142 " and name "HD11") (segid " " and resid "142 " and name "HB1 ") 3.300 3.300 0.000 peak 11982 weight 0.10000E+01 volume -0.21820E+01 ppm1 0.899 ppm2 2.073 OR {11982} (segid " " and resid "142 " and name "HD12") (segid " " and resid "142 " and name "HB1 ") OR {11982} (segid " " and resid "142 " and name "HD13") (segid " " and resid "142 " and name "HB1 ") ASSI {11983} (segid " " and resid "142 " and name "HD11") (segid " " and resid "142 " and name "HB2 ") 3.300 3.300 0.000 peak 11983 weight 0.10000E+01 volume -0.25230E+01 ppm1 0.891 ppm2 1.331 OR {11983} (segid " " and resid "142 " and name "HD12") (segid " " and resid "142 " and name "HB2 ") OR {11983} (segid " " and resid "142 " and name "HD13") (segid " " and resid "142 " and name "HB2 ") ASSI {11984} (segid " " and resid "142 " and name "HD12") (segid " " and resid "142 " and name "HG ") 3.300 3.300 0.000 peak 11984 weight 0.10000E+01 volume -0.38350E+01 ppm1 0.893 ppm2 1.513 OR {11984} (segid " " and resid "142 " and name "HD13") (segid " " and resid "142 " and name "HG ") OR {11984} (segid " " and resid "142 " and name "HD11") (segid " " and resid "142 " and name "HG ") ASSI {11986} (segid " " and resid "142 " and name "HD23") (segid " " and resid "142 " and name "HG ") 2.700 2.700 0.000 peak 11986 weight 0.10000E+01 volume -0.49960E+01 ppm1 0.739 ppm2 1.513 OR {11986} (segid " " and resid "142 " and name "HD21") (segid " " and resid "142 " and name "HG ") OR {11986} (segid " " and resid "142 " and name "HD22") (segid " " and resid "142 " and name "HG ") ASSI {11988} (segid " " and resid "142 " and name "HG ") (segid " " and resid "142 " and name "HB1 ") 5.000 5.000 0.000 peak 11988 weight 0.10000E+01 volume -0.95500E+00 ppm1 1.513 ppm2 2.073 ASSI {11990} (segid " " and resid "143 " and name "HA ") (segid " " and resid "143 " and name "HB ") 5.000 5.000 0.000 peak 11990 weight 0.10000E+01 volume -0.43600E+00 ppm1 5.382 ppm2 4.689 ASSI {11991} (segid " " and resid "143 " and name "HA ") (segid " " and resid "143 " and name "HG23") 5.000 5.000 0.000 peak 11991 weight 0.10000E+01 volume -0.85300E+00 ppm1 5.382 ppm2 1.246 OR {11991} (segid " " and resid "143 " and name "HA ") (segid " " and resid "143 " and name "HG21") OR {11991} (segid " " and resid "143 " and name "HA ") (segid " " and resid "143 " and name "HG22") ASSI {11995} (segid " " and resid "143 " and name "HG22") (segid " " and resid "143 " and name "HB ") 3.300 3.300 0.000 peak 11995 weight 0.10000E+01 volume -0.27620E+01 ppm1 1.246 ppm2 4.689 OR {11995} (segid " " and resid "143 " and name "HG21") (segid " " and resid "143 " and name "HB ") OR {11995} (segid " " and resid "143 " and name "HG23") (segid " " and resid "143 " and name "HB ") ASSI {11996} (segid " " and resid "144 " and name "HA ") (segid " " and resid "144 " and name "HB2 ") 5.000 5.000 0.000 peak 11996 weight 0.10000E+01 volume -0.87300E+00 ppm1 3.689 ppm2 1.779 ASSI {11997} (segid " " and resid "144 " and name "HD1 ") (segid " " and resid "143 " and name "HA ") 5.000 5.000 0.000 peak 11997 weight 0.10000E+01 volume 0.63800E+00 ppm1 4.305 ppm2 5.370 ASSI {11998} (segid " " and resid "144 " and name "HD2 ") (segid " " and resid "143 " and name "HA ") 6.000 6.000 0.000 peak 11998 weight 0.10000E+01 volume 0.25100E+00 ppm1 3.746 ppm2 5.375 ASSI {11999} (segid " " and resid "144 " and name "HD1 ") (segid " " and resid "143 " and name "HB ") 5.000 5.000 0.000 peak 11999 weight 0.10000E+01 volume 0.34800E+00 ppm1 4.291 ppm2 4.689 ASSI {12000} (segid " " and resid "144 " and name "HD2 ") (segid " " and resid "143 " and name "HB ") 5.000 5.000 0.000 peak 12000 weight 0.10000E+01 volume 0.36000E+00 ppm1 3.733 ppm2 4.696 ASSI {12001} (segid " " and resid "144 " and name "HD2 ") (segid " " and resid "144 " and name "HD1 ") 6.000 6.000 0.000 peak 12001 weight 0.10000E+01 volume 0.29800E+00 ppm1 3.725 ppm2 4.297 ASSI {12002} (segid " " and resid "144 " and name "HD1 ") (segid " " and resid "144 " and name "HG1 ") 5.000 5.000 0.000 peak 12002 weight 0.10000E+01 volume 0.48600E+00 ppm1 4.297 ppm2 1.689 ASSI {12003} (segid " " and resid "144 " and name "HD2 ") (segid " " and resid "144 " and name "HG1 ") 6.000 6.000 0.000 peak 12003 weight 0.10000E+01 volume 0.20600E+00 ppm1 3.730 ppm2 1.680 ASSI {12004} (segid " " and resid "144 " and name "HD1 ") (segid " " and resid "144 " and name "HG2 ") 6.000 6.000 0.000 peak 12004 weight 0.10000E+01 volume 0.14800E+00 ppm1 4.294 ppm2 0.552 ASSI {12005} (segid " " and resid "144 " and name "HD2 ") (segid " " and resid "144 " and name "HG2 ") 6.000 6.000 0.000 peak 12005 weight 0.10000E+01 volume 0.14200E+00 ppm1 3.714 ppm2 0.538 ASSI {12006} (segid " " and resid "144 " and name "HG1 ") (segid " " and resid "144 " and name "HG2 ") 5.000 5.000 0.000 peak 12006 weight 0.10000E+01 volume -0.50300E+00 ppm1 1.678 ppm2 0.547 ASSI {12007} (segid " " and resid "145 " and name "HA ") (segid " " and resid "145 " and name "HB1 ") 3.300 3.300 0.000 peak 12007 weight 0.10000E+01 volume 0.25740E+01 ppm1 3.931 ppm2 1.754 ASSI {12008} (segid " " and resid "145 " and name "HA ") (segid " " and resid "145 " and name "HB2 ") 3.300 3.300 0.000 peak 12008 weight 0.10000E+01 volume 0.25250E+01 ppm1 3.936 ppm2 1.404 ASSI {12009} (segid " " and resid "145 " and name "HA ") (segid " " and resid "145 " and name "HG ") 5.000 5.000 0.000 peak 12009 weight 0.10000E+01 volume 0.19450E+01 ppm1 3.931 ppm2 1.531 ASSI {12013} (segid " " and resid "145 " and name "HB1 ") (segid " " and resid "145 " and name "HB2 ") 3.300 3.300 0.000 peak 12013 weight 0.10000E+01 volume 0.20990E+01 ppm1 1.751 ppm2 1.403 ASSI {12014} (segid " " and resid "145 " and name "HB2 ") (segid " " and resid "145 " and name "HG ") 3.300 3.300 0.000 peak 12014 weight 0.10000E+01 volume 0.25130E+01 ppm1 1.404 ppm2 1.539 ASSI {12015} (segid " " and resid "145 " and name "HD11") (segid " " and resid "145 " and name "HB1 ") 2.700 2.700 0.000 peak 12015 weight 0.10000E+01 volume -0.44220E+01 ppm1 0.952 ppm2 1.753 OR {12015} (segid " " and resid "145 " and name "HD12") (segid " " and resid "145 " and name "HB1 ") OR {12015} (segid " " and resid "145 " and name "HD13") (segid " " and resid "145 " and name "HB1 ") ASSI {12016} (segid " " and resid "145 " and name "HD13") (segid " " and resid "145 " and name "HB2 ") 2.700 2.700 0.000 peak 12016 weight 0.10000E+01 volume -0.41030E+01 ppm1 0.952 ppm2 1.406 OR {12016} (segid " " and resid "145 " and name "HD12") (segid " " and resid "145 " and name "HB2 ") OR {12016} (segid " " and resid "145 " and name "HD11") (segid " " and resid "145 " and name "HB2 ") ASSI {12017} (segid " " and resid "145 " and name "HD11") (segid " " and resid "145 " and name "HG ") 2.700 2.700 0.000 peak 12017 weight 0.10000E+01 volume -0.50690E+01 ppm1 0.952 ppm2 1.540 OR {12017} (segid " " and resid "145 " and name "HD13") (segid " " and resid "145 " and name "HG ") OR {12017} (segid " " and resid "145 " and name "HD12") (segid " " and resid "145 " and name "HG ") ASSI {12018} (segid " " and resid "145 " and name "HD23") (segid " " and resid "145 " and name "HG ") 2.700 2.700 0.000 peak 12018 weight 0.10000E+01 volume -0.10814E+02 ppm1 1.006 ppm2 1.525 OR {12018} (segid " " and resid "145 " and name "HD22") (segid " " and resid "145 " and name "HG ") OR {12018} (segid " " and resid "145 " and name "HD21") (segid " " and resid "145 " and name "HG ") ASSI {12020} (segid " " and resid "146 " and name "HG1 ") (segid " " and resid "146 " and name "HA ") 5.000 5.000 0.000 peak 12020 weight 0.10000E+01 volume 0.62700E+00 ppm1 2.424 ppm2 3.995 ASSI {12021} (segid " " and resid "146 " and name "HG2 ") (segid " " and resid "146 " and name "HA ") 5.000 5.000 0.000 peak 12021 weight 0.10000E+01 volume 0.66600E+00 ppm1 2.334 ppm2 3.998 ASSI {12022} (segid " " and resid "147 " and name "HA ") (segid " " and resid "147 " and name "HB1 ") 3.300 3.300 0.000 peak 12022 weight 0.10000E+01 volume 0.21590E+01 ppm1 4.209 ppm2 2.125 ASSI {12023} (segid " " and resid "147 " and name "HA ") (segid " " and resid "147 " and name "HD11") 5.000 5.000 0.000 peak 12023 weight 0.10000E+01 volume 0.12800E+01 ppm1 4.213 ppm2 1.185 OR {12023} (segid " " and resid "147 " and name "HA ") (segid " " and resid "147 " and name "HD13") OR {12023} (segid " " and resid "147 " and name "HA ") (segid " " and resid "147 " and name "HD12") ASSI {12024} (segid " " and resid "147 " and name "HA ") (segid " " and resid "147 " and name "HD23") 3.300 3.300 0.000 peak 12024 weight 0.10000E+01 volume 0.34580E+01 ppm1 4.209 ppm2 1.043 OR {12024} (segid " " and resid "147 " and name "HA ") (segid " " and resid "147 " and name "HD22") OR {12024} (segid " " and resid "147 " and name "HA ") (segid " " and resid "147 " and name "HD21") ASSI {12026} (segid " " and resid "147 " and name "HB2 ") (segid " " and resid "147 " and name "HA ") 5.000 5.000 0.000 peak 12026 weight 0.10000E+01 volume 0.48000E+00 ppm1 1.562 ppm2 4.207 ASSI {12028} (segid " " and resid "147 " and name "HB1 ") (segid " " and resid "147 " and name "HB2 ") 3.300 3.300 0.000 peak 12028 weight 0.10000E+01 volume 0.25480E+01 ppm1 2.137 ppm2 1.551 ASSI {12029} (segid " " and resid "147 " and name "HB2 ") (segid " " and resid "147 " and name "HD13") 5.000 5.000 0.000 peak 12029 weight 0.10000E+01 volume 0.10690E+01 ppm1 1.556 ppm2 1.190 OR {12029} (segid " " and resid "147 " and name "HB2 ") (segid " " and resid "147 " and name "HD11") OR {12029} (segid " " and resid "147 " and name "HB2 ") (segid " " and resid "147 " and name "HD12") ASSI {12030} (segid " " and resid "147 " and name "HB2 ") (segid " " and resid "147 " and name "HD22") 5.000 5.000 0.000 peak 12030 weight 0.10000E+01 volume 0.11350E+01 ppm1 1.565 ppm2 1.048 OR {12030} (segid " " and resid "147 " and name "HB2 ") (segid " " and resid "147 " and name "HD21") OR {12030} (segid " " and resid "147 " and name "HB2 ") (segid " " and resid "147 " and name "HD23") ASSI {12031} (segid " " and resid "147 " and name "HB1 ") (segid " " and resid "147 " and name "HG ") 3.300 3.300 0.000 peak 12031 weight 0.10000E+01 volume 0.25230E+01 ppm1 2.134 ppm2 1.472 ASSI {12034} (segid " " and resid "147 " and name "HD13") (segid " " and resid "147 " and name "HD23") 2.700 2.700 0.000 peak 12034 weight 0.10000E+01 volume -0.70190E+01 ppm1 1.193 ppm2 1.048 OR {12034} (segid " " and resid "147 " and name "HD11") (segid " " and resid "147 " and name "HD23") OR {12034} (segid " " and resid "147 " and name "HD13") (segid " " and resid "147 " and name "HD21") OR {12034} (segid " " and resid "147 " and name "HD12") (segid " " and resid "147 " and name "HD23") OR {12034} (segid " " and resid "147 " and name "HD13") (segid " " and resid "147 " and name "HD22") OR {12034} (segid " " and resid "147 " and name "HD12") (segid " " and resid "147 " and name "HD22") OR {12034} (segid " " and resid "147 " and name "HD12") (segid " " and resid "147 " and name "HD21") OR {12034} (segid " " and resid "147 " and name "HD11") (segid " " and resid "147 " and name "HD22") OR {12034} (segid " " and resid "147 " and name "HD11") (segid " " and resid "147 " and name "HD21") ASSI {12035} (segid " " and resid "147 " and name "HD12") (segid " " and resid "147 " and name "HG ") 3.300 3.300 0.000 peak 12035 weight 0.10000E+01 volume -0.30430E+01 ppm1 1.193 ppm2 1.487 OR {12035} (segid " " and resid "147 " and name "HD13") (segid " " and resid "147 " and name "HG ") OR {12035} (segid " " and resid "147 " and name "HD11") (segid " " and resid "147 " and name "HG ") ASSI {12038} (segid " " and resid "147 " and name "HD21") (segid " " and resid "147 " and name "HB1 ") 3.300 3.300 0.000 peak 12038 weight 0.10000E+01 volume -0.32670E+01 ppm1 1.032 ppm2 2.127 OR {12038} (segid " " and resid "147 " and name "HD23") (segid " " and resid "147 " and name "HB1 ") OR {12038} (segid " " and resid "147 " and name "HD22") (segid " " and resid "147 " and name "HB1 ") ASSI {12040} (segid " " and resid "147 " and name "HG ") (segid " " and resid "147 " and name "HA ") 5.000 5.000 0.000 peak 12040 weight 0.10000E+01 volume -0.45400E+00 ppm1 1.486 ppm2 4.208 ASSI {12043} (segid " " and resid "148 " and name "HB3 ") (segid " " and resid "148 " and name "HA ") 2.700 2.700 0.000 peak 12043 weight 0.10000E+01 volume -0.43960E+01 ppm1 1.433 ppm2 3.742 OR {12043} (segid " " and resid "148 " and name "HB2 ") (segid " " and resid "148 " and name "HA ") OR {12043} (segid " " and resid "148 " and name "HB1 ") (segid " " and resid "148 " and name "HA ") ASSI {12044} (segid " " and resid "149 " and name "HA ") (segid " " and resid "149 " and name "HB1 ") 5.000 5.000 0.000 peak 12044 weight 0.10000E+01 volume -0.19930E+01 ppm1 4.339 ppm2 1.973 ASSI {12045} (segid " " and resid "149 " and name "HA ") (segid " " and resid "149 " and name "HB2 ") 5.000 5.000 0.000 peak 12045 weight 0.10000E+01 volume -0.18950E+01 ppm1 4.336 ppm2 1.868 ASSI {12046} (segid " " and resid "149 " and name "HA ") (segid " " and resid "149 " and name "HD2 ") 5.000 5.000 0.000 peak 12046 weight 0.10000E+01 volume -0.45900E+00 ppm1 4.336 ppm2 3.255 OR {12046} (segid " " and resid "149 " and name "HA ") (segid " " and resid "149 " and name "HD1 ") ASSI {12047} (segid " " and resid "149 " and name "HA ") (segid " " and resid "149 " and name "HG1 ") 5.000 5.000 0.000 peak 12047 weight 0.10000E+01 volume -0.16350E+01 ppm1 4.336 ppm2 1.757 ASSI {12048} (segid " " and resid "149 " and name "HA ") (segid " " and resid "149 " and name "HG2 ") 5.000 5.000 0.000 peak 12048 weight 0.10000E+01 volume -0.12020E+01 ppm1 4.335 ppm2 1.578 ASSI {12051} (segid " " and resid "150 " and name "HB1 ") (segid " " and resid "150 " and name "HA ") 5.000 5.000 0.000 peak 12051 weight 0.10000E+01 volume -0.10990E+01 ppm1 2.414 ppm2 4.048 ASSI {12053} (segid " " and resid "150 " and name "HG2 ") (segid " " and resid "150 " and name "HA ") 5.000 5.000 0.000 peak 12053 weight 0.10000E+01 volume 0.13850E+01 ppm1 2.337 ppm2 4.043 ASSI {12054} (segid " " and resid "150 " and name "HG2 ") (segid " " and resid "150 " and name "HG1 ") 2.700 2.700 0.000 peak 12054 weight 0.10000E+01 volume 0.53500E+01 ppm1 2.333 ppm2 2.551 ASSI {12055} (segid " " and resid "151 " and name "HA ") (segid " " and resid "151 " and name "HB1 ") 3.300 3.300 0.000 peak 12055 weight 0.10000E+01 volume 0.26060E+01 ppm1 4.289 ppm2 2.147 ASSI {12056} (segid " " and resid "151 " and name "HA ") (segid " " and resid "151 " and name "HB2 ") 3.300 3.300 0.000 peak 12056 weight 0.10000E+01 volume 0.39580E+01 ppm1 4.290 ppm2 1.804 ASSI {12057} (segid " " and resid "151 " and name "HA ") (segid " " and resid "151 " and name "HD1 ") 5.000 5.000 0.000 peak 12057 weight 0.10000E+01 volume 0.73900E+00 ppm1 4.292 ppm2 3.293 ASSI {12058} (segid " " and resid "151 " and name "HA ") (segid " " and resid "151 " and name "HD2 ") 5.000 5.000 0.000 peak 12058 weight 0.10000E+01 volume 0.58300E+00 ppm1 4.291 ppm2 2.991 ASSI {12060} (segid " " and resid "151 " and name "HB2 ") (segid " " and resid "151 " and name "HD2 ") 5.000 5.000 0.000 peak 12060 weight 0.10000E+01 volume -0.56400E+00 ppm1 1.805 ppm2 2.987 ASSI {12066} (segid " " and resid "151 " and name "HD2 ") (segid " " and resid "151 " and name "HB1 ") 5.000 5.000 0.000 peak 12066 weight 0.10000E+01 volume 0.68000E+00 ppm1 2.987 ppm2 2.137 ASSI {12067} (segid " " and resid "151 " and name "HD2 ") (segid " " and resid "151 " and name "HD1 ") 2.700 2.700 0.000 peak 12067 weight 0.10000E+01 volume 0.46920E+01 ppm1 2.987 ppm2 3.292 ASSI {12069} (segid " " and resid "151 " and name "HD2 ") (segid " " and resid "151 " and name "HG1 ") 5.000 5.000 0.000 peak 12069 weight 0.10000E+01 volume 0.19120E+01 ppm1 2.990 ppm2 1.829 ASSI {12070} (segid " " and resid "151 " and name "HD2 ") (segid " " and resid "151 " and name "HG2 ") 5.000 5.000 0.000 peak 12070 weight 0.10000E+01 volume 0.19560E+01 ppm1 2.987 ppm2 1.760 ASSI {12071} (segid " " and resid "151 " and name "HG1 ") (segid " " and resid "151 " and name "HA ") 5.000 5.000 0.000 peak 12071 weight 0.10000E+01 volume -0.15990E+01 ppm1 1.852 ppm2 4.290 ASSI {12072} (segid " " and resid "151 " and name "HG2 ") (segid " " and resid "151 " and name "HA ") 5.000 5.000 0.000 peak 12072 weight 0.10000E+01 volume -0.17910E+01 ppm1 1.772 ppm2 4.290 ASSI {12074} (segid " " and resid "153 " and name "HA ") (segid " " and resid "153 " and name "HB3 ") 2.700 2.700 0.000 peak 12074 weight 0.10000E+01 volume 0.47350E+01 ppm1 4.774 ppm2 1.370 OR {12074} (segid " " and resid "153 " and name "HA ") (segid " " and resid "153 " and name "HB1 ") OR {12074} (segid " " and resid "153 " and name "HA ") (segid " " and resid "153 " and name "HB2 ") ASSI {12075} (segid " " and resid "155 " and name "HA ") (segid " " and resid "155 " and name "HB1 ") 3.300 3.300 0.000 peak 12075 weight 0.10000E+01 volume 0.22350E+01 ppm1 4.478 ppm2 2.943 ASSI {12076} (segid " " and resid "155 " and name "HA ") (segid " " and resid "155 " and name "HB2 ") 3.300 3.300 0.000 peak 12076 weight 0.10000E+01 volume 0.29650E+01 ppm1 4.477 ppm2 2.864 ASSI {12079} (segid " " and resid "156 " and name "HA ") (segid " " and resid "156 " and name "HB1 ") 5.000 5.000 0.000 peak 12079 weight 0.10000E+01 volume 0.83600E+00 ppm1 4.148 ppm2 2.097 ASSI {12080} (segid " " and resid "156 " and name "HA ") (segid " " and resid "156 " and name "HB2 ") 5.000 5.000 0.000 peak 12080 weight 0.10000E+01 volume 0.93300E+00 ppm1 4.158 ppm2 1.160 ASSI {12081} (segid " " and resid "156 " and name "HA ") (segid " " and resid "156 " and name "HD22") 3.300 3.300 0.000 peak 12081 weight 0.10000E+01 volume 0.26760E+01 ppm1 4.158 ppm2 0.735 OR {12081} (segid " " and resid "156 " and name "HA ") (segid " " and resid "156 " and name "HD23") OR {12081} (segid " " and resid "156 " and name "HA ") (segid " " and resid "156 " and name "HD21") ASSI {12082} (segid " " and resid "156 " and name "HA ") (segid " " and resid "156 " and name "HG ") 5.000 5.000 0.000 peak 12082 weight 0.10000E+01 volume 0.13430E+01 ppm1 4.151 ppm2 1.877 ASSI {12085} (segid " " and resid "156 " and name "HB2 ") (segid " " and resid "156 " and name "HB1 ") 5.000 5.000 0.000 peak 12085 weight 0.10000E+01 volume 0.11530E+01 ppm1 1.170 ppm2 2.084 ASSI {12088} (segid " " and resid "156 " and name "HB2 ") (segid " " and resid "156 " and name "HD11") 5.000 5.000 0.000 peak 12088 weight 0.10000E+01 volume 0.11840E+01 ppm1 1.168 ppm2 0.984 OR {12088} (segid " " and resid "156 " and name "HB2 ") (segid " " and resid "156 " and name "HD12") OR {12088} (segid " " and resid "156 " and name "HB2 ") (segid " " and resid "156 " and name "HD13") ASSI {12089} (segid " " and resid "156 " and name "HB1 ") (segid " " and resid "156 " and name "HD23") 5.000 5.000 0.000 peak 12089 weight 0.10000E+01 volume 0.80900E+00 ppm1 2.097 ppm2 0.742 OR {12089} (segid " " and resid "156 " and name "HB1 ") (segid " " and resid "156 " and name "HD22") OR {12089} (segid " " and resid "156 " and name "HB1 ") (segid " " and resid "156 " and name "HD21") ASSI {12090} (segid " " and resid "156 " and name "HB2 ") (segid " " and resid "156 " and name "HD22") 5.000 5.000 0.000 peak 12090 weight 0.10000E+01 volume 0.12210E+01 ppm1 1.160 ppm2 0.747 OR {12090} (segid " " and resid "156 " and name "HB2 ") (segid " " and resid "156 " and name "HD21") OR {12090} (segid " " and resid "156 " and name "HB2 ") (segid " " and resid "156 " and name "HD23") ASSI {12091} (segid " " and resid "156 " and name "HB1 ") (segid " " and resid "156 " and name "HG ") 5.000 5.000 0.000 peak 12091 weight 0.10000E+01 volume 0.84700E+00 ppm1 2.093 ppm2 1.887 ASSI {12092} (segid " " and resid "156 " and name "HB2 ") (segid " " and resid "156 " and name "HG ") 5.000 5.000 0.000 peak 12092 weight 0.10000E+01 volume 0.61900E+00 ppm1 1.169 ppm2 1.863 ASSI {12093} (segid " " and resid "156 " and name "HD13") (segid " " and resid "156 " and name "HB1 ") 3.300 3.300 0.000 peak 12093 weight 0.10000E+01 volume -0.31170E+01 ppm1 0.995 ppm2 2.103 OR {12093} (segid " " and resid "156 " and name "HD11") (segid " " and resid "156 " and name "HB1 ") OR {12093} (segid " " and resid "156 " and name "HD12") (segid " " and resid "156 " and name "HB1 ") ASSI {12094} (segid " " and resid "156 " and name "HD22") (segid " " and resid "156 " and name "HD12") 2.700 2.700 0.000 peak 12094 weight 0.10000E+01 volume -0.16602E+02 ppm1 0.735 ppm2 0.994 OR {12094} (segid " " and resid "156 " and name "HD21") (segid " " and resid "156 " and name "HD11") OR {12094} (segid " " and resid "156 " and name "HD21") (segid " " and resid "156 " and name "HD13") OR {12094} (segid " " and resid "156 " and name "HD23") (segid " " and resid "156 " and name "HD11") OR {12094} (segid " " and resid "156 " and name "HD21") (segid " " and resid "156 " and name "HD12") OR {12094} (segid " " and resid "156 " and name "HD23") (segid " " and resid "156 " and name "HD13") OR {12094} (segid " " and resid "156 " and name "HD22") (segid " " and resid "156 " and name "HD11") OR {12094} (segid " " and resid "156 " and name "HD22") (segid " " and resid "156 " and name "HD13") OR {12094} (segid " " and resid "156 " and name "HD23") (segid " " and resid "156 " and name "HD12") ASSI {12095} (segid " " and resid "157 " and name "HA ") (segid " " and resid "157 " and name "HB1 ") 3.300 3.300 0.000 peak 12095 weight 0.10000E+01 volume -0.21600E+01 ppm1 3.711 ppm2 2.281 ASSI {12096} (segid " " and resid "157 " and name "HA ") (segid " " and resid "157 " and name "HB2 ") 5.000 5.000 0.000 peak 12096 weight 0.10000E+01 volume -0.19720E+01 ppm1 3.709 ppm2 2.171 ASSI {12099} (segid " " and resid "158 " and name "HA ") (segid " " and resid "158 " and name "HB1 ") 5.000 5.000 0.000 peak 12099 weight 0.10000E+01 volume 0.13470E+01 ppm1 4.344 ppm2 2.791 ASSI {12100} (segid " " and resid "158 " and name "HA ") (segid " " and resid "158 " and name "HB2 ") 5.000 5.000 0.000 peak 12100 weight 0.10000E+01 volume 0.19340E+01 ppm1 4.345 ppm2 2.676 ASSI {12103} (segid " " and resid "158 " and name "HB2 ") (segid " " and resid "158 " and name "HB1 ") 2.700 2.700 0.000 peak 12103 weight 0.10000E+01 volume 0.43030E+01 ppm1 2.667 ppm2 2.792 ASSI {12106} (segid " " and resid "159 " and name "HA ") (segid " " and resid "159 " and name "HB ") 5.000 5.000 0.000 peak 12106 weight 0.10000E+01 volume -0.11020E+01 ppm1 3.766 ppm2 1.862 ASSI {12107} (segid " " and resid "159 " and name "HA ") (segid " " and resid "159 " and name "HG11") 5.000 5.000 0.000 peak 12107 weight 0.10000E+01 volume -0.14760E+01 ppm1 3.761 ppm2 1.940 ASSI {12108} (segid " " and resid "159 " and name "HA ") (segid " " and resid "159 " and name "HG12") 5.000 5.000 0.000 peak 12108 weight 0.10000E+01 volume -0.14920E+01 ppm1 3.765 ppm2 1.144 ASSI {12111} (segid " " and resid "159 " and name "HB ") (segid " " and resid "159 " and name "HG12") 5.000 5.000 0.000 peak 12111 weight 0.10000E+01 volume 0.60600E+00 ppm1 1.867 ppm2 1.143 ASSI {12112} (segid " " and resid "159 " and name "HD13") (segid " " and resid "159 " and name "HA ") 5.000 5.000 0.000 peak 12112 weight 0.10000E+01 volume -0.16810E+01 ppm1 0.909 ppm2 3.772 OR {12112} (segid " " and resid "159 " and name "HD12") (segid " " and resid "159 " and name "HA ") OR {12112} (segid " " and resid "159 " and name "HD11") (segid " " and resid "159 " and name "HA ") ASSI {12115} (segid " " and resid "159 " and name "HG12") (segid " " and resid "159 " and name "HG11") 3.300 3.300 0.000 peak 12115 weight 0.10000E+01 volume -0.28190E+01 ppm1 1.150 ppm2 1.936 ASSI {12117} (segid " " and resid "159 " and name "HG22") (segid " " and resid "159 " and name "HG12") 2.700 2.700 0.000 peak 12117 weight 0.10000E+01 volume -0.41410E+01 ppm1 0.899 ppm2 1.139 OR {12117} (segid " " and resid "159 " and name "HG23") (segid " " and resid "159 " and name "HG12") OR {12117} (segid " " and resid "159 " and name "HG21") (segid " " and resid "159 " and name "HG12") ASSI {12118} (segid " " and resid "160 " and name "HA ") (segid " " and resid "160 " and name "HB1 ") 3.300 3.300 0.000 peak 12118 weight 0.10000E+01 volume 0.21600E+01 ppm1 3.886 ppm2 1.957 ASSI {12119} (segid " " and resid "160 " and name "HA ") (segid " " and resid "160 " and name "HB2 ") 3.300 3.300 0.000 peak 12119 weight 0.10000E+01 volume 0.21670E+01 ppm1 3.894 ppm2 1.285 ASSI {12120} (segid " " and resid "160 " and name "HA ") (segid " " and resid "160 " and name "HG ") 3.300 3.300 0.000 peak 12120 weight 0.10000E+01 volume 0.22910E+01 ppm1 3.892 ppm2 1.782 ASSI {12123} (segid " " and resid "160 " and name "HB2 ") (segid " " and resid "160 " and name "HB1 ") 5.000 5.000 0.000 peak 12123 weight 0.10000E+01 volume 0.11970E+01 ppm1 1.291 ppm2 1.959 ASSI {12125} (segid " " and resid "160 " and name "HB1 ") (segid " " and resid "160 " and name "HD13") 5.000 5.000 0.000 peak 12125 weight 0.10000E+01 volume 0.82100E+00 ppm1 1.945 ppm2 0.637 OR {12125} (segid " " and resid "160 " and name "HB1 ") (segid " " and resid "160 " and name "HD12") OR {12125} (segid " " and resid "160 " and name "HB1 ") (segid " " and resid "160 " and name "HD11") ASSI {12126} (segid " " and resid "160 " and name "HB2 ") (segid " " and resid "160 " and name "HD11") 5.000 5.000 0.000 peak 12126 weight 0.10000E+01 volume 0.83600E+00 ppm1 1.292 ppm2 0.638 OR {12126} (segid " " and resid "160 " and name "HB2 ") (segid " " and resid "160 " and name "HD12") OR {12126} (segid " " and resid "160 " and name "HB2 ") (segid " " and resid "160 " and name "HD13") ASSI {12128} (segid " " and resid "160 " and name "HB1 ") (segid " " and resid "160 " and name "HG ") 5.000 5.000 0.000 peak 12128 weight 0.10000E+01 volume 0.79000E+00 ppm1 1.942 ppm2 1.781 ASSI {12129} (segid " " and resid "160 " and name "HB2 ") (segid " " and resid "160 " and name "HG ") 5.000 5.000 0.000 peak 12129 weight 0.10000E+01 volume 0.85600E+00 ppm1 1.274 ppm2 1.781 ASSI {12130} (segid " " and resid "160 " and name "HD22") (segid " " and resid "160 " and name "HB2 ") 3.300 3.300 0.000 peak 12130 weight 0.10000E+01 volume -0.33000E+01 ppm1 0.752 ppm2 1.290 OR {12130} (segid " " and resid "160 " and name "HD23") (segid " " and resid "160 " and name "HB2 ") OR {12130} (segid " " and resid "160 " and name "HD21") (segid " " and resid "160 " and name "HB2 ") ASSI {12131} (segid " " and resid "161 " and name "HB1 ") (segid " " and resid "161 " and name "HA ") 2.700 2.700 0.000 peak 12131 weight 0.10000E+01 volume -0.44150E+01 ppm1 2.207 ppm2 4.021 ASSI {12132} (segid " " and resid "161 " and name "HB2 ") (segid " " and resid "161 " and name "HA ") 3.300 3.300 0.000 peak 12132 weight 0.10000E+01 volume -0.35770E+01 ppm1 2.127 ppm2 4.021 ASSI {12133} (segid " " and resid "161 " and name "HG1 ") (segid " " and resid "161 " and name "HA ") 5.000 5.000 0.000 peak 12133 weight 0.10000E+01 volume 0.43500E+00 ppm1 2.536 ppm2 4.020 ASSI {12134} (segid " " and resid "161 " and name "HG2 ") (segid " " and resid "161 " and name "HA ") 5.000 5.000 0.000 peak 12134 weight 0.10000E+01 volume 0.97300E+00 ppm1 2.368 ppm2 4.015 ASSI {12135} (segid " " and resid "163 " and name "HA ") (segid " " and resid "163 " and name "HB1 ") 5.000 5.000 0.000 peak 12135 weight 0.10000E+01 volume 0.15160E+01 ppm1 4.636 ppm2 3.261 ASSI {12136} (segid " " and resid "163 " and name "HA ") (segid " " and resid "163 " and name "HB2 ") 5.000 5.000 0.000 peak 12136 weight 0.10000E+01 volume 0.13570E+01 ppm1 4.634 ppm2 2.718 ASSI {12137} (segid " " and resid "163 " and name "HA ") (segid " " and resid "163 " and name "HD2 ") 6.000 6.000 0.000 peak 12137 weight 0.10000E+01 volume 0.15000E+00 ppm1 4.636 ppm2 7.029 ASSI {12140} (segid " " and resid "163 " and name "HB2 ") (segid " " and resid "163 " and name "HB1 ") 5.000 5.000 0.000 peak 12140 weight 0.10000E+01 volume -0.88700E+00 ppm1 2.725 ppm2 3.263 ASSI {12142} (segid " " and resid "163 " and name "HB2 ") (segid " " and resid "163 " and name "HD2 ") 6.000 6.000 0.000 peak 12142 weight 0.10000E+01 volume -0.70000E-01 ppm1 2.720 ppm2 7.020 ASSI {12143} (segid " " and resid "164 " and name "HA ") (segid " " and resid "164 " and name "HG1 ") 5.000 5.000 0.000 peak 12143 weight 0.10000E+01 volume 0.14300E+01 ppm1 4.503 ppm2 2.705 ASSI {12144} (segid " " and resid "164 " and name "HB1 ") (segid " " and resid "164 " and name "HA ") 5.000 5.000 0.000 peak 12144 weight 0.10000E+01 volume 0.98400E+00 ppm1 2.308 ppm2 4.498 ASSI {12145} (segid " " and resid "164 " and name "HB2 ") (segid " " and resid "164 " and name "HA ") 5.000 5.000 0.000 peak 12145 weight 0.10000E+01 volume 0.67400E+00 ppm1 1.941 ppm2 4.498 ASSI {12146} (segid " " and resid "164 " and name "HB1 ") (segid " " and resid "164 " and name "HG1 ") 5.000 5.000 0.000 peak 12146 weight 0.10000E+01 volume 0.92400E+00 ppm1 2.306 ppm2 2.696 ASSI {12147} (segid " " and resid "164 " and name "HB2 ") (segid " " and resid "164 " and name "HG1 ") 5.000 5.000 0.000 peak 12147 weight 0.10000E+01 volume 0.58800E+00 ppm1 1.946 ppm2 2.702 ASSI {12149} (segid " " and resid "164 " and name "HG2 ") (segid " " and resid "164 " and name "HA ") 5.000 5.000 0.000 peak 12149 weight 0.10000E+01 volume -0.63300E+00 ppm1 2.357 ppm2 4.505 ASSI {12151} (segid " " and resid "164 " and name "HG1 ") (segid " " and resid "164 " and name "HG2 ") 3.300 3.300 0.000 peak 12151 weight 0.10000E+01 volume -0.31450E+01 ppm1 2.706 ppm2 2.356 ASSI {12152} (segid " " and resid "166 " and name "HA ") (segid " " and resid "166 " and name "HB ") 5.000 5.000 0.000 peak 12152 weight 0.10000E+01 volume 0.54600E+00 ppm1 4.525 ppm2 1.912 ASSI {12153} (segid " " and resid "166 " and name "HA ") (segid " " and resid "166 " and name "HD11") 5.000 5.000 0.000 peak 12153 weight 0.10000E+01 volume 0.46200E+00 ppm1 4.519 ppm2 0.900 OR {12153} (segid " " and resid "166 " and name "HA ") (segid " " and resid "166 " and name "HD13") OR {12153} (segid " " and resid "166 " and name "HA ") (segid " " and resid "166 " and name "HD12") ASSI {12154} (segid " " and resid "166 " and name "HA ") (segid " " and resid "166 " and name "HG11") 6.000 6.000 0.000 peak 12154 weight 0.10000E+01 volume 0.24800E+00 ppm1 4.524 ppm2 1.559 ASSI {12155} (segid " " and resid "166 " and name "HA ") (segid " " and resid "166 " and name "HG12") 5.000 5.000 0.000 peak 12155 weight 0.10000E+01 volume 0.39600E+00 ppm1 4.524 ppm2 1.230 ASSI {12156} (segid " " and resid "166 " and name "HA ") (segid " " and resid "166 " and name "HG21") 5.000 5.000 0.000 peak 12156 weight 0.10000E+01 volume 0.96200E+00 ppm1 4.525 ppm2 0.995 OR {12156} (segid " " and resid "166 " and name "HA ") (segid " " and resid "166 " and name "HG23") OR {12156} (segid " " and resid "166 " and name "HA ") (segid " " and resid "166 " and name "HG22") ASSI {12158} (segid " " and resid "166 " and name "HB ") (segid " " and resid "166 " and name "HG11") 5.000 5.000 0.000 peak 12158 weight 0.10000E+01 volume 0.79600E+00 ppm1 1.912 ppm2 1.570 ASSI {12159} (segid " " and resid "166 " and name "HB ") (segid " " and resid "166 " and name "HG12") 5.000 5.000 0.000 peak 12159 weight 0.10000E+01 volume 0.44100E+00 ppm1 1.915 ppm2 1.227 ASSI {12160} (segid " " and resid "166 " and name "HB ") (segid " " and resid "166 " and name "HG21") 5.000 5.000 0.000 peak 12160 weight 0.10000E+01 volume 0.18170E+01 ppm1 1.915 ppm2 0.996 OR {12160} (segid " " and resid "166 " and name "HB ") (segid " " and resid "166 " and name "HG22") OR {12160} (segid " " and resid "166 " and name "HB ") (segid " " and resid "166 " and name "HG23") ASSI {12164} (segid " " and resid "167 " and name "HD2 ") (segid " " and resid "166 " and name "HA ") 5.000 5.000 0.000 peak 12164 weight 0.10000E+01 volume 0.16770E+01 ppm1 3.732 ppm2 4.523 ASSI {12165} (segid " " and resid "167 " and name "HD1 ") (segid " " and resid "166 " and name "HB ") 5.000 5.000 0.000 peak 12165 weight 0.10000E+01 volume 0.32400E+00 ppm1 3.938 ppm2 1.896 ASSI {12166} (segid " " and resid "167 " and name "HD2 ") (segid " " and resid "166 " and name "HB ") 5.000 5.000 0.000 peak 12166 weight 0.10000E+01 volume 0.44000E+00 ppm1 3.727 ppm2 1.897 ASSI {12167} (segid " " and resid "167 " and name "HD1 ") (segid " " and resid "166 " and name "HG22") 6.000 6.000 0.000 peak 12167 weight 0.10000E+01 volume 0.23600E+00 ppm1 3.942 ppm2 0.990 OR {12167} (segid " " and resid "167 " and name "HD1 ") (segid " " and resid "166 " and name "HG21") OR {12167} (segid " " and resid "167 " and name "HD1 ") (segid " " and resid "166 " and name "HG23") ASSI {12168} (segid " " and resid "167 " and name "HD2 ") (segid " " and resid "166 " and name "HG22") 5.000 5.000 0.000 peak 12168 weight 0.10000E+01 volume 0.31700E+00 ppm1 3.730 ppm2 0.996 OR {12168} (segid " " and resid "167 " and name "HD2 ") (segid " " and resid "166 " and name "HG21") OR {12168} (segid " " and resid "167 " and name "HD2 ") (segid " " and resid "166 " and name "HG23") ASSI { 5572} (segid " " and resid "5 " and name "HA ") (segid " " and resid "5 " and name "HB1 ") 2.700 2.700 0.000 peak 5572 weight 0.10000E+01 volume 0.44930E+01 ppm1 4.377 ppm2 1.630 OR { 5572} (segid " " and resid "5 " and name "HA ") (segid " " and resid "5 " and name "HB2 ") ASSI { 5573} (segid " " and resid "5 " and name "HA ") (segid " " and resid "5 " and name "HD21") 2.700 2.700 0.000 peak 5573 weight 0.10000E+01 volume -0.44750E+01 ppm1 4.377 ppm2 0.898 OR { 5573} (segid " " and resid "5 " and name "HA ") (segid " " and resid "5 " and name "HD22") OR { 5573} (segid " " and resid "5 " and name "HA ") (segid " " and resid "5 " and name "HD23") ASSI { 5574} (segid " " and resid "5 " and name "HA ") (segid " " and resid "5 " and name "HG ") 5.000 5.000 0.000 peak 5574 weight 0.10000E+01 volume -0.85400E+00 ppm1 4.377 ppm2 1.619 ASSI { 5575} (segid " " and resid "5 " and name "HD11") (segid " " and resid "5 " and name "HB1 ") 2.700 2.700 0.000 peak 5575 weight 0.10000E+01 volume -0.68800E+01 ppm1 0.953 ppm2 1.650 OR { 5575} (segid " " and resid "5 " and name "HD11") (segid " " and resid "5 " and name "HB2 ") OR { 5575} (segid " " and resid "5 " and name "HD13") (segid " " and resid "5 " and name "HB1 ") OR { 5575} (segid " " and resid "5 " and name "HD12") (segid " " and resid "5 " and name "HB1 ") OR { 5575} (segid " " and resid "5 " and name "HD12") (segid " " and resid "5 " and name "HB2 ") OR { 5575} (segid " " and resid "5 " and name "HD13") (segid " " and resid "5 " and name "HB2 ") ASSI { 5576} (segid " " and resid "5 " and name "HD23") (segid " " and resid "5 " and name "HB1 ") 3.300 3.300 0.000 peak 5576 weight 0.10000E+01 volume -0.34770E+01 ppm1 0.890 ppm2 1.618 OR { 5576} (segid " " and resid "5 " and name "HD21") (segid " " and resid "5 " and name "HB2 ") OR { 5576} (segid " " and resid "5 " and name "HD21") (segid " " and resid "5 " and name "HB1 ") OR { 5576} (segid " " and resid "5 " and name "HD22") (segid " " and resid "5 " and name "HB1 ") OR { 5576} (segid " " and resid "5 " and name "HD23") (segid " " and resid "5 " and name "HB2 ") OR { 5576} (segid " " and resid "5 " and name "HD22") (segid " " and resid "5 " and name "HB2 ") ASSI { 5577} (segid " " and resid "5 " and name "HG ") (segid " " and resid "5 " and name "HB1 ") 2.700 2.700 0.000 peak 5577 weight 0.10000E+01 volume -0.29395E+02 ppm1 1.630 ppm2 1.630 OR { 5577} (segid " " and resid "5 " and name "HG ") (segid " " and resid "5 " and name "HB2 ") ASSI {12937} (segid " " and resid "10 " and name "HA ") (segid " " and resid "10 " and name "HG22") 5.000 5.000 0.000 peak 12937 weight 0.10000E+01 volume 0.68700E+00 ppm1 3.900 ppm2 1.123 OR {12937} (segid " " and resid "10 " and name "HA ") (segid " " and resid "10 " and name "HG21") OR {12937} (segid " " and resid "10 " and name "HA ") (segid " " and resid "10 " and name "HG23") ASSI { 5583} (segid " " and resid "10 " and name "HB ") (segid " " and resid "10 " and name "HG23") 5.000 5.000 0.000 peak 5583 weight 0.10000E+01 volume 0.15370E+01 ppm1 2.286 ppm2 1.123 OR { 5583} (segid " " and resid "10 " and name "HB ") (segid " " and resid "10 " and name "HG21") OR { 5583} (segid " " and resid "10 " and name "HB ") (segid " " and resid "10 " and name "HG22") ASSI { 5591} (segid " " and resid "13 " and name "HD1 ") (segid " " and resid "10 " and name "HA ") 6.000 6.000 0.000 peak 5591 weight 0.10000E+01 volume -0.20700E+00 ppm1 3.171 ppm2 3.907 OR { 5591} (segid " " and resid "13 " and name "HD2 ") (segid " " and resid "10 " and name "HA ") ASSI { 5596} (segid " " and resid "14 " and name "HA ") (segid " " and resid "14 " and name "HB2 ") 6.000 6.000 0.000 peak 5596 weight 0.10000E+01 volume 0.22000E+00 ppm1 4.078 ppm2 1.422 ASSI { 5515} (segid " " and resid "14 " and name "HA ") (segid " " and resid "17 " and name "HB3 ") 6.000 6.000 0.000 peak 5515 weight 0.10000E+01 volume -0.25500E+00 ppm1 4.091 ppm2 1.496 OR { 5515} (segid " " and resid "14 " and name "HA ") (segid " " and resid "17 " and name "HB1 ") OR { 5515} (segid " " and resid "14 " and name "HA ") (segid " " and resid "17 " and name "HB2 ") ASSI { 5597} (segid " " and resid "14 " and name "HA ") (segid " " and resid "29 " and name "HD11") 5.000 5.000 0.000 peak 5597 weight 0.10000E+01 volume -0.90400E+00 ppm1 4.083 ppm2 0.769 OR { 5597} (segid " " and resid "14 " and name "HA ") (segid " " and resid "29 " and name "HD12") OR { 5597} (segid " " and resid "14 " and name "HA ") (segid " " and resid "29 " and name "HD13") ASSI { 5598} (segid " " and resid "16 " and name "HA2 ") (segid " " and resid "19 " and name "HB2 ") 5.000 5.000 0.000 peak 5598 weight 0.10000E+01 volume -0.44800E+00 ppm1 3.858 ppm2 1.571 OR { 5598} (segid " " and resid "16 " and name "HA2 ") (segid " " and resid "19 " and name "HB3 ") OR { 5598} (segid " " and resid "16 " and name "HA2 ") (segid " " and resid "19 " and name "HB1 ") ASSI { 5602} (segid " " and resid "18 " and name "HB1 ") (segid " " and resid "50 " and name "HG21") 5.000 5.000 0.000 peak 5602 weight 0.10000E+01 volume 0.92200E+00 ppm1 1.314 ppm2 0.908 OR { 5602} (segid " " and resid "18 " and name "HB1 ") (segid " " and resid "50 " and name "HG23") OR { 5602} (segid " " and resid "18 " and name "HB2 ") (segid " " and resid "50 " and name "HG21") OR { 5602} (segid " " and resid "18 " and name "HB3 ") (segid " " and resid "50 " and name "HG21") OR { 5602} (segid " " and resid "18 " and name "HB1 ") (segid " " and resid "50 " and name "HG22") OR { 5602} (segid " " and resid "18 " and name "HB3 ") (segid " " and resid "50 " and name "HG22") OR { 5602} (segid " " and resid "18 " and name "HB2 ") (segid " " and resid "50 " and name "HG22") OR { 5602} (segid " " and resid "18 " and name "HB2 ") (segid " " and resid "50 " and name "HG23") OR { 5602} (segid " " and resid "18 " and name "HB3 ") (segid " " and resid "50 " and name "HG23") ASSI { 5604} (segid " " and resid "18 " and name "HB2 ") (segid " " and resid "51 " and name "HB1 ") 6.000 6.000 0.000 peak 5604 weight 0.10000E+01 volume -0.25200E+00 ppm1 1.324 ppm2 1.986 OR { 5604} (segid " " and resid "18 " and name "HB3 ") (segid " " and resid "51 " and name "HB1 ") OR { 5604} (segid " " and resid "18 " and name "HB1 ") (segid " " and resid "51 " and name "HB1 ") ASSI { 5605} (segid " " and resid "18 " and name "HB1 ") (segid " " and resid "51 " and name "HB2 ") 5.000 5.000 0.000 peak 5605 weight 0.10000E+01 volume -0.33100E+00 ppm1 1.324 ppm2 1.451 OR { 5605} (segid " " and resid "18 " and name "HB2 ") (segid " " and resid "51 " and name "HB2 ") OR { 5605} (segid " " and resid "18 " and name "HB3 ") (segid " " and resid "51 " and name "HB2 ") ASSI { 5609} (segid " " and resid "19 " and name "HB2 ") (segid " " and resid "16 " and name "HA1 ") 5.000 5.000 0.000 peak 5609 weight 0.10000E+01 volume -0.34500E+00 ppm1 1.544 ppm2 3.928 OR { 5609} (segid " " and resid "19 " and name "HB3 ") (segid " " and resid "16 " and name "HA1 ") OR { 5609} (segid " " and resid "19 " and name "HB1 ") (segid " " and resid "16 " and name "HA1 ") ASSI {13076} (segid " " and resid "20 " and name "HA ") (segid " " and resid "20 " and name "HG1 ") 6.000 6.000 0.000 peak 13076 weight 0.10000E+01 volume -0.29800E+00 ppm1 4.515 ppm2 1.921 ASSI {13078} (segid " " and resid "20 " and name "HA ") (segid " " and resid "20 " and name "HG2 ") 5.000 5.000 0.000 peak 13078 weight 0.10000E+01 volume -0.51000E+00 ppm1 4.514 ppm2 1.802 ASSI { 5616} (segid " " and resid "23 " and name "HA ") (segid " " and resid "26 " and name "HB ") 5.000 5.000 0.000 peak 5616 weight 0.10000E+01 volume 0.98900E+00 ppm1 3.368 ppm2 2.177 ASSI { 5617} (segid " " and resid "23 " and name "HG11") (segid " " and resid "24 " and name "HG2 ") 6.000 6.000 0.000 peak 5617 weight 0.10000E+01 volume -0.19900E+00 ppm1 0.940 ppm2 2.463 OR { 5617} (segid " " and resid "23 " and name "HG12") (segid " " and resid "24 " and name "HG2 ") OR { 5617} (segid " " and resid "23 " and name "HG13") (segid " " and resid "24 " and name "HG2 ") ASSI { 5618} (segid " " and resid "23 " and name "HG21") (segid " " and resid "24 " and name "HG1 ") 5.000 5.000 0.000 peak 5618 weight 0.10000E+01 volume -0.37000E+00 ppm1 0.916 ppm2 2.482 OR { 5618} (segid " " and resid "23 " and name "HG21") (segid " " and resid "24 " and name "HG2 ") OR { 5618} (segid " " and resid "23 " and name "HG22") (segid " " and resid "24 " and name "HG1 ") OR { 5618} (segid " " and resid "23 " and name "HG23") (segid " " and resid "24 " and name "HG1 ") OR { 5618} (segid " " and resid "23 " and name "HG22") (segid " " and resid "24 " and name "HG2 ") OR { 5618} (segid " " and resid "23 " and name "HG23") (segid " " and resid "24 " and name "HG2 ") ASSI {12908} (segid " " and resid "25 " and name "HG2 ") (segid " " and resid "17 " and name "HB3 ") 6.000 6.000 0.000 peak 12908 weight 0.10000E+01 volume -0.22100E+00 ppm1 2.131 ppm2 1.518 OR {12908} (segid " " and resid "25 " and name "HG2 ") (segid " " and resid "17 " and name "HB2 ") OR {12908} (segid " " and resid "25 " and name "HG2 ") (segid " " and resid "17 " and name "HB1 ") ASSI { 5434} (segid " " and resid "31 " and name "HD2 ") (segid " " and resid "27 " and name "HA ") 6.000 6.000 0.000 peak 5434 weight 0.10000E+01 volume 0.22800E+00 ppm1 6.955 ppm2 3.684 ASSI {13061} (segid " " and resid "33 " and name "HA ") (segid " " and resid "33 " and name "HB2 ") 5.000 5.000 0.000 peak 13061 weight 0.10000E+01 volume -0.42500E+00 ppm1 4.480 ppm2 2.339 ASSI { 5656} (segid " " and resid "37 " and name "HA ") (segid " " and resid "14 " and name "HD13") 5.000 5.000 0.000 peak 5656 weight 0.10000E+01 volume 0.55000E+00 ppm1 4.101 ppm2 0.990 OR { 5656} (segid " " and resid "37 " and name "HA ") (segid " " and resid "14 " and name "HD12") OR { 5656} (segid " " and resid "37 " and name "HA ") (segid " " and resid "14 " and name "HD11") ASSI { 5670} (segid " " and resid "42 " and name "HA ") (segid " " and resid "42 " and name "HB1 ") 5.000 5.000 0.000 peak 5670 weight 0.10000E+01 volume -0.76500E+00 ppm1 4.160 ppm2 1.962 ASSI {13034} (segid " " and resid "45 " and name "HE2 ") (segid " " and resid "45 " and name "HG1 ") 6.000 6.000 0.000 peak 13034 weight 0.10000E+01 volume -0.26500E+00 ppm1 2.950 ppm2 1.386 OR {13034} (segid " " and resid "45 " and name "HE1 ") (segid " " and resid "45 " and name "HG1 ") ASSI {12864} (segid " " and resid "45 " and name "HE1 ") (segid " " and resid "45 " and name "HG2 ") 6.000 6.000 0.000 peak 12864 weight 0.10000E+01 volume -0.27700E+00 ppm1 2.947 ppm2 1.345 OR {12864} (segid " " and resid "45 " and name "HE2 ") (segid " " and resid "45 " and name "HG2 ") ASSI {13036} (segid " " and resid "45 " and name "HG1 ") (segid " " and resid "45 " and name "HA ") 6.000 6.000 0.000 peak 13036 weight 0.10000E+01 volume -0.80000E-01 ppm1 1.390 ppm2 4.825 ASSI { 5674} (segid " " and resid "47 " and name "HA ") (segid " " and resid "50 " and name "HG23") 5.000 5.000 0.000 peak 5674 weight 0.10000E+01 volume -0.11340E+01 ppm1 4.031 ppm2 0.922 OR { 5674} (segid " " and resid "47 " and name "HA ") (segid " " and resid "50 " and name "HG22") OR { 5674} (segid " " and resid "47 " and name "HA ") (segid " " and resid "50 " and name "HG21") ASSI { 5676} (segid " " and resid "47 " and name "HB1 ") (segid " " and resid "14 " and name "HD13") 5.000 5.000 0.000 peak 5676 weight 0.10000E+01 volume 0.84800E+00 ppm1 1.251 ppm2 1.009 OR { 5676} (segid " " and resid "47 " and name "HB2 ") (segid " " and resid "14 " and name "HD11") OR { 5676} (segid " " and resid "47 " and name "HB1 ") (segid " " and resid "14 " and name "HD11") OR { 5676} (segid " " and resid "47 " and name "HB3 ") (segid " " and resid "14 " and name "HD11") OR { 5676} (segid " " and resid "47 " and name "HB2 ") (segid " " and resid "14 " and name "HD13") OR { 5676} (segid " " and resid "47 " and name "HB2 ") (segid " " and resid "14 " and name "HD12") OR { 5676} (segid " " and resid "47 " and name "HB1 ") (segid " " and resid "14 " and name "HD12") OR { 5676} (segid " " and resid "47 " and name "HB3 ") (segid " " and resid "14 " and name "HD12") OR { 5676} (segid " " and resid "47 " and name "HB3 ") (segid " " and resid "14 " and name "HD13") ASSI { 5677} (segid " " and resid "47 " and name "HB2 ") (segid " " and resid "50 " and name "HG21") 5.000 5.000 0.000 peak 5677 weight 0.10000E+01 volume 0.10200E+01 ppm1 1.256 ppm2 0.909 OR { 5677} (segid " " and resid "47 " and name "HB1 ") (segid " " and resid "50 " and name "HG23") OR { 5677} (segid " " and resid "47 " and name "HB2 ") (segid " " and resid "50 " and name "HG23") OR { 5677} (segid " " and resid "47 " and name "HB3 ") (segid " " and resid "50 " and name "HG23") OR { 5677} (segid " " and resid "47 " and name "HB3 ") (segid " " and resid "50 " and name "HG22") OR { 5677} (segid " " and resid "47 " and name "HB2 ") (segid " " and resid "50 " and name "HG22") OR { 5677} (segid " " and resid "47 " and name "HB3 ") (segid " " and resid "50 " and name "HG21") OR { 5677} (segid " " and resid "47 " and name "HB1 ") (segid " " and resid "50 " and name "HG22") OR { 5677} (segid " " and resid "47 " and name "HB1 ") (segid " " and resid "50 " and name "HG21") ASSI { 5550} (segid " " and resid "49 " and name "HG1 ") (segid " " and resid "71 " and name "HG23") 6.000 6.000 0.000 peak 5550 weight 0.10000E+01 volume -0.13300E+00 ppm1 2.704 ppm2 0.871 OR { 5550} (segid " " and resid "49 " and name "HG1 ") (segid " " and resid "71 " and name "HG22") OR { 5550} (segid " " and resid "49 " and name "HG1 ") (segid " " and resid "71 " and name "HG21") ASSI { 5551} (segid " " and resid "49 " and name "HG2 ") (segid " " and resid "71 " and name "HG21") 6.000 6.000 0.000 peak 5551 weight 0.10000E+01 volume -0.13800E+00 ppm1 2.226 ppm2 0.848 OR { 5551} (segid " " and resid "49 " and name "HG2 ") (segid " " and resid "71 " and name "HG22") OR { 5551} (segid " " and resid "49 " and name "HG2 ") (segid " " and resid "71 " and name "HG23") ASSI { 5694} (segid " " and resid "51 " and name "HE2 ") (segid " " and resid "48 " and name "HA ") 6.000 6.000 0.000 peak 5694 weight 0.10000E+01 volume -0.14700E+00 ppm1 1.690 ppm2 3.784 OR { 5694} (segid " " and resid "51 " and name "HE1 ") (segid " " and resid "48 " and name "HA ") OR { 5694} (segid " " and resid "51 " and name "HE3 ") (segid " " and resid "48 " and name "HA ") ASSI { 5698} (segid " " and resid "51 " and name "HE2 ") (segid " " and resid "53 " and name "HD1 ") 6.000 6.000 0.000 peak 5698 weight 0.10000E+01 volume 0.12900E+00 ppm1 1.691 ppm2 7.195 OR { 5698} (segid " " and resid "51 " and name "HE1 ") (segid " " and resid "53 " and name "HD1 ") OR { 5698} (segid " " and resid "51 " and name "HE3 ") (segid " " and resid "53 " and name "HD2 ") OR { 5698} (segid " " and resid "51 " and name "HE2 ") (segid " " and resid "53 " and name "HD2 ") OR { 5698} (segid " " and resid "51 " and name "HE1 ") (segid " " and resid "53 " and name "HD2 ") OR { 5698} (segid " " and resid "51 " and name "HE3 ") (segid " " and resid "53 " and name "HD1 ") ASSI { 5699} (segid " " and resid "51 " and name "HE2 ") (segid " " and resid "59 " and name "HA ") 6.000 6.000 0.000 peak 5699 weight 0.10000E+01 volume -0.11600E+00 ppm1 1.691 ppm2 3.741 OR { 5699} (segid " " and resid "51 " and name "HE1 ") (segid " " and resid "59 " and name "HA ") OR { 5699} (segid " " and resid "51 " and name "HE3 ") (segid " " and resid "59 " and name "HA ") ASSI { 5705} (segid " " and resid "52 " and name "HG2 ") (segid " " and resid "52 " and name "HE1 ") 6.000 6.000 0.000 peak 5705 weight 0.10000E+01 volume 0.27000E+00 ppm1 2.554 ppm2 2.093 OR { 5705} (segid " " and resid "52 " and name "HG2 ") (segid " " and resid "52 " and name "HE3 ") OR { 5705} (segid " " and resid "52 " and name "HG1 ") (segid " " and resid "52 " and name "HE2 ") OR { 5705} (segid " " and resid "52 " and name "HG1 ") (segid " " and resid "52 " and name "HE3 ") OR { 5705} (segid " " and resid "52 " and name "HG1 ") (segid " " and resid "52 " and name "HE1 ") OR { 5705} (segid " " and resid "52 " and name "HG2 ") (segid " " and resid "52 " and name "HE2 ") ASSI { 5709} (segid " " and resid "56 " and name "HG1 ") (segid " " and resid "56 " and name "HA ") 5.000 5.000 0.000 peak 5709 weight 0.10000E+01 volume 0.51600E+00 ppm1 2.054 ppm2 4.308 OR { 5709} (segid " " and resid "56 " and name "HG2 ") (segid " " and resid "56 " and name "HA ") ASSI { 5720} (segid " " and resid "59 " and name "HB2 ") (segid " " and resid "56 " and name "HA ") 5.000 5.000 0.000 peak 5720 weight 0.10000E+01 volume 0.34600E+00 ppm1 1.319 ppm2 4.330 OR { 5720} (segid " " and resid "59 " and name "HB3 ") (segid " " and resid "56 " and name "HA ") OR { 5720} (segid " " and resid "59 " and name "HB1 ") (segid " " and resid "56 " and name "HA ") ASSI { 5722} (segid " " and resid "60 " and name "HD12") (segid " " and resid "64 " and name "HE1 ") 5.000 5.000 0.000 peak 5722 weight 0.10000E+01 volume -0.50000E+00 ppm1 0.965 ppm2 2.988 OR { 5722} (segid " " and resid "60 " and name "HD11") (segid " " and resid "64 " and name "HE1 ") OR { 5722} (segid " " and resid "60 " and name "HD12") (segid " " and resid "64 " and name "HE2 ") OR { 5722} (segid " " and resid "60 " and name "HD11") (segid " " and resid "64 " and name "HE2 ") OR { 5722} (segid " " and resid "60 " and name "HD13") (segid " " and resid "64 " and name "HE1 ") OR { 5722} (segid " " and resid "60 " and name "HD13") (segid " " and resid "64 " and name "HE2 ") ASSI {12947} (segid " " and resid "78 " and name "HA ") (segid " " and resid "79 " and name "HD1 ") 6.000 6.000 0.000 peak 12947 weight 0.10000E+01 volume 0.13500E+00 ppm1 5.873 ppm2 4.319 OR {12947} (segid " " and resid "78 " and name "HA ") (segid " " and resid "79 " and name "HD2 ") ASSI {12919} (segid " " and resid "79 " and name "HD1 ") (segid " " and resid "71 " and name "HG22") 5.000 5.000 0.000 peak 12919 weight 0.10000E+01 volume -0.30600E+00 ppm1 4.325 ppm2 0.845 OR {12919} (segid " " and resid "79 " and name "HD1 ") (segid " " and resid "71 " and name "HG23") OR {12919} (segid " " and resid "79 " and name "HD1 ") (segid " " and resid "71 " and name "HG21") OR {12919} (segid " " and resid "79 " and name "HD2 ") (segid " " and resid "71 " and name "HG22") OR {12919} (segid " " and resid "79 " and name "HD2 ") (segid " " and resid "71 " and name "HG23") OR {12919} (segid " " and resid "79 " and name "HD2 ") (segid " " and resid "71 " and name "HG21") ASSI {12951} (segid " " and resid "79 " and name "HD2 ") (segid " " and resid "78 " and name "HB1 ") 6.000 6.000 0.000 peak 12951 weight 0.10000E+01 volume -0.25700E+00 ppm1 4.319 ppm2 4.449 OR {12951} (segid " " and resid "79 " and name "HD1 ") (segid " " and resid "78 " and name "HB1 ") ASSI {12920} (segid " " and resid "79 " and name "HD2 ") (segid " " and resid "78 " and name "HB2 ") 5.000 5.000 0.000 peak 12920 weight 0.10000E+01 volume -0.35500E+00 ppm1 4.319 ppm2 4.292 OR {12920} (segid " " and resid "79 " and name "HD1 ") (segid " " and resid "78 " and name "HB2 ") ASSI {12952} (segid " " and resid "79 " and name "HD2 ") (segid " " and resid "79 " and name "HG2 ") 6.000 6.000 0.000 peak 12952 weight 0.10000E+01 volume -0.14500E+00 ppm1 4.319 ppm2 1.995 OR {12952} (segid " " and resid "79 " and name "HD1 ") (segid " " and resid "79 " and name "HG1 ") OR {12952} (segid " " and resid "79 " and name "HD2 ") (segid " " and resid "79 " and name "HG1 ") OR {12952} (segid " " and resid "79 " and name "HD1 ") (segid " " and resid "79 " and name "HG2 ") ASSI {13000} (segid " " and resid "80 " and name "HA ") (segid " " and resid "80 " and name "HG11") 3.300 3.300 0.000 peak 13000 weight 0.10000E+01 volume 0.26930E+01 ppm1 3.690 ppm2 0.879 OR {13000} (segid " " and resid "80 " and name "HA ") (segid " " and resid "80 " and name "HG12") OR {13000} (segid " " and resid "80 " and name "HA ") (segid " " and resid "80 " and name "HG13") ASSI { 5757} (segid " " and resid "80 " and name "HA ") (segid " " and resid "95 " and name "HD12") 5.000 5.000 0.000 peak 5757 weight 0.10000E+01 volume 0.56700E+00 ppm1 3.693 ppm2 0.753 OR { 5757} (segid " " and resid "80 " and name "HA ") (segid " " and resid "95 " and name "HD13") OR { 5757} (segid " " and resid "80 " and name "HA ") (segid " " and resid "95 " and name "HD11") ASSI { 5759} (segid " " and resid "83 " and name "HB3 ") (segid " " and resid "80 " and name "HA ") 5.000 5.000 0.000 peak 5759 weight 0.10000E+01 volume 0.11760E+01 ppm1 1.321 ppm2 3.697 OR { 5759} (segid " " and resid "83 " and name "HB1 ") (segid " " and resid "80 " and name "HA ") OR { 5759} (segid " " and resid "83 " and name "HB2 ") (segid " " and resid "80 " and name "HA ") ASSI { 5762} (segid " " and resid "84 " and name "HB1 ") (segid " " and resid "92 " and name "HD13") 5.000 5.000 0.000 peak 5762 weight 0.10000E+01 volume 0.88800E+00 ppm1 1.457 ppm2 0.956 OR { 5762} (segid " " and resid "84 " and name "HB2 ") (segid " " and resid "92 " and name "HD12") OR { 5762} (segid " " and resid "84 " and name "HB3 ") (segid " " and resid "92 " and name "HD12") OR { 5762} (segid " " and resid "84 " and name "HB3 ") (segid " " and resid "92 " and name "HD11") OR { 5762} (segid " " and resid "84 " and name "HB1 ") (segid " " and resid "92 " and name "HD12") OR { 5762} (segid " " and resid "84 " and name "HB1 ") (segid " " and resid "92 " and name "HD11") OR { 5762} (segid " " and resid "84 " and name "HB2 ") (segid " " and resid "92 " and name "HD13") OR { 5762} (segid " " and resid "84 " and name "HB2 ") (segid " " and resid "92 " and name "HD11") OR { 5762} (segid " " and resid "84 " and name "HB3 ") (segid " " and resid "92 " and name "HD13") ASSI { 5764} (segid " " and resid "86 " and name "HB ") (segid " " and resid "86 " and name "HA ") 5.000 5.000 0.000 peak 5764 weight 0.10000E+01 volume 0.17110E+01 ppm1 4.379 ppm2 4.332 ASSI { 5765} (segid " " and resid "88 " and name "HB1 ") (segid " " and resid "91 " and name "HB ") 6.000 6.000 0.000 peak 5765 weight 0.10000E+01 volume -0.64000E-01 ppm1 3.437 ppm2 4.208 ASSI { 5774} (segid " " and resid "89 " and name "HD23") (segid " " and resid "92 " and name "HD13") 5.000 5.000 0.000 peak 5774 weight 0.10000E+01 volume 0.75900E+00 ppm1 0.606 ppm2 0.962 OR { 5774} (segid " " and resid "89 " and name "HD21") (segid " " and resid "92 " and name "HD11") OR { 5774} (segid " " and resid "89 " and name "HD23") (segid " " and resid "92 " and name "HD11") OR { 5774} (segid " " and resid "89 " and name "HD21") (segid " " and resid "92 " and name "HD12") OR { 5774} (segid " " and resid "89 " and name "HD22") (segid " " and resid "92 " and name "HD11") OR { 5774} (segid " " and resid "89 " and name "HD22") (segid " " and resid "92 " and name "HD13") OR { 5774} (segid " " and resid "89 " and name "HD21") (segid " " and resid "92 " and name "HD13") OR { 5774} (segid " " and resid "89 " and name "HD22") (segid " " and resid "92 " and name "HD12") OR { 5774} (segid " " and resid "89 " and name "HD23") (segid " " and resid "92 " and name "HD12") ASSI { 5784} (segid " " and resid "92 " and name "HD12") (segid " " and resid "84 " and name "HA ") 5.000 5.000 0.000 peak 5784 weight 0.10000E+01 volume -0.33500E+00 ppm1 0.955 ppm2 3.959 OR { 5784} (segid " " and resid "92 " and name "HD13") (segid " " and resid "84 " and name "HA ") OR { 5784} (segid " " and resid "92 " and name "HD11") (segid " " and resid "84 " and name "HA ") ASSI { 5786} (segid " " and resid "92 " and name "HD11") (segid " " and resid "89 " and name "HA ") 6.000 6.000 0.000 peak 5786 weight 0.10000E+01 volume -0.21700E+00 ppm1 0.956 ppm2 3.737 OR { 5786} (segid " " and resid "92 " and name "HD13") (segid " " and resid "89 " and name "HA ") OR { 5786} (segid " " and resid "92 " and name "HD12") (segid " " and resid "89 " and name "HA ") ASSI { 5789} (segid " " and resid "92 " and name "HD13") (segid " " and resid "128 " and name "HG ") 5.000 5.000 0.000 peak 5789 weight 0.10000E+01 volume 0.46800E+00 ppm1 0.955 ppm2 2.008 OR { 5789} (segid " " and resid "92 " and name "HD11") (segid " " and resid "128 " and name "HG ") OR { 5789} (segid " " and resid "92 " and name "HD12") (segid " " and resid "128 " and name "HG ") ASSI { 5790} (segid " " and resid "92 " and name "HD23") (segid " " and resid "80 " and name "HA ") 5.000 5.000 0.000 peak 5790 weight 0.10000E+01 volume 0.67700E+00 ppm1 1.015 ppm2 3.707 OR { 5790} (segid " " and resid "92 " and name "HD22") (segid " " and resid "80 " and name "HA ") OR { 5790} (segid " " and resid "92 " and name "HD21") (segid " " and resid "80 " and name "HA ") ASSI { 5796} (segid " " and resid "93 " and name "HE1 ") (segid " " and resid "89 " and name "HD12") 6.000 6.000 0.000 peak 5796 weight 0.10000E+01 volume -0.66000E-01 ppm1 2.738 ppm2 0.849 OR { 5796} (segid " " and resid "93 " and name "HE1 ") (segid " " and resid "89 " and name "HD11") OR { 5796} (segid " " and resid "93 " and name "HE1 ") (segid " " and resid "89 " and name "HD13") ASSI { 5797} (segid " " and resid "93 " and name "HE2 ") (segid " " and resid "89 " and name "HD13") 6.000 6.000 0.000 peak 5797 weight 0.10000E+01 volume -0.19600E+00 ppm1 2.584 ppm2 0.842 OR { 5797} (segid " " and resid "93 " and name "HE2 ") (segid " " and resid "89 " and name "HD11") OR { 5797} (segid " " and resid "93 " and name "HE2 ") (segid " " and resid "89 " and name "HD12") ASSI { 5798} (segid " " and resid "93 " and name "HE1 ") (segid " " and resid "89 " and name "HD22") 6.000 6.000 0.000 peak 5798 weight 0.10000E+01 volume -0.56000E-01 ppm1 2.737 ppm2 0.595 OR { 5798} (segid " " and resid "93 " and name "HE1 ") (segid " " and resid "89 " and name "HD23") OR { 5798} (segid " " and resid "93 " and name "HE1 ") (segid " " and resid "89 " and name "HD21") ASSI { 5799} (segid " " and resid "93 " and name "HE2 ") (segid " " and resid "89 " and name "HD21") 6.000 6.000 0.000 peak 5799 weight 0.10000E+01 volume -0.13200E+00 ppm1 2.589 ppm2 0.612 OR { 5799} (segid " " and resid "93 " and name "HE2 ") (segid " " and resid "89 " and name "HD23") OR { 5799} (segid " " and resid "93 " and name "HE2 ") (segid " " and resid "89 " and name "HD22") ASSI {12929} (segid " " and resid "94 " and name "HA ") (segid " " and resid "97 " and name "HB1 ") 5.000 5.000 0.000 peak 12929 weight 0.10000E+01 volume 0.50400E+00 ppm1 4.046 ppm2 2.272 ASSI {12983} (segid " " and resid "96 " and name "HA ") (segid " " and resid "96 " and name "HG21") 3.300 3.300 0.000 peak 12983 weight 0.10000E+01 volume 0.27970E+01 ppm1 3.764 ppm2 1.123 OR {12983} (segid " " and resid "96 " and name "HA ") (segid " " and resid "96 " and name "HG23") OR {12983} (segid " " and resid "96 " and name "HA ") (segid " " and resid "96 " and name "HG22") ASSI { 5817} (segid " " and resid "97 " and name "HB2 ") (segid " " and resid "94 " and name "HA ") 6.000 6.000 0.000 peak 5817 weight 0.10000E+01 volume 0.26000E+00 ppm1 2.028 ppm2 4.048 ASSI { 5812} (segid " " and resid "97 " and name "HB1 ") (segid " " and resid "97 " and name "HA ") 3.300 3.300 0.000 peak 5812 weight 0.10000E+01 volume -0.22020E+01 ppm1 2.264 ppm2 4.100 ASSI { 5843} (segid " " and resid "108 " and name "HA ") (segid " " and resid "108 " and name "HB ") 5.000 5.000 0.000 peak 5843 weight 0.10000E+01 volume 0.16430E+01 ppm1 4.619 ppm2 4.541 ASSI {12977} (segid " " and resid "112 " and name "HG1 ") (segid " " and resid "112 " and name "HD1 ") 6.000 6.000 0.000 peak 12977 weight 0.10000E+01 volume -0.12500E+00 ppm1 1.811 ppm2 4.290 ASSI {12978} (segid " " and resid "112 " and name "HG1 ") (segid " " and resid "112 " and name "HG2 ") 5.000 5.000 0.000 peak 12978 weight 0.10000E+01 volume 0.37800E+00 ppm1 1.809 ppm2 0.889 ASSI { 5857} (segid " " and resid "113 " and name "HA ") (segid " " and resid "128 " and name "HD11") 5.000 5.000 0.000 peak 5857 weight 0.10000E+01 volume 0.79600E+00 ppm1 3.833 ppm2 0.728 OR { 5857} (segid " " and resid "113 " and name "HA ") (segid " " and resid "128 " and name "HD13") OR { 5857} (segid " " and resid "113 " and name "HA ") (segid " " and resid "128 " and name "HD12") ASSI { 5858} (segid " " and resid "113 " and name "HB ") (segid " " and resid "128 " and name "HD13") 6.000 6.000 0.000 peak 5858 weight 0.10000E+01 volume -0.29500E+00 ppm1 1.733 ppm2 0.727 OR { 5858} (segid " " and resid "113 " and name "HB ") (segid " " and resid "128 " and name "HD11") OR { 5858} (segid " " and resid "113 " and name "HB ") (segid " " and resid "128 " and name "HD12") ASSI { 5849} (segid " " and resid "113 " and name "HD12") (segid " " and resid "113 " and name "HG12") 5.000 5.000 0.000 peak 5849 weight 0.10000E+01 volume 0.45300E+00 ppm1 0.742 ppm2 1.387 OR { 5849} (segid " " and resid "113 " and name "HD11") (segid " " and resid "113 " and name "HG11") OR { 5849} (segid " " and resid "113 " and name "HD13") (segid " " and resid "113 " and name "HG11") OR { 5849} (segid " " and resid "113 " and name "HD11") (segid " " and resid "113 " and name "HG12") OR { 5849} (segid " " and resid "113 " and name "HD13") (segid " " and resid "113 " and name "HG12") OR { 5849} (segid " " and resid "113 " and name "HD12") (segid " " and resid "113 " and name "HG11") ASSI { 5861} (segid " " and resid "113 " and name "HD13") (segid " " and resid "129 " and name "HB2 ") 5.000 5.000 0.000 peak 5861 weight 0.10000E+01 volume 0.66200E+00 ppm1 0.741 ppm2 1.116 OR { 5861} (segid " " and resid "113 " and name "HD12") (segid " " and resid "129 " and name "HB2 ") OR { 5861} (segid " " and resid "113 " and name "HD13") (segid " " and resid "129 " and name "HB3 ") OR { 5861} (segid " " and resid "113 " and name "HD11") (segid " " and resid "129 " and name "HB3 ") OR { 5861} (segid " " and resid "113 " and name "HD12") (segid " " and resid "129 " and name "HB3 ") OR { 5861} (segid " " and resid "113 " and name "HD11") (segid " " and resid "129 " and name "HB2 ") OR { 5861} (segid " " and resid "113 " and name "HD12") (segid " " and resid "129 " and name "HB1 ") OR { 5861} (segid " " and resid "113 " and name "HD13") (segid " " and resid "129 " and name "HB1 ") OR { 5861} (segid " " and resid "113 " and name "HD11") (segid " " and resid "129 " and name "HB1 ") ASSI { 5862} (segid " " and resid "113 " and name "HD13") (segid " " and resid "134 " and name "HD21") 5.000 5.000 0.000 peak 5862 weight 0.10000E+01 volume 0.10270E+01 ppm1 0.737 ppm2 0.690 OR { 5862} (segid " " and resid "113 " and name "HD13") (segid " " and resid "134 " and name "HD23") OR { 5862} (segid " " and resid "113 " and name "HD11") (segid " " and resid "134 " and name "HD21") OR { 5862} (segid " " and resid "113 " and name "HD13") (segid " " and resid "134 " and name "HD22") OR { 5862} (segid " " and resid "113 " and name "HD11") (segid " " and resid "134 " and name "HD23") OR { 5862} (segid " " and resid "113 " and name "HD12") (segid " " and resid "134 " and name "HD21") OR { 5862} (segid " " and resid "113 " and name "HD11") (segid " " and resid "134 " and name "HD22") OR { 5862} (segid " " and resid "113 " and name "HD12") (segid " " and resid "134 " and name "HD22") OR { 5862} (segid " " and resid "113 " and name "HD12") (segid " " and resid "134 " and name "HD23") ASSI { 5864} (segid " " and resid "116 " and name "HB2 ") (segid " " and resid "113 " and name "HA ") 5.000 5.000 0.000 peak 5864 weight 0.10000E+01 volume 0.33400E+00 ppm1 1.489 ppm2 3.836 OR { 5864} (segid " " and resid "116 " and name "HB3 ") (segid " " and resid "113 " and name "HA ") OR { 5864} (segid " " and resid "116 " and name "HB1 ") (segid " " and resid "113 " and name "HA ") ASSI { 5870} (segid " " and resid "117 " and name "HA ") (segid " " and resid "156 " and name "HD11") 5.000 5.000 0.000 peak 5870 weight 0.10000E+01 volume 0.10140E+01 ppm1 3.515 ppm2 0.997 OR { 5870} (segid " " and resid "117 " and name "HA ") (segid " " and resid "156 " and name "HD13") OR { 5870} (segid " " and resid "117 " and name "HA ") (segid " " and resid "156 " and name "HD12") ASSI { 5871} (segid " " and resid "117 " and name "HD13") (segid " " and resid "144 " and name "HA ") 5.000 5.000 0.000 peak 5871 weight 0.10000E+01 volume 0.53900E+00 ppm1 0.899 ppm2 3.695 OR { 5871} (segid " " and resid "117 " and name "HD12") (segid " " and resid "144 " and name "HA ") OR { 5871} (segid " " and resid "117 " and name "HD11") (segid " " and resid "144 " and name "HA ") ASSI { 5872} (segid " " and resid "117 " and name "HG21") (segid " " and resid "147 " and name "HD13") 5.000 5.000 0.000 peak 5872 weight 0.10000E+01 volume 0.95000E+00 ppm1 0.778 ppm2 1.193 OR { 5872} (segid " " and resid "117 " and name "HG23") (segid " " and resid "147 " and name "HD11") OR { 5872} (segid " " and resid "117 " and name "HG22") (segid " " and resid "147 " and name "HD13") OR { 5872} (segid " " and resid "117 " and name "HG21") (segid " " and resid "147 " and name "HD11") OR { 5872} (segid " " and resid "117 " and name "HG23") (segid " " and resid "147 " and name "HD12") OR { 5872} (segid " " and resid "117 " and name "HG22") (segid " " and resid "147 " and name "HD12") OR { 5872} (segid " " and resid "117 " and name "HG21") (segid " " and resid "147 " and name "HD12") OR { 5872} (segid " " and resid "117 " and name "HG22") (segid " " and resid "147 " and name "HD11") OR { 5872} (segid " " and resid "117 " and name "HG23") (segid " " and resid "147 " and name "HD13") ASSI { 5820} (segid " " and resid "117 " and name "HG21") (segid " " and resid "147 " and name "HG ") 5.000 5.000 0.000 peak 5820 weight 0.10000E+01 volume 0.38000E+00 ppm1 0.776 ppm2 1.494 OR { 5820} (segid " " and resid "117 " and name "HG22") (segid " " and resid "147 " and name "HG ") OR { 5820} (segid " " and resid "117 " and name "HG23") (segid " " and resid "147 " and name "HG ") ASSI { 5873} (segid " " and resid "117 " and name "HG23") (segid " " and resid "148 " and name "HA ") 5.000 5.000 0.000 peak 5873 weight 0.10000E+01 volume -0.70200E+00 ppm1 0.778 ppm2 3.766 OR { 5873} (segid " " and resid "117 " and name "HG22") (segid " " and resid "148 " and name "HA ") OR { 5873} (segid " " and resid "117 " and name "HG21") (segid " " and resid "148 " and name "HA ") ASSI { 5874} (segid " " and resid "117 " and name "HG23") (segid " " and resid "148 " and name "HB2 ") 5.000 5.000 0.000 peak 5874 weight 0.10000E+01 volume 0.15850E+01 ppm1 0.778 ppm2 1.428 OR { 5874} (segid " " and resid "117 " and name "HG21") (segid " " and resid "148 " and name "HB2 ") OR { 5874} (segid " " and resid "117 " and name "HG22") (segid " " and resid "148 " and name "HB2 ") OR { 5874} (segid " " and resid "117 " and name "HG22") (segid " " and resid "148 " and name "HB3 ") OR { 5874} (segid " " and resid "117 " and name "HG21") (segid " " and resid "148 " and name "HB1 ") OR { 5874} (segid " " and resid "117 " and name "HG23") (segid " " and resid "148 " and name "HB3 ") OR { 5874} (segid " " and resid "117 " and name "HG22") (segid " " and resid "148 " and name "HB1 ") OR { 5874} (segid " " and resid "117 " and name "HG21") (segid " " and resid "148 " and name "HB3 ") OR { 5874} (segid " " and resid "117 " and name "HG23") (segid " " and resid "148 " and name "HB1 ") ASSI { 5875} (segid " " and resid "117 " and name "HG23") (segid " " and resid "156 " and name "HD11") 5.000 5.000 0.000 peak 5875 weight 0.10000E+01 volume 0.85700E+00 ppm1 0.778 ppm2 0.995 OR { 5875} (segid " " and resid "117 " and name "HG22") (segid " " and resid "156 " and name "HD13") OR { 5875} (segid " " and resid "117 " and name "HG22") (segid " " and resid "156 " and name "HD11") OR { 5875} (segid " " and resid "117 " and name "HG21") (segid " " and resid "156 " and name "HD13") OR { 5875} (segid " " and resid "117 " and name "HG23") (segid " " and resid "156 " and name "HD12") OR { 5875} (segid " " and resid "117 " and name "HG22") (segid " " and resid "156 " and name "HD12") OR { 5875} (segid " " and resid "117 " and name "HG21") (segid " " and resid "156 " and name "HD11") OR { 5875} (segid " " and resid "117 " and name "HG23") (segid " " and resid "156 " and name "HD13") OR { 5875} (segid " " and resid "117 " and name "HG21") (segid " " and resid "156 " and name "HD12") ASSI { 5883} (segid " " and resid "126 " and name "HB2 ") (segid " " and resid "159 " and name "HD11") 5.000 5.000 0.000 peak 5883 weight 0.10000E+01 volume 0.79900E+00 ppm1 3.878 ppm2 0.913 OR { 5883} (segid " " and resid "126 " and name "HB1 ") (segid " " and resid "159 " and name "HD11") OR { 5883} (segid " " and resid "126 " and name "HB2 ") (segid " " and resid "159 " and name "HD12") OR { 5883} (segid " " and resid "126 " and name "HB1 ") (segid " " and resid "159 " and name "HD12") OR { 5883} (segid " " and resid "126 " and name "HB1 ") (segid " " and resid "159 " and name "HD13") OR { 5883} (segid " " and resid "126 " and name "HB2 ") (segid " " and resid "159 " and name "HD13") ASSI { 5893} (segid " " and resid "128 " and name "HD12") (segid " " and resid "113 " and name "HD12") 5.000 5.000 0.000 peak 5893 weight 0.10000E+01 volume 0.41700E+00 ppm1 0.716 ppm2 0.745 OR { 5893} (segid " " and resid "128 " and name "HD13") (segid " " and resid "113 " and name "HD12") OR { 5893} (segid " " and resid "128 " and name "HD11") (segid " " and resid "113 " and name "HD13") OR { 5893} (segid " " and resid "128 " and name "HD11") (segid " " and resid "113 " and name "HD12") OR { 5893} (segid " " and resid "128 " and name "HD13") (segid " " and resid "113 " and name "HD13") OR { 5893} (segid " " and resid "128 " and name "HD13") (segid " " and resid "113 " and name "HD11") OR { 5893} (segid " " and resid "128 " and name "HD12") (segid " " and resid "113 " and name "HD13") OR { 5893} (segid " " and resid "128 " and name "HD12") (segid " " and resid "113 " and name "HD11") OR { 5893} (segid " " and resid "128 " and name "HD11") (segid " " and resid "113 " and name "HD11") ASSI { 5899} (segid " " and resid "130 " and name "HD1 ") (segid " " and resid "129 " and name "HB2 ") 6.000 6.000 0.000 peak 5899 weight 0.10000E+01 volume -0.25100E+00 ppm1 3.470 ppm2 1.124 OR { 5899} (segid " " and resid "130 " and name "HD1 ") (segid " " and resid "129 " and name "HB3 ") OR { 5899} (segid " " and resid "130 " and name "HD1 ") (segid " " and resid "129 " and name "HB1 ") ASSI { 5900} (segid " " and resid "130 " and name "HD2 ") (segid " " and resid "129 " and name "HB2 ") 6.000 6.000 0.000 peak 5900 weight 0.10000E+01 volume -0.20900E+00 ppm1 3.066 ppm2 1.128 OR { 5900} (segid " " and resid "130 " and name "HD2 ") (segid " " and resid "129 " and name "HB3 ") OR { 5900} (segid " " and resid "130 " and name "HD2 ") (segid " " and resid "129 " and name "HB1 ") ASSI { 5901} (segid " " and resid "131 " and name "HB1 ") (segid " " and resid "102 " and name "HG23") 5.000 5.000 0.000 peak 5901 weight 0.10000E+01 volume 0.11590E+01 ppm1 2.281 ppm2 0.883 OR { 5901} (segid " " and resid "131 " and name "HB1 ") (segid " " and resid "102 " and name "HG21") OR { 5901} (segid " " and resid "131 " and name "HB1 ") (segid " " and resid "102 " and name "HG22") ASSI { 5902} (segid " " and resid "131 " and name "HB2 ") (segid " " and resid "102 " and name "HG21") 5.000 5.000 0.000 peak 5902 weight 0.10000E+01 volume 0.56100E+00 ppm1 1.483 ppm2 0.883 OR { 5902} (segid " " and resid "131 " and name "HB2 ") (segid " " and resid "102 " and name "HG23") OR { 5902} (segid " " and resid "131 " and name "HB2 ") (segid " " and resid "102 " and name "HG22") ASSI { 5906} (segid " " and resid "134 " and name "HD21") (segid " " and resid "113 " and name "HG22") 5.000 5.000 0.000 peak 5906 weight 0.10000E+01 volume 0.77000E+00 ppm1 0.691 ppm2 0.742 OR { 5906} (segid " " and resid "134 " and name "HD23") (segid " " and resid "113 " and name "HG22") OR { 5906} (segid " " and resid "134 " and name "HD21") (segid " " and resid "113 " and name "HG23") OR { 5906} (segid " " and resid "134 " and name "HD22") (segid " " and resid "113 " and name "HG22") OR { 5906} (segid " " and resid "134 " and name "HD22") (segid " " and resid "113 " and name "HG23") OR { 5906} (segid " " and resid "134 " and name "HD23") (segid " " and resid "113 " and name "HG23") OR { 5906} (segid " " and resid "134 " and name "HD23") (segid " " and resid "113 " and name "HG21") OR { 5906} (segid " " and resid "134 " and name "HD22") (segid " " and resid "113 " and name "HG21") OR { 5906} (segid " " and resid "134 " and name "HD21") (segid " " and resid "113 " and name "HG21") ASSI { 5935} (segid " " and resid "147 " and name "HB1 ") (segid " " and resid "144 " and name "HA ") 6.000 6.000 0.000 peak 5935 weight 0.10000E+01 volume -0.13100E+00 ppm1 2.141 ppm2 3.696 ASSI { 5931} (segid " " and resid "147 " and name "HB1 ") (segid " " and resid "147 " and name "HD12") 5.000 5.000 0.000 peak 5931 weight 0.10000E+01 volume -0.52600E+00 ppm1 2.136 ppm2 1.186 OR { 5931} (segid " " and resid "147 " and name "HB1 ") (segid " " and resid "147 " and name "HD11") OR { 5931} (segid " " and resid "147 " and name "HB1 ") (segid " " and resid "147 " and name "HD13") ASSI { 5936} (segid " " and resid "147 " and name "HB1 ") (segid " " and resid "156 " and name "HD11") 5.000 5.000 0.000 peak 5936 weight 0.10000E+01 volume -0.36600E+00 ppm1 2.092 ppm2 0.995 OR { 5936} (segid " " and resid "147 " and name "HB1 ") (segid " " and resid "156 " and name "HD13") OR { 5936} (segid " " and resid "147 " and name "HB1 ") (segid " " and resid "156 " and name "HD12") ASSI { 5941} (segid " " and resid "148 " and name "HB2 ") (segid " " and resid "145 " and name "HA ") 5.000 5.000 0.000 peak 5941 weight 0.10000E+01 volume -0.46600E+00 ppm1 1.440 ppm2 3.950 OR { 5941} (segid " " and resid "148 " and name "HB3 ") (segid " " and resid "145 " and name "HA ") OR { 5941} (segid " " and resid "148 " and name "HB1 ") (segid " " and resid "145 " and name "HA ") ASSI { 5942} (segid " " and resid "148 " and name "HB3 ") (segid " " and resid "156 " and name "HD13") 5.000 5.000 0.000 peak 5942 weight 0.10000E+01 volume 0.15070E+01 ppm1 1.429 ppm2 1.002 OR { 5942} (segid " " and resid "148 " and name "HB2 ") (segid " " and resid "156 " and name "HD12") OR { 5942} (segid " " and resid "148 " and name "HB1 ") (segid " " and resid "156 " and name "HD11") OR { 5942} (segid " " and resid "148 " and name "HB2 ") (segid " " and resid "156 " and name "HD13") OR { 5942} (segid " " and resid "148 " and name "HB3 ") (segid " " and resid "156 " and name "HD12") OR { 5942} (segid " " and resid "148 " and name "HB1 ") (segid " " and resid "156 " and name "HD13") OR { 5942} (segid " " and resid "148 " and name "HB1 ") (segid " " and resid "156 " and name "HD12") OR { 5942} (segid " " and resid "148 " and name "HB2 ") (segid " " and resid "156 " and name "HD11") OR { 5942} (segid " " and resid "148 " and name "HB3 ") (segid " " and resid "156 " and name "HD11") ASSI { 5943} (segid " " and resid "148 " and name "HB3 ") (segid " " and resid "157 " and name "HA ") 6.000 6.000 0.000 peak 5943 weight 0.10000E+01 volume 0.20500E+00 ppm1 1.443 ppm2 3.736 OR { 5943} (segid " " and resid "148 " and name "HB2 ") (segid " " and resid "157 " and name "HA ") OR { 5943} (segid " " and resid "148 " and name "HB1 ") (segid " " and resid "157 " and name "HA ") ASSI { 5944} (segid " " and resid "148 " and name "HB2 ") (segid " " and resid "157 " and name "HG2 ") 5.000 5.000 0.000 peak 5944 weight 0.10000E+01 volume 0.69200E+00 ppm1 1.440 ppm2 2.339 OR { 5944} (segid " " and resid "148 " and name "HB1 ") (segid " " and resid "157 " and name "HG1 ") OR { 5944} (segid " " and resid "148 " and name "HB3 ") (segid " " and resid "157 " and name "HG2 ") OR { 5944} (segid " " and resid "148 " and name "HB2 ") (segid " " and resid "157 " and name "HG1 ") OR { 5944} (segid " " and resid "148 " and name "HB1 ") (segid " " and resid "157 " and name "HG2 ") OR { 5944} (segid " " and resid "148 " and name "HB3 ") (segid " " and resid "157 " and name "HG1 ") ASSI { 5945} (segid " " and resid "148 " and name "HB2 ") (segid " " and resid "160 " and name "HD13") 5.000 5.000 0.000 peak 5945 weight 0.10000E+01 volume 0.10780E+01 ppm1 1.440 ppm2 0.647 OR { 5945} (segid " " and resid "148 " and name "HB2 ") (segid " " and resid "160 " and name "HD11") OR { 5945} (segid " " and resid "148 " and name "HB1 ") (segid " " and resid "160 " and name "HD13") OR { 5945} (segid " " and resid "148 " and name "HB1 ") (segid " " and resid "160 " and name "HD12") OR { 5945} (segid " " and resid "148 " and name "HB3 ") (segid " " and resid "160 " and name "HD11") OR { 5945} (segid " " and resid "148 " and name "HB1 ") (segid " " and resid "160 " and name "HD11") OR { 5945} (segid " " and resid "148 " and name "HB3 ") (segid " " and resid "160 " and name "HD12") OR { 5945} (segid " " and resid "148 " and name "HB2 ") (segid " " and resid "160 " and name "HD12") OR { 5945} (segid " " and resid "148 " and name "HB3 ") (segid " " and resid "160 " and name "HD13") ASSI { 5963} (segid " " and resid "156 " and name "HA ") (segid " " and resid "156 " and name "HD12") 6.000 6.000 0.000 peak 5963 weight 0.10000E+01 volume -0.21000E+00 ppm1 4.157 ppm2 1.000 OR { 5963} (segid " " and resid "156 " and name "HA ") (segid " " and resid "156 " and name "HD13") OR { 5963} (segid " " and resid "156 " and name "HA ") (segid " " and resid "156 " and name "HD11") ASSI { 5965} (segid " " and resid "156 " and name "HA ") (segid " " and resid "159 " and name "HB ") 6.000 6.000 0.000 peak 5965 weight 0.10000E+01 volume 0.21500E+00 ppm1 4.159 ppm2 1.881 ASSI { 5966} (segid " " and resid "156 " and name "HA ") (segid " " and resid "159 " and name "HD12") 5.000 5.000 0.000 peak 5966 weight 0.10000E+01 volume -0.44300E+00 ppm1 4.157 ppm2 0.905 OR { 5966} (segid " " and resid "156 " and name "HA ") (segid " " and resid "159 " and name "HD11") OR { 5966} (segid " " and resid "156 " and name "HA ") (segid " " and resid "159 " and name "HD13") ASSI { 5968} (segid " " and resid "156 " and name "HD11") (segid " " and resid "153 " and name "HB2 ") 3.300 3.300 0.000 peak 5968 weight 0.10000E+01 volume 0.24720E+01 ppm1 0.997 ppm2 1.382 OR { 5968} (segid " " and resid "156 " and name "HD11") (segid " " and resid "153 " and name "HB3 ") OR { 5968} (segid " " and resid "156 " and name "HD12") (segid " " and resid "153 " and name "HB2 ") OR { 5968} (segid " " and resid "156 " and name "HD12") (segid " " and resid "153 " and name "HB3 ") OR { 5968} (segid " " and resid "156 " and name "HD13") (segid " " and resid "153 " and name "HB1 ") OR { 5968} (segid " " and resid "156 " and name "HD13") (segid " " and resid "153 " and name "HB3 ") OR { 5968} (segid " " and resid "156 " and name "HD12") (segid " " and resid "153 " and name "HB1 ") OR { 5968} (segid " " and resid "156 " and name "HD11") (segid " " and resid "153 " and name "HB1 ") OR { 5968} (segid " " and resid "156 " and name "HD13") (segid " " and resid "153 " and name "HB2 ") ASSI { 5960} (segid " " and resid "156 " and name "HD13") (segid " " and resid "156 " and name "HG ") 5.000 5.000 0.000 peak 5960 weight 0.10000E+01 volume 0.11610E+01 ppm1 0.998 ppm2 1.885 OR { 5960} (segid " " and resid "156 " and name "HD12") (segid " " and resid "156 " and name "HG ") OR { 5960} (segid " " and resid "156 " and name "HD11") (segid " " and resid "156 " and name "HG ") ASSI { 5969} (segid " " and resid "156 " and name "HG ") (segid " " and resid "153 " and name "HB3 ") 5.000 5.000 0.000 peak 5969 weight 0.10000E+01 volume 0.52100E+00 ppm1 1.880 ppm2 1.386 OR { 5969} (segid " " and resid "156 " and name "HG ") (segid " " and resid "153 " and name "HB1 ") OR { 5969} (segid " " and resid "156 " and name "HG ") (segid " " and resid "153 " and name "HB2 ") ASSI { 5973} (segid " " and resid "157 " and name "HE1 ") (segid " " and resid "157 " and name "HG1 ") 5.000 5.000 0.000 peak 5973 weight 0.10000E+01 volume 0.12060E+01 ppm1 2.052 ppm2 2.331 OR { 5973} (segid " " and resid "157 " and name "HE3 ") (segid " " and resid "157 " and name "HG2 ") OR { 5973} (segid " " and resid "157 " and name "HE2 ") (segid " " and resid "157 " and name "HG1 ") OR { 5973} (segid " " and resid "157 " and name "HE3 ") (segid " " and resid "157 " and name "HG1 ") OR { 5973} (segid " " and resid "157 " and name "HE1 ") (segid " " and resid "157 " and name "HG2 ") OR { 5973} (segid " " and resid "157 " and name "HE2 ") (segid " " and resid "157 " and name "HG2 ") ASSI { 5976} (segid " " and resid "159 " and name "HD11") (segid " " and resid "159 " and name "HB ") 5.000 5.000 0.000 peak 5976 weight 0.10000E+01 volume -0.12580E+01 ppm1 0.912 ppm2 1.872 OR { 5976} (segid " " and resid "159 " and name "HD12") (segid " " and resid "159 " and name "HB ") OR { 5976} (segid " " and resid "159 " and name "HD13") (segid " " and resid "159 " and name "HB ") ASSI { 5975} (segid " " and resid "159 " and name "HD13") (segid " " and resid "159 " and name "HG12") 5.000 5.000 0.000 peak 5975 weight 0.10000E+01 volume 0.19480E+01 ppm1 0.918 ppm2 1.119 OR { 5975} (segid " " and resid "159 " and name "HD11") (segid " " and resid "159 " and name "HG12") OR { 5975} (segid " " and resid "159 " and name "HD12") (segid " " and resid "159 " and name "HG12") ASSI { 6000} (segid " " and resid "160 " and name "HD23") (segid " " and resid "113 " and name "HD13") 5.000 5.000 0.000 peak 6000 weight 0.10000E+01 volume 0.13930E+01 ppm1 0.758 ppm2 0.734 OR { 6000} (segid " " and resid "160 " and name "HD22") (segid " " and resid "113 " and name "HD13") OR { 6000} (segid " " and resid "160 " and name "HD21") (segid " " and resid "113 " and name "HD13") OR { 6000} (segid " " and resid "160 " and name "HD23") (segid " " and resid "113 " and name "HD11") OR { 6000} (segid " " and resid "160 " and name "HD21") (segid " " and resid "113 " and name "HD11") OR { 6000} (segid " " and resid "160 " and name "HD23") (segid " " and resid "113 " and name "HD12") OR { 6000} (segid " " and resid "160 " and name "HD22") (segid " " and resid "113 " and name "HD12") OR { 6000} (segid " " and resid "160 " and name "HD22") (segid " " and resid "113 " and name "HD11") OR { 6000} (segid " " and resid "160 " and name "HD21") (segid " " and resid "113 " and name "HD12") ASSI { 6007} (segid " " and resid "164 " and name "HE3 ") (segid " " and resid "164 " and name "HB1 ") 5.000 5.000 0.000 peak 6007 weight 0.10000E+01 volume -0.82400E+00 ppm1 1.973 ppm2 2.303 OR { 6007} (segid " " and resid "164 " and name "HE2 ") (segid " " and resid "164 " and name "HB1 ") OR { 6007} (segid " " and resid "164 " and name "HE1 ") (segid " " and resid "164 " and name "HB1 ") ASSI { 6002} (segid " " and resid "164 " and name "HE1 ") (segid " " and resid "164 " and name "HG1 ") 6.000 6.000 0.000 peak 6002 weight 0.10000E+01 volume -0.96000E-01 ppm1 1.973 ppm2 2.703 OR { 6002} (segid " " and resid "164 " and name "HE3 ") (segid " " and resid "164 " and name "HG1 ") OR { 6002} (segid " " and resid "164 " and name "HE2 ") (segid " " and resid "164 " and name "HG1 ") ASSI { 6001} (segid " " and resid "164 " and name "HE3 ") (segid " " and resid "164 " and name "HG2 ") 5.000 5.000 0.000 peak 6001 weight 0.10000E+01 volume -0.32400E+00 ppm1 1.973 ppm2 2.341 OR { 6001} (segid " " and resid "164 " and name "HE2 ") (segid " " and resid "164 " and name "HG2 ") OR { 6001} (segid " " and resid "164 " and name "HE1 ") (segid " " and resid "164 " and name "HG2 ") ASSI {12857} (segid " " and resid "166 " and name "HD13") (segid " " and resid "166 " and name "HG12") 3.300 3.300 0.000 peak 12857 weight 0.10000E+01 volume 0.27260E+01 ppm1 0.907 ppm2 1.193 OR {12857} (segid " " and resid "166 " and name "HD11") (segid " " and resid "166 " and name "HG12") OR {12857} (segid " " and resid "166 " and name "HD12") (segid " " and resid "166 " and name "HG12") ASSI {12856} (segid " " and resid "166 " and name "HG21") (segid " " and resid "166 " and name "HG12") 5.000 5.000 0.000 peak 12856 weight 0.10000E+01 volume 0.52200E+00 ppm1 0.996 ppm2 1.230 OR {12856} (segid " " and resid "166 " and name "HG23") (segid " " and resid "166 " and name "HG12") OR {12856} (segid " " and resid "166 " and name "HG22") (segid " " and resid "166 " and name "HG12") ASSI { 6018} (segid " " and resid "167 " and name "HD1 ") (segid " " and resid "166 " and name "HA ") 3.300 3.300 0.000 peak 6018 weight 0.10000E+01 volume 0.20880E+01 ppm1 3.932 ppm2 4.517 ASSI {12853} (segid " " and resid "167 " and name "HG1 ") (segid " " and resid "167 " and name "HD1 ") 5.000 5.000 0.000 peak 12853 weight 0.10000E+01 volume -0.62400E+00 ppm1 2.100 ppm2 3.957 ASSI {12852} (segid " " and resid "167 " and name "HG1 ") (segid " " and resid "167 " and name "HD2 ") 5.000 5.000 0.000 peak 12852 weight 0.10000E+01 volume -0.71600E+00 ppm1 2.100 ppm2 3.760 ASSI {12854} (segid " " and resid "167 " and name "HG2 ") (segid " " and resid "167 " and name "HD2 ") 5.000 5.000 0.000 peak 12854 weight 0.10000E+01 volume -0.58200E+00 ppm1 1.998 ppm2 3.760 ASSI { 8021} (segid " " and resid "7 " and name "HN ") (segid " " and resid "7 " and name "HA ") 5.000 5.000 0.000 peak 8021 weight 0.10000E+01 volume 0.10000E+01 ppm1 8.326 ppm2 4.291 ASSI { 8022} (segid " " and resid "7 " and name "HN ") (segid " " and resid "7 " and name "HB2 ") 5.000 5.000 0.000 peak 8022 weight 0.10000E+01 volume 0.12640E+01 ppm1 8.332 ppm2 2.018 OR { 8022} (segid " " and resid "7 " and name "HN ") (segid " " and resid "7 " and name "HB1 ") ASSI { 8031} (segid " " and resid "11 " and name "HN ") (segid " " and resid "11 " and name "HA2 ") 3.300 3.300 0.000 peak 8031 weight 0.10000E+01 volume 0.17230E+01 ppm1 8.767 ppm2 3.642 OR { 8031} (segid " " and resid "11 " and name "HN ") (segid " " and resid "11 " and name "HA1 ") ASSI { 8035} (segid " " and resid "12 " and name "HN ") (segid " " and resid "11 " and name "HA2 ") 5.000 5.000 0.000 peak 8035 weight 0.10000E+01 volume 0.50700E+00 ppm1 8.088 ppm2 3.640 OR { 8035} (segid " " and resid "12 " and name "HN ") (segid " " and resid "11 " and name "HA1 ") ASSI { 8036} (segid " " and resid "12 " and name "HN ") (segid " " and resid "11 " and name "HN ") 5.000 5.000 0.000 peak 8036 weight 0.10000E+01 volume 0.30900E+00 ppm1 8.093 ppm2 8.765 ASSI { 8037} (segid " " and resid "12 " and name "HN ") (segid " " and resid "12 " and name "HA ") 5.000 5.000 0.000 peak 8037 weight 0.10000E+01 volume 0.31100E+00 ppm1 8.087 ppm2 4.600 ASSI { 8038} (segid " " and resid "12 " and name "HN ") (segid " " and resid "12 " and name "HB1 ") 5.000 5.000 0.000 peak 8038 weight 0.10000E+01 volume 0.83900E+00 ppm1 8.083 ppm2 3.035 ASSI { 8039} (segid " " and resid "12 " and name "HN ") (segid " " and resid "12 " and name "HB2 ") 5.000 5.000 0.000 peak 8039 weight 0.10000E+01 volume 0.54700E+00 ppm1 8.083 ppm2 2.696 ASSI { 8042} (segid " " and resid "14 " and name "HN ") (segid " " and resid "14 " and name "HA ") 5.000 5.000 0.000 peak 8042 weight 0.10000E+01 volume 0.81000E+00 ppm1 8.343 ppm2 4.087 ASSI { 8043} (segid " " and resid "14 " and name "HN ") (segid " " and resid "14 " and name "HB1 ") 2.700 2.700 0.000 peak 8043 weight 0.10000E+01 volume 0.33890E+01 ppm1 8.340 ppm2 1.986 ASSI { 8044} (segid " " and resid "14 " and name "HN ") (segid " " and resid "14 " and name "HB2 ") 3.300 3.300 0.000 peak 8044 weight 0.10000E+01 volume 0.15660E+01 ppm1 8.341 ppm2 1.367 ASSI { 8045} (segid " " and resid "14 " and name "HN ") (segid " " and resid "14 " and name "HG ") 5.000 5.000 0.000 peak 8045 weight 0.10000E+01 volume 0.99400E+00 ppm1 8.341 ppm2 1.517 ASSI { 8055} (segid " " and resid "15 " and name "HN ") (segid " " and resid "14 " and name "HB1 ") 5.000 5.000 0.000 peak 8055 weight 0.10000E+01 volume 0.60600E+00 ppm1 8.240 ppm2 2.005 ASSI { 8056} (segid " " and resid "15 " and name "HN ") (segid " " and resid "15 " and name "HG ") 5.000 5.000 0.000 peak 8056 weight 0.10000E+01 volume 0.39100E+00 ppm1 8.257 ppm2 5.767 ASSI { 8057} (segid " " and resid "15 " and name "HN ") (segid " " and resid "16 " and name "HN ") 2.700 2.700 0.000 peak 8057 weight 0.10000E+01 volume 0.40520E+01 ppm1 8.256 ppm2 8.347 ASSI { 8064} (segid " " and resid "16 " and name "HN ") (segid " " and resid "16 " and name "HA2 ") 3.300 3.300 0.000 peak 8064 weight 0.10000E+01 volume 0.27220E+01 ppm1 8.351 ppm2 3.854 ASSI { 8065} (segid " " and resid "16 " and name "HN ") (segid " " and resid "17 " and name "HN ") 5.000 5.000 0.000 peak 8065 weight 0.10000E+01 volume 0.87100E+00 ppm1 8.350 ppm2 7.618 ASSI { 8070} (segid " " and resid "17 " and name "HN ") (segid " " and resid "16 " and name "HA1 ") 5.000 5.000 0.000 peak 8070 weight 0.10000E+01 volume 0.91600E+00 ppm1 7.620 ppm2 3.954 ASSI { 8071} (segid " " and resid "17 " and name "HN ") (segid " " and resid "16 " and name "HA2 ") 5.000 5.000 0.000 peak 8071 weight 0.10000E+01 volume 0.70300E+00 ppm1 7.621 ppm2 3.846 ASSI { 8072} (segid " " and resid "17 " and name "HN ") (segid " " and resid "17 " and name "HA ") 5.000 5.000 0.000 peak 8072 weight 0.10000E+01 volume 0.11760E+01 ppm1 7.622 ppm2 4.156 ASSI { 8073} (segid " " and resid "17 " and name "HN ") (segid " " and resid "17 " and name "HB2 ") 3.300 3.300 0.000 peak 8073 weight 0.10000E+01 volume 0.25780E+01 ppm1 7.620 ppm2 1.503 OR { 8073} (segid " " and resid "17 " and name "HN ") (segid " " and resid "17 " and name "HB3 ") OR { 8073} (segid " " and resid "17 " and name "HN ") (segid " " and resid "17 " and name "HB1 ") ASSI { 8079} (segid " " and resid "18 " and name "HN ") (segid " " and resid "17 " and name "HA ") 5.000 5.000 0.000 peak 8079 weight 0.10000E+01 volume 0.33300E+00 ppm1 8.360 ppm2 4.145 ASSI { 8080} (segid " " and resid "18 " and name "HN ") (segid " " and resid "17 " and name "HB3 ") 3.300 3.300 0.000 peak 8080 weight 0.10000E+01 volume 0.16310E+01 ppm1 8.359 ppm2 1.507 OR { 8080} (segid " " and resid "18 " and name "HN ") (segid " " and resid "17 " and name "HB1 ") OR { 8080} (segid " " and resid "18 " and name "HN ") (segid " " and resid "17 " and name "HB2 ") ASSI { 8081} (segid " " and resid "18 " and name "HN ") (segid " " and resid "17 " and name "HN ") 5.000 5.000 0.000 peak 8081 weight 0.10000E+01 volume 0.12900E+01 ppm1 8.359 ppm2 7.618 ASSI { 8082} (segid " " and resid "18 " and name "HN ") (segid " " and resid "18 " and name "HA ") 5.000 5.000 0.000 peak 8082 weight 0.10000E+01 volume 0.10690E+01 ppm1 8.364 ppm2 3.827 ASSI { 8083} (segid " " and resid "18 " and name "HN ") (segid " " and resid "18 " and name "HB2 ") 2.700 2.700 0.000 peak 8083 weight 0.10000E+01 volume 0.30130E+01 ppm1 8.360 ppm2 1.307 OR { 8083} (segid " " and resid "18 " and name "HN ") (segid " " and resid "18 " and name "HB3 ") OR { 8083} (segid " " and resid "18 " and name "HN ") (segid " " and resid "18 " and name "HB1 ") ASSI { 8084} (segid " " and resid "18 " and name "HN ") (segid " " and resid "19 " and name "HN ") 5.000 5.000 0.000 peak 8084 weight 0.10000E+01 volume 0.10380E+01 ppm1 8.359 ppm2 8.965 ASSI { 8089} (segid " " and resid "19 " and name "HN ") (segid " " and resid "16 " and name "HA1 ") 5.000 5.000 0.000 peak 8089 weight 0.10000E+01 volume 0.39500E+00 ppm1 8.958 ppm2 3.950 ASSI { 8091} (segid " " and resid "19 " and name "HN ") (segid " " and resid "18 " and name "HB3 ") 5.000 5.000 0.000 peak 8091 weight 0.10000E+01 volume 0.10560E+01 ppm1 8.961 ppm2 1.307 OR { 8091} (segid " " and resid "19 " and name "HN ") (segid " " and resid "18 " and name "HB1 ") OR { 8091} (segid " " and resid "19 " and name "HN ") (segid " " and resid "18 " and name "HB2 ") ASSI { 8093} (segid " " and resid "19 " and name "HN ") (segid " " and resid "19 " and name "HA ") 5.000 5.000 0.000 peak 8093 weight 0.10000E+01 volume 0.89400E+00 ppm1 8.968 ppm2 4.294 ASSI { 8094} (segid " " and resid "19 " and name "HN ") (segid " " and resid "19 " and name "HB3 ") 3.300 3.300 0.000 peak 8094 weight 0.10000E+01 volume 0.28840E+01 ppm1 8.963 ppm2 1.547 OR { 8094} (segid " " and resid "19 " and name "HN ") (segid " " and resid "19 " and name "HB2 ") OR { 8094} (segid " " and resid "19 " and name "HN ") (segid " " and resid "19 " and name "HB1 ") ASSI { 8095} (segid " " and resid "19 " and name "HN ") (segid " " and resid "20 " and name "HN ") 5.000 5.000 0.000 peak 8095 weight 0.10000E+01 volume 0.73200E+00 ppm1 8.964 ppm2 7.415 ASSI { 8097} (segid " " and resid "20 " and name "HN ") (segid " " and resid "18 " and name "HA ") 6.000 6.000 0.000 peak 8097 weight 0.10000E+01 volume 0.13800E+00 ppm1 7.418 ppm2 3.812 ASSI { 8098} (segid " " and resid "20 " and name "HN ") (segid " " and resid "19 " and name "HA ") 5.000 5.000 0.000 peak 8098 weight 0.10000E+01 volume 0.34700E+00 ppm1 7.419 ppm2 4.300 ASSI { 8099} (segid " " and resid "20 " and name "HN ") (segid " " and resid "19 " and name "HB3 ") 5.000 5.000 0.000 peak 8099 weight 0.10000E+01 volume 0.82800E+00 ppm1 7.418 ppm2 1.549 OR { 8099} (segid " " and resid "20 " and name "HN ") (segid " " and resid "19 " and name "HB1 ") OR { 8099} (segid " " and resid "20 " and name "HN ") (segid " " and resid "19 " and name "HB2 ") ASSI { 8101} (segid " " and resid "20 " and name "HN ") (segid " " and resid "20 " and name "HA ") 5.000 5.000 0.000 peak 8101 weight 0.10000E+01 volume 0.71900E+00 ppm1 7.415 ppm2 4.528 ASSI { 8102} (segid " " and resid "20 " and name "HN ") (segid " " and resid "20 " and name "HB2 ") 3.300 3.300 0.000 peak 8102 weight 0.10000E+01 volume 0.19740E+01 ppm1 7.416 ppm2 1.993 OR { 8102} (segid " " and resid "20 " and name "HN ") (segid " " and resid "20 " and name "HB1 ") ASSI { 8103} (segid " " and resid "20 " and name "HN ") (segid " " and resid "20 " and name "HG1 ") 3.300 3.300 0.000 peak 8103 weight 0.10000E+01 volume 0.21460E+01 ppm1 7.419 ppm2 1.927 ASSI { 8104} (segid " " and resid "20 " and name "HN ") (segid " " and resid "20 " and name "HG2 ") 5.000 5.000 0.000 peak 8104 weight 0.10000E+01 volume 0.81800E+00 ppm1 7.413 ppm2 1.813 ASSI { 8105} (segid " " and resid "20 " and name "HN ") (segid " " and resid "21 " and name "HN ") 5.000 5.000 0.000 peak 8105 weight 0.10000E+01 volume 0.11870E+01 ppm1 7.417 ppm2 7.904 ASSI { 8111} (segid " " and resid "21 " and name "HN ") (segid " " and resid "18 " and name "HA ") 6.000 6.000 0.000 peak 8111 weight 0.10000E+01 volume 0.22000E+00 ppm1 7.906 ppm2 3.828 ASSI { 8112} (segid " " and resid "21 " and name "HN ") (segid " " and resid "20 " and name "HA ") 6.000 6.000 0.000 peak 8112 weight 0.10000E+01 volume 0.21300E+00 ppm1 7.900 ppm2 4.536 ASSI { 8113} (segid " " and resid "21 " and name "HN ") (segid " " and resid "20 " and name "HB2 ") 5.000 5.000 0.000 peak 8113 weight 0.10000E+01 volume 0.51300E+00 ppm1 7.900 ppm2 1.997 OR { 8113} (segid " " and resid "21 " and name "HN ") (segid " " and resid "20 " and name "HB1 ") ASSI { 8115} (segid " " and resid "21 " and name "HN ") (segid " " and resid "21 " and name "HA1 ") 3.300 3.300 0.000 peak 8115 weight 0.10000E+01 volume 0.15170E+01 ppm1 7.906 ppm2 4.288 ASSI { 8116} (segid " " and resid "21 " and name "HN ") (segid " " and resid "21 " and name "HA2 ") 3.300 3.300 0.000 peak 8116 weight 0.10000E+01 volume 0.15700E+01 ppm1 7.905 ppm2 3.575 ASSI { 8117} (segid " " and resid "21 " and name "HN ") (segid " " and resid "22 " and name "HN ") 5.000 5.000 0.000 peak 8117 weight 0.10000E+01 volume 0.11370E+01 ppm1 7.903 ppm2 8.161 ASSI { 8121} (segid " " and resid "22 " and name "HN ") (segid " " and resid "22 " and name "HB1 ") 3.300 3.300 0.000 peak 8121 weight 0.10000E+01 volume 0.16010E+01 ppm1 8.153 ppm2 3.068 ASSI { 8122} (segid " " and resid "22 " and name "HN ") (segid " " and resid "22 " and name "HB2 ") 3.300 3.300 0.000 peak 8122 weight 0.10000E+01 volume 0.15970E+01 ppm1 8.153 ppm2 2.437 ASSI { 8126} (segid " " and resid "23 " and name "HN ") (segid " " and resid "22 " and name "HA ") 2.700 2.700 0.000 peak 8126 weight 0.10000E+01 volume 0.32590E+01 ppm1 7.877 ppm2 4.725 ASSI { 8129} (segid " " and resid "23 " and name "HN ") (segid " " and resid "23 " and name "HA ") 5.000 5.000 0.000 peak 8129 weight 0.10000E+01 volume 0.81300E+00 ppm1 7.875 ppm2 3.371 ASSI { 8130} (segid " " and resid "23 " and name "HN ") (segid " " and resid "23 " and name "HB ") 5.000 5.000 0.000 peak 8130 weight 0.10000E+01 volume 0.14920E+01 ppm1 7.874 ppm2 1.959 ASSI { 8131} (segid " " and resid "23 " and name "HN ") (segid " " and resid "24 " and name "HN ") 5.000 5.000 0.000 peak 8131 weight 0.10000E+01 volume 0.99700E+00 ppm1 7.876 ppm2 8.438 ASSI { 8134} (segid " " and resid "24 " and name "HN ") (segid " " and resid "23 " and name "HA ") 5.000 5.000 0.000 peak 8134 weight 0.10000E+01 volume 0.31400E+00 ppm1 8.440 ppm2 3.367 ASSI { 8135} (segid " " and resid "24 " and name "HN ") (segid " " and resid "23 " and name "HB ") 5.000 5.000 0.000 peak 8135 weight 0.10000E+01 volume 0.93800E+00 ppm1 8.444 ppm2 1.960 ASSI { 8136} (segid " " and resid "24 " and name "HN ") (segid " " and resid "23 " and name "HG21") 5.000 5.000 0.000 peak 8136 weight 0.10000E+01 volume 0.12340E+01 ppm1 8.443 ppm2 0.914 OR { 8136} (segid " " and resid "24 " and name "HN ") (segid " " and resid "23 " and name "HG22") OR { 8136} (segid " " and resid "24 " and name "HN ") (segid " " and resid "23 " and name "HG23") ASSI { 8138} (segid " " and resid "24 " and name "HN ") (segid " " and resid "24 " and name "HA ") 5.000 5.000 0.000 peak 8138 weight 0.10000E+01 volume 0.84200E+00 ppm1 8.447 ppm2 4.009 ASSI { 8139} (segid " " and resid "24 " and name "HN ") (segid " " and resid "24 " and name "HB2 ") 2.700 2.700 0.000 peak 8139 weight 0.10000E+01 volume 0.30670E+01 ppm1 8.443 ppm2 2.208 OR { 8139} (segid " " and resid "24 " and name "HN ") (segid " " and resid "24 " and name "HB1 ") ASSI { 8140} (segid " " and resid "24 " and name "HN ") (segid " " and resid "24 " and name "HG2 ") 5.000 5.000 0.000 peak 8140 weight 0.10000E+01 volume 0.10070E+01 ppm1 8.445 ppm2 2.482 OR { 8140} (segid " " and resid "24 " and name "HN ") (segid " " and resid "24 " and name "HG1 ") ASSI { 8141} (segid " " and resid "24 " and name "HN ") (segid " " and resid "25 " and name "HN ") 5.000 5.000 0.000 peak 8141 weight 0.10000E+01 volume 0.11130E+01 ppm1 8.444 ppm2 7.741 ASSI { 8144} (segid " " and resid "24 " and name "HE22") (segid " " and resid "24 " and name "HE21") 3.300 3.300 0.000 peak 8144 weight 0.10000E+01 volume 0.28250E+01 ppm1 6.874 ppm2 7.603 ASSI { 8153} (segid " " and resid "25 " and name "HN ") (segid " " and resid "24 " and name "HA ") 5.000 5.000 0.000 peak 8153 weight 0.10000E+01 volume 0.30000E+00 ppm1 7.740 ppm2 4.013 ASSI { 8154} (segid " " and resid "25 " and name "HN ") (segid " " and resid "24 " and name "HB1 ") 5.000 5.000 0.000 peak 8154 weight 0.10000E+01 volume 0.13540E+01 ppm1 7.742 ppm2 2.231 ASSI { 8156} (segid " " and resid "25 " and name "HN ") (segid " " and resid "25 " and name "HA ") 5.000 5.000 0.000 peak 8156 weight 0.10000E+01 volume 0.65200E+00 ppm1 7.745 ppm2 4.620 ASSI { 8157} (segid " " and resid "25 " and name "HN ") (segid " " and resid "25 " and name "HB2 ") 5.000 5.000 0.000 peak 8157 weight 0.10000E+01 volume 0.14010E+01 ppm1 7.742 ppm2 1.584 ASSI { 8158} (segid " " and resid "25 " and name "HN ") (segid " " and resid "25 " and name "HG1 ") 5.000 5.000 0.000 peak 8158 weight 0.10000E+01 volume 0.46100E+00 ppm1 7.741 ppm2 2.348 ASSI { 8159} (segid " " and resid "25 " and name "HN ") (segid " " and resid "26 " and name "HN ") 5.000 5.000 0.000 peak 8159 weight 0.10000E+01 volume 0.10730E+01 ppm1 7.745 ppm2 8.136 ASSI { 8162} (segid " " and resid "26 " and name "HN ") (segid " " and resid "26 " and name "HB ") 2.700 2.700 0.000 peak 8162 weight 0.10000E+01 volume 0.32380E+01 ppm1 8.130 ppm2 2.166 ASSI { 8166} (segid " " and resid "28 " and name "HN ") (segid " " and resid "29 " and name "HN ") 5.000 5.000 0.000 peak 8166 weight 0.10000E+01 volume 0.12470E+01 ppm1 8.142 ppm2 8.557 ASSI { 8173} (segid " " and resid "29 " and name "HN ") (segid " " and resid "26 " and name "HA ") 6.000 6.000 0.000 peak 8173 weight 0.10000E+01 volume 0.20700E+00 ppm1 8.568 ppm2 3.386 ASSI { 8174} (segid " " and resid "29 " and name "HN ") (segid " " and resid "28 " and name "HA ") 5.000 5.000 0.000 peak 8174 weight 0.10000E+01 volume 0.50400E+00 ppm1 8.570 ppm2 4.003 ASSI { 8175} (segid " " and resid "29 " and name "HN ") (segid " " and resid "28 " and name "HG1 ") 5.000 5.000 0.000 peak 8175 weight 0.10000E+01 volume 0.82700E+00 ppm1 8.570 ppm2 1.678 ASSI { 8176} (segid " " and resid "29 " and name "HN ") (segid " " and resid "29 " and name "HA ") 5.000 5.000 0.000 peak 8176 weight 0.10000E+01 volume 0.70000E+00 ppm1 8.568 ppm2 3.897 ASSI { 8177} (segid " " and resid "29 " and name "HN ") (segid " " and resid "29 " and name "HB2 ") 5.000 5.000 0.000 peak 8177 weight 0.10000E+01 volume 0.79800E+00 ppm1 8.570 ppm2 1.085 ASSI { 8178} (segid " " and resid "29 " and name "HN ") (segid " " and resid "29 " and name "HD13") 5.000 5.000 0.000 peak 8178 weight 0.10000E+01 volume 0.14480E+01 ppm1 8.568 ppm2 0.757 OR { 8178} (segid " " and resid "29 " and name "HN ") (segid " " and resid "29 " and name "HD11") OR { 8178} (segid " " and resid "29 " and name "HN ") (segid " " and resid "29 " and name "HD12") ASSI { 8179} (segid " " and resid "29 " and name "HN ") (segid " " and resid "29 " and name "HG ") 3.300 3.300 0.000 peak 8179 weight 0.10000E+01 volume 0.22160E+01 ppm1 8.569 ppm2 1.823 ASSI { 8182} (segid " " and resid "30 " and name "HN ") (segid " " and resid "27 " and name "HA ") 6.000 6.000 0.000 peak 8182 weight 0.10000E+01 volume 0.20500E+00 ppm1 8.155 ppm2 3.661 ASSI { 8184} (segid " " and resid "30 " and name "HN ") (segid " " and resid "29 " and name "HA ") 6.000 6.000 0.000 peak 8184 weight 0.10000E+01 volume 0.20200E+00 ppm1 8.149 ppm2 3.900 ASSI { 8185} (segid " " and resid "30 " and name "HN ") (segid " " and resid "29 " and name "HB2 ") 5.000 5.000 0.000 peak 8185 weight 0.10000E+01 volume 0.84400E+00 ppm1 8.150 ppm2 1.066 ASSI { 8186} (segid " " and resid "30 " and name "HN ") (segid " " and resid "29 " and name "HN ") 5.000 5.000 0.000 peak 8186 weight 0.10000E+01 volume 0.40700E+00 ppm1 8.152 ppm2 8.559 ASSI { 8187} (segid " " and resid "30 " and name "HN ") (segid " " and resid "30 " and name "HA ") 5.000 5.000 0.000 peak 8187 weight 0.10000E+01 volume 0.44900E+00 ppm1 8.151 ppm2 4.228 ASSI { 8188} (segid " " and resid "30 " and name "HN ") (segid " " and resid "30 " and name "HB1 ") 5.000 5.000 0.000 peak 8188 weight 0.10000E+01 volume 0.11170E+01 ppm1 8.151 ppm2 1.577 ASSI { 8189} (segid " " and resid "30 " and name "HN ") (segid " " and resid "30 " and name "HD12") 5.000 5.000 0.000 peak 8189 weight 0.10000E+01 volume 0.65100E+00 ppm1 8.152 ppm2 0.665 OR { 8189} (segid " " and resid "30 " and name "HN ") (segid " " and resid "30 " and name "HD13") OR { 8189} (segid " " and resid "30 " and name "HN ") (segid " " and resid "30 " and name "HD11") ASSI { 8190} (segid " " and resid "30 " and name "HN ") (segid " " and resid "30 " and name "HG ") 3.300 3.300 0.000 peak 8190 weight 0.10000E+01 volume 0.22320E+01 ppm1 8.147 ppm2 1.973 ASSI { 8191} (segid " " and resid "30 " and name "HN ") (segid " " and resid "31 " and name "HN ") 5.000 5.000 0.000 peak 8191 weight 0.10000E+01 volume 0.59100E+00 ppm1 8.149 ppm2 8.746 ASSI { 8196} (segid " " and resid "31 " and name "HN ") (segid " " and resid "30 " and name "HA ") 6.000 6.000 0.000 peak 8196 weight 0.10000E+01 volume 0.10100E+00 ppm1 8.748 ppm2 4.232 ASSI { 8197} (segid " " and resid "31 " and name "HN ") (segid " " and resid "30 " and name "HB1 ") 5.000 5.000 0.000 peak 8197 weight 0.10000E+01 volume 0.67300E+00 ppm1 8.750 ppm2 1.577 ASSI { 8198} (segid " " and resid "31 " and name "HN ") (segid " " and resid "30 " and name "HB2 ") 5.000 5.000 0.000 peak 8198 weight 0.10000E+01 volume 0.32800E+00 ppm1 8.743 ppm2 1.004 ASSI { 8199} (segid " " and resid "31 " and name "HN ") (segid " " and resid "30 " and name "HD12") 6.000 6.000 0.000 peak 8199 weight 0.10000E+01 volume 0.14100E+00 ppm1 8.755 ppm2 0.661 OR { 8199} (segid " " and resid "31 " and name "HN ") (segid " " and resid "30 " and name "HD11") OR { 8199} (segid " " and resid "31 " and name "HN ") (segid " " and resid "30 " and name "HD13") ASSI { 8201} (segid " " and resid "31 " and name "HN ") (segid " " and resid "31 " and name "HA ") 5.000 5.000 0.000 peak 8201 weight 0.10000E+01 volume 0.45900E+00 ppm1 8.746 ppm2 4.647 ASSI { 8202} (segid " " and resid "31 " and name "HN ") (segid " " and resid "31 " and name "HB2 ") 5.000 5.000 0.000 peak 8202 weight 0.10000E+01 volume 0.12120E+01 ppm1 8.747 ppm2 3.122 OR { 8202} (segid " " and resid "31 " and name "HN ") (segid " " and resid "31 " and name "HB1 ") ASSI { 8203} (segid " " and resid "31 " and name "HN ") (segid " " and resid "31 " and name "HD2 ") 6.000 6.000 0.000 peak 8203 weight 0.10000E+01 volume 0.20400E+00 ppm1 8.756 ppm2 6.963 ASSI { 8204} (segid " " and resid "31 " and name "HN ") (segid " " and resid "32 " and name "HN ") 5.000 5.000 0.000 peak 8204 weight 0.10000E+01 volume 0.10510E+01 ppm1 8.745 ppm2 8.405 ASSI { 8206} (segid " " and resid "32 " and name "HN ") (segid " " and resid "31 " and name "HA ") 5.000 5.000 0.000 peak 8206 weight 0.10000E+01 volume 0.93600E+00 ppm1 8.406 ppm2 4.648 ASSI { 8208} (segid " " and resid "32 " and name "HN ") (segid " " and resid "33 " and name "HN ") 3.300 3.300 0.000 peak 8208 weight 0.10000E+01 volume 0.16160E+01 ppm1 8.404 ppm2 7.535 ASSI { 8217} (segid " " and resid "33 " and name "HN ") (segid " " and resid "33 " and name "HA ") 5.000 5.000 0.000 peak 8217 weight 0.10000E+01 volume 0.52500E+00 ppm1 7.546 ppm2 4.456 ASSI { 8218} (segid " " and resid "33 " and name "HN ") (segid " " and resid "34 " and name "HN ") 5.000 5.000 0.000 peak 8218 weight 0.10000E+01 volume 0.83900E+00 ppm1 7.542 ppm2 6.815 ASSI { 8224} (segid " " and resid "34 " and name "HN ") (segid " " and resid "33 " and name "HA ") 5.000 5.000 0.000 peak 8224 weight 0.10000E+01 volume 0.30600E+00 ppm1 6.810 ppm2 4.453 ASSI { 8226} (segid " " and resid "34 " and name "HN ") (segid " " and resid "34 " and name "HA ") 3.300 3.300 0.000 peak 8226 weight 0.10000E+01 volume 0.20520E+01 ppm1 6.812 ppm2 4.012 ASSI { 8227} (segid " " and resid "34 " and name "HN ") (segid " " and resid "34 " and name "HD21") 5.000 5.000 0.000 peak 8227 weight 0.10000E+01 volume 0.60000E+00 ppm1 6.817 ppm2 0.837 OR { 8227} (segid " " and resid "34 " and name "HN ") (segid " " and resid "34 " and name "HD23") OR { 8227} (segid " " and resid "34 " and name "HN ") (segid " " and resid "34 " and name "HD22") ASSI { 8228} (segid " " and resid "34 " and name "HN ") (segid " " and resid "34 " and name "HG ") 5.000 5.000 0.000 peak 8228 weight 0.10000E+01 volume 0.32900E+00 ppm1 6.815 ppm2 1.383 ASSI { 8229} (segid " " and resid "34 " and name "HN ") (segid " " and resid "35 " and name "HN ") 5.000 5.000 0.000 peak 8229 weight 0.10000E+01 volume 0.63800E+00 ppm1 6.807 ppm2 7.974 ASSI { 8230} (segid " " and resid "35 " and name "HN ") (segid " " and resid "34 " and name "HA ") 5.000 5.000 0.000 peak 8230 weight 0.10000E+01 volume 0.71700E+00 ppm1 7.965 ppm2 4.010 ASSI { 8232} (segid " " and resid "35 " and name "HN ") (segid " " and resid "35 " and name "HA ") 5.000 5.000 0.000 peak 8232 weight 0.10000E+01 volume 0.65200E+00 ppm1 7.966 ppm2 3.788 ASSI { 8233} (segid " " and resid "35 " and name "HN ") (segid " " and resid "35 " and name "HB ") 3.300 3.300 0.000 peak 8233 weight 0.10000E+01 volume 0.16870E+01 ppm1 7.971 ppm2 1.582 ASSI { 8234} (segid " " and resid "35 " and name "HN ") (segid " " and resid "35 " and name "HG11") 3.300 3.300 0.000 peak 8234 weight 0.10000E+01 volume 0.28070E+01 ppm1 7.971 ppm2 0.954 OR { 8234} (segid " " and resid "35 " and name "HN ") (segid " " and resid "35 " and name "HG23") OR { 8234} (segid " " and resid "35 " and name "HN ") (segid " " and resid "35 " and name "HG12") OR { 8234} (segid " " and resid "35 " and name "HN ") (segid " " and resid "35 " and name "HG22") OR { 8234} (segid " " and resid "35 " and name "HN ") (segid " " and resid "35 " and name "HG13") OR { 8234} (segid " " and resid "35 " and name "HN ") (segid " " and resid "35 " and name "HG21") ASSI { 8238} (segid " " and resid "36 " and name "HN ") (segid " " and resid "35 " and name "HA ") 3.300 3.300 0.000 peak 8238 weight 0.10000E+01 volume -0.26340E+01 ppm1 8.809 ppm2 3.791 ASSI { 8239} (segid " " and resid "36 " and name "HN ") (segid " " and resid "35 " and name "HB ") 6.000 6.000 0.000 peak 8239 weight 0.10000E+01 volume -0.20600E+00 ppm1 8.813 ppm2 1.585 ASSI { 8240} (segid " " and resid "36 " and name "HN ") (segid " " and resid "35 " and name "HG22") 5.000 5.000 0.000 peak 8240 weight 0.10000E+01 volume -0.11560E+01 ppm1 8.809 ppm2 0.936 OR { 8240} (segid " " and resid "36 " and name "HN ") (segid " " and resid "35 " and name "HG21") OR { 8240} (segid " " and resid "36 " and name "HN ") (segid " " and resid "35 " and name "HG23") ASSI { 8241} (segid " " and resid "36 " and name "HN ") (segid " " and resid "36 " and name "HA ") 5.000 5.000 0.000 peak 8241 weight 0.10000E+01 volume -0.52000E+00 ppm1 8.809 ppm2 4.378 ASSI { 8242} (segid " " and resid "36 " and name "HN ") (segid " " and resid "36 " and name "HB1 ") 5.000 5.000 0.000 peak 8242 weight 0.10000E+01 volume -0.12420E+01 ppm1 8.809 ppm2 3.204 ASSI { 8243} (segid " " and resid "36 " and name "HN ") (segid " " and resid "36 " and name "HB2 ") 5.000 5.000 0.000 peak 8243 weight 0.10000E+01 volume -0.12230E+01 ppm1 8.809 ppm2 2.884 ASSI { 8247} (segid " " and resid "38 " and name "HN ") (segid " " and resid "37 " and name "HG2 ") 5.000 5.000 0.000 peak 8247 weight 0.10000E+01 volume 0.53200E+00 ppm1 10.208 ppm2 1.379 ASSI { 8248} (segid " " and resid "38 " and name "HN ") (segid " " and resid "38 " and name "HA ") 5.000 5.000 0.000 peak 8248 weight 0.10000E+01 volume 0.32200E+00 ppm1 10.214 ppm2 5.146 ASSI { 8249} (segid " " and resid "38 " and name "HN ") (segid " " and resid "38 " and name "HB1 ") 5.000 5.000 0.000 peak 8249 weight 0.10000E+01 volume 0.81200E+00 ppm1 10.205 ppm2 3.208 ASSI { 8250} (segid " " and resid "38 " and name "HN ") (segid " " and resid "38 " and name "HB2 ") 5.000 5.000 0.000 peak 8250 weight 0.10000E+01 volume 0.10600E+01 ppm1 10.208 ppm2 2.590 ASSI { 8251} (segid " " and resid "38 " and name "HN ") (segid " " and resid "39 " and name "HN ") 5.000 5.000 0.000 peak 8251 weight 0.10000E+01 volume 0.13430E+01 ppm1 10.206 ppm2 7.864 ASSI { 8257} (segid " " and resid "39 " and name "HN ") (segid " " and resid "38 " and name "HA ") 5.000 5.000 0.000 peak 8257 weight 0.10000E+01 volume 0.61100E+00 ppm1 7.863 ppm2 5.148 ASSI { 8258} (segid " " and resid "39 " and name "HN ") (segid " " and resid "38 " and name "HB1 ") 6.000 6.000 0.000 peak 8258 weight 0.10000E+01 volume 0.21300E+00 ppm1 7.859 ppm2 3.212 ASSI { 8259} (segid " " and resid "39 " and name "HN ") (segid " " and resid "38 " and name "HB2 ") 6.000 6.000 0.000 peak 8259 weight 0.10000E+01 volume 0.20000E+00 ppm1 7.859 ppm2 2.593 ASSI { 8261} (segid " " and resid "39 " and name "HN ") (segid " " and resid "39 " and name "HA ") 3.300 3.300 0.000 peak 8261 weight 0.10000E+01 volume 0.18270E+01 ppm1 7.859 ppm2 4.054 ASSI { 8262} (segid " " and resid "39 " and name "HN ") (segid " " and resid "39 " and name "HB3 ") 2.700 2.700 0.000 peak 8262 weight 0.10000E+01 volume 0.64140E+01 ppm1 7.856 ppm2 1.387 OR { 8262} (segid " " and resid "39 " and name "HN ") (segid " " and resid "39 " and name "HB1 ") OR { 8262} (segid " " and resid "39 " and name "HN ") (segid " " and resid "39 " and name "HB2 ") ASSI { 8264} (segid " " and resid "40 " and name "HN ") (segid " " and resid "39 " and name "HA ") 2.700 2.700 0.000 peak 8264 weight 0.10000E+01 volume 0.32280E+01 ppm1 8.300 ppm2 4.049 ASSI { 8265} (segid " " and resid "40 " and name "HN ") (segid " " and resid "39 " and name "HB2 ") 5.000 5.000 0.000 peak 8265 weight 0.10000E+01 volume 0.10420E+01 ppm1 8.297 ppm2 1.389 OR { 8265} (segid " " and resid "40 " and name "HN ") (segid " " and resid "39 " and name "HB1 ") OR { 8265} (segid " " and resid "40 " and name "HN ") (segid " " and resid "39 " and name "HB3 ") ASSI { 8267} (segid " " and resid "40 " and name "HN ") (segid " " and resid "40 " and name "HA ") 5.000 5.000 0.000 peak 8267 weight 0.10000E+01 volume 0.10070E+01 ppm1 8.305 ppm2 4.317 ASSI { 8268} (segid " " and resid "40 " and name "HN ") (segid " " and resid "40 " and name "HB2 ") 5.000 5.000 0.000 peak 8268 weight 0.10000E+01 volume 0.71600E+00 ppm1 8.306 ppm2 1.266 ASSI { 8269} (segid " " and resid "40 " and name "HN ") (segid " " and resid "40 " and name "HD11") 5.000 5.000 0.000 peak 8269 weight 0.10000E+01 volume 0.37800E+00 ppm1 8.307 ppm2 0.908 OR { 8269} (segid " " and resid "40 " and name "HN ") (segid " " and resid "40 " and name "HD13") OR { 8269} (segid " " and resid "40 " and name "HN ") (segid " " and resid "40 " and name "HD12") ASSI { 8270} (segid " " and resid "40 " and name "HN ") (segid " " and resid "40 " and name "HD23") 5.000 5.000 0.000 peak 8270 weight 0.10000E+01 volume 0.50900E+00 ppm1 8.305 ppm2 0.669 OR { 8270} (segid " " and resid "40 " and name "HN ") (segid " " and resid "40 " and name "HD22") OR { 8270} (segid " " and resid "40 " and name "HN ") (segid " " and resid "40 " and name "HD21") ASSI { 8271} (segid " " and resid "40 " and name "HN ") (segid " " and resid "41 " and name "HN ") 6.000 6.000 0.000 peak 8271 weight 0.10000E+01 volume 0.27600E+00 ppm1 8.305 ppm2 8.834 ASSI { 8273} (segid " " and resid "41 " and name "HN ") (segid " " and resid "40 " and name "HA ") 3.300 3.300 0.000 peak 8273 weight 0.10000E+01 volume 0.21190E+01 ppm1 8.847 ppm2 4.315 ASSI { 8274} (segid " " and resid "41 " and name "HN ") (segid " " and resid "40 " and name "HB1 ") 5.000 5.000 0.000 peak 8274 weight 0.10000E+01 volume 0.35000E+00 ppm1 8.854 ppm2 1.790 ASSI { 8275} (segid " " and resid "41 " and name "HN ") (segid " " and resid "40 " and name "HB2 ") 5.000 5.000 0.000 peak 8275 weight 0.10000E+01 volume 0.47700E+00 ppm1 8.851 ppm2 1.269 ASSI { 8276} (segid " " and resid "41 " and name "HN ") (segid " " and resid "40 " and name "HD22") 5.000 5.000 0.000 peak 8276 weight 0.10000E+01 volume 0.41900E+00 ppm1 8.847 ppm2 0.671 OR { 8276} (segid " " and resid "41 " and name "HN ") (segid " " and resid "40 " and name "HD23") OR { 8276} (segid " " and resid "41 " and name "HN ") (segid " " and resid "40 " and name "HD21") ASSI { 8277} (segid " " and resid "41 " and name "HN ") (segid " " and resid "41 " and name "HA ") 5.000 5.000 0.000 peak 8277 weight 0.10000E+01 volume 0.50300E+00 ppm1 8.849 ppm2 4.486 ASSI { 8278} (segid " " and resid "41 " and name "HN ") (segid " " and resid "41 " and name "HB1 ") 6.000 6.000 0.000 peak 8278 weight 0.10000E+01 volume 0.23500E+00 ppm1 8.863 ppm2 3.909 ASSI { 8279} (segid " " and resid "41 " and name "HN ") (segid " " and resid "41 " and name "HB2 ") 6.000 6.000 0.000 peak 8279 weight 0.10000E+01 volume 0.29800E+00 ppm1 8.849 ppm2 2.812 ASSI { 8280} (segid " " and resid "41 " and name "HN ") (segid " " and resid "45 " and name "HN ") 5.000 5.000 0.000 peak 8280 weight 0.10000E+01 volume 0.31600E+00 ppm1 8.850 ppm2 7.449 ASSI { 8284} (segid " " and resid "42 " and name "HN ") (segid " " and resid "41 " and name "HB1 ") 5.000 5.000 0.000 peak 8284 weight 0.10000E+01 volume 0.78700E+00 ppm1 9.846 ppm2 3.893 ASSI { 8285} (segid " " and resid "42 " and name "HN ") (segid " " and resid "41 " and name "HB2 ") 5.000 5.000 0.000 peak 8285 weight 0.10000E+01 volume 0.51300E+00 ppm1 9.847 ppm2 2.825 ASSI { 8286} (segid " " and resid "42 " and name "HN ") (segid " " and resid "42 " and name "HA ") 5.000 5.000 0.000 peak 8286 weight 0.10000E+01 volume 0.44900E+00 ppm1 9.850 ppm2 4.166 ASSI { 8287} (segid " " and resid "42 " and name "HN ") (segid " " and resid "42 " and name "HB1 ") 5.000 5.000 0.000 peak 8287 weight 0.10000E+01 volume 0.56300E+00 ppm1 9.851 ppm2 1.897 ASSI { 8288} (segid " " and resid "42 " and name "HN ") (segid " " and resid "42 " and name "HB2 ") 5.000 5.000 0.000 peak 8288 weight 0.10000E+01 volume 0.56100E+00 ppm1 9.847 ppm2 1.770 ASSI { 8289} (segid " " and resid "42 " and name "HN ") (segid " " and resid "42 " and name "HD2 ") 6.000 6.000 0.000 peak 8289 weight 0.10000E+01 volume 0.18500E+00 ppm1 9.850 ppm2 2.951 OR { 8289} (segid " " and resid "42 " and name "HN ") (segid " " and resid "42 " and name "HD1 ") ASSI { 8290} (segid " " and resid "42 " and name "HN ") (segid " " and resid "42 " and name "HG1 ") 5.000 5.000 0.000 peak 8290 weight 0.10000E+01 volume 0.48500E+00 ppm1 9.847 ppm2 1.255 ASSI { 8291} (segid " " and resid "42 " and name "HN ") (segid " " and resid "42 " and name "HG2 ") 6.000 6.000 0.000 peak 8291 weight 0.10000E+01 volume 0.22700E+00 ppm1 9.852 ppm2 0.265 ASSI { 8292} (segid " " and resid "42 " and name "HN ") (segid " " and resid "43 " and name "HN ") 5.000 5.000 0.000 peak 8292 weight 0.10000E+01 volume 0.41100E+00 ppm1 9.845 ppm2 7.934 ASSI { 8293} (segid " " and resid "43 " and name "HN ") (segid " " and resid "42 " and name "HG2 ") 6.000 6.000 0.000 peak 8293 weight 0.10000E+01 volume 0.17700E+00 ppm1 7.927 ppm2 0.277 ASSI { 8294} (segid " " and resid "43 " and name "HN ") (segid " " and resid "43 " and name "HA ") 5.000 5.000 0.000 peak 8294 weight 0.10000E+01 volume 0.70000E+00 ppm1 7.936 ppm2 4.855 ASSI { 8295} (segid " " and resid "43 " and name "HN ") (segid " " and resid "43 " and name "HB1 ") 5.000 5.000 0.000 peak 8295 weight 0.10000E+01 volume 0.60400E+00 ppm1 7.929 ppm2 3.553 ASSI { 8296} (segid " " and resid "43 " and name "HN ") (segid " " and resid "43 " and name "HB2 ") 3.300 3.300 0.000 peak 8296 weight 0.10000E+01 volume 0.18480E+01 ppm1 7.927 ppm2 2.797 ASSI { 8297} (segid " " and resid "43 " and name "HN ") (segid " " and resid "43 " and name "HD2 ") 5.000 5.000 0.000 peak 8297 weight 0.10000E+01 volume 0.57600E+00 ppm1 7.925 ppm2 7.228 OR { 8297} (segid " " and resid "43 " and name "HN ") (segid " " and resid "43 " and name "HD1 ") ASSI { 8298} (segid " " and resid "43 " and name "HN ") (segid " " and resid "44 " and name "HN ") 3.300 3.300 0.000 peak 8298 weight 0.10000E+01 volume 0.16240E+01 ppm1 7.925 ppm2 8.491 ASSI { 8304} (segid " " and resid "44 " and name "HN ") (segid " " and resid "43 " and name "HB1 ") 6.000 6.000 0.000 peak 8304 weight 0.10000E+01 volume 0.16600E+00 ppm1 8.494 ppm2 3.550 ASSI { 8305} (segid " " and resid "44 " and name "HN ") (segid " " and resid "43 " and name "HB2 ") 6.000 6.000 0.000 peak 8305 weight 0.10000E+01 volume 0.11400E+00 ppm1 8.496 ppm2 2.815 ASSI { 8307} (segid " " and resid "44 " and name "HN ") (segid " " and resid "44 " and name "HA1 ") 5.000 5.000 0.000 peak 8307 weight 0.10000E+01 volume 0.13400E+01 ppm1 8.492 ppm2 4.211 ASSI { 8308} (segid " " and resid "44 " and name "HN ") (segid " " and resid "44 " and name "HA2 ") 5.000 5.000 0.000 peak 8308 weight 0.10000E+01 volume 0.14090E+01 ppm1 8.492 ppm2 3.716 ASSI { 8313} (segid " " and resid "45 " and name "HN ") (segid " " and resid "43 " and name "HN ") 5.000 5.000 0.000 peak 8313 weight 0.10000E+01 volume 0.38400E+00 ppm1 7.458 ppm2 7.932 ASSI { 8314} (segid " " and resid "45 " and name "HN ") (segid " " and resid "44 " and name "HA1 ") 5.000 5.000 0.000 peak 8314 weight 0.10000E+01 volume 0.49400E+00 ppm1 7.453 ppm2 4.211 ASSI { 8315} (segid " " and resid "45 " and name "HN ") (segid " " and resid "44 " and name "HA2 ") 5.000 5.000 0.000 peak 8315 weight 0.10000E+01 volume 0.50700E+00 ppm1 7.462 ppm2 3.716 ASSI { 8316} (segid " " and resid "45 " and name "HN ") (segid " " and resid "44 " and name "HN ") 3.300 3.300 0.000 peak 8316 weight 0.10000E+01 volume 0.16980E+01 ppm1 7.452 ppm2 8.489 ASSI { 8317} (segid " " and resid "45 " and name "HN ") (segid " " and resid "45 " and name "HA ") 5.000 5.000 0.000 peak 8317 weight 0.10000E+01 volume 0.50200E+00 ppm1 7.458 ppm2 4.858 ASSI { 8318} (segid " " and resid "45 " and name "HN ") (segid " " and resid "45 " and name "HB1 ") 5.000 5.000 0.000 peak 8318 weight 0.10000E+01 volume 0.53300E+00 ppm1 7.457 ppm2 1.880 ASSI { 8319} (segid " " and resid "45 " and name "HN ") (segid " " and resid "45 " and name "HB2 ") 5.000 5.000 0.000 peak 8319 weight 0.10000E+01 volume 0.95500E+00 ppm1 7.456 ppm2 1.544 ASSI { 8320} (segid " " and resid "45 " and name "HN ") (segid " " and resid "45 " and name "HG1 ") 5.000 5.000 0.000 peak 8320 weight 0.10000E+01 volume 0.68800E+00 ppm1 7.464 ppm2 1.393 ASSI { 8327} (segid " " and resid "46 " and name "HN ") (segid " " and resid "45 " and name "HA ") 3.300 3.300 0.000 peak 8327 weight 0.10000E+01 volume 0.15750E+01 ppm1 9.207 ppm2 4.857 ASSI { 8328} (segid " " and resid "46 " and name "HN ") (segid " " and resid "45 " and name "HG2 ") 6.000 6.000 0.000 peak 8328 weight 0.10000E+01 volume 0.22900E+00 ppm1 9.200 ppm2 1.347 ASSI { 8329} (segid " " and resid "46 " and name "HN ") (segid " " and resid "46 " and name "HG22") 5.000 5.000 0.000 peak 8329 weight 0.10000E+01 volume 0.89100E+00 ppm1 9.210 ppm2 1.202 OR { 8329} (segid " " and resid "46 " and name "HN ") (segid " " and resid "46 " and name "HG21") OR { 8329} (segid " " and resid "46 " and name "HN ") (segid " " and resid "46 " and name "HG23") ASSI { 8332} (segid " " and resid "47 " and name "HN ") (segid " " and resid "46 " and name "HB ") 5.000 5.000 0.000 peak 8332 weight 0.10000E+01 volume 0.69400E+00 ppm1 10.260 ppm2 4.915 ASSI { 8333} (segid " " and resid "47 " and name "HN ") (segid " " and resid "47 " and name "HB2 ") 5.000 5.000 0.000 peak 8333 weight 0.10000E+01 volume 0.10980E+01 ppm1 10.255 ppm2 1.227 OR { 8333} (segid " " and resid "47 " and name "HN ") (segid " " and resid "47 " and name "HB1 ") OR { 8333} (segid " " and resid "47 " and name "HN ") (segid " " and resid "47 " and name "HB3 ") ASSI { 8336} (segid " " and resid "48 " and name "HN ") (segid " " and resid "47 " and name "HB3 ") 3.300 3.300 0.000 peak 8336 weight 0.10000E+01 volume 0.16730E+01 ppm1 8.373 ppm2 1.233 OR { 8336} (segid " " and resid "48 " and name "HN ") (segid " " and resid "47 " and name "HB2 ") OR { 8336} (segid " " and resid "48 " and name "HN ") (segid " " and resid "47 " and name "HB1 ") ASSI { 8338} (segid " " and resid "48 " and name "HN ") (segid " " and resid "48 " and name "HA ") 5.000 5.000 0.000 peak 8338 weight 0.10000E+01 volume 0.80100E+00 ppm1 8.377 ppm2 3.766 ASSI { 8339} (segid " " and resid "48 " and name "HN ") (segid " " and resid "48 " and name "HB1 ") 3.300 3.300 0.000 peak 8339 weight 0.10000E+01 volume 0.29570E+01 ppm1 8.379 ppm2 1.557 ASSI { 8340} (segid " " and resid "48 " and name "HN ") (segid " " and resid "48 " and name "HB2 ") 3.300 3.300 0.000 peak 8340 weight 0.10000E+01 volume 0.17070E+01 ppm1 8.373 ppm2 1.405 ASSI { 8341} (segid " " and resid "48 " and name "HN ") (segid " " and resid "49 " and name "HN ") 5.000 5.000 0.000 peak 8341 weight 0.10000E+01 volume 0.39600E+00 ppm1 8.372 ppm2 7.384 ASSI { 8347} (segid " " and resid "49 " and name "HN ") (segid " " and resid "48 " and name "HB2 ") 5.000 5.000 0.000 peak 8347 weight 0.10000E+01 volume 0.36500E+00 ppm1 7.384 ppm2 1.405 ASSI { 8349} (segid " " and resid "49 " and name "HN ") (segid " " and resid "49 " and name "HA ") 5.000 5.000 0.000 peak 8349 weight 0.10000E+01 volume 0.54300E+00 ppm1 7.377 ppm2 4.188 ASSI { 8350} (segid " " and resid "49 " and name "HN ") (segid " " and resid "49 " and name "HB1 ") 5.000 5.000 0.000 peak 8350 weight 0.10000E+01 volume 0.64500E+00 ppm1 7.382 ppm2 2.615 ASSI { 8351} (segid " " and resid "49 " and name "HN ") (segid " " and resid "49 " and name "HB2 ") 5.000 5.000 0.000 peak 8351 weight 0.10000E+01 volume 0.82300E+00 ppm1 7.383 ppm2 2.143 ASSI { 8352} (segid " " and resid "49 " and name "HN ") (segid " " and resid "49 " and name "HG1 ") 5.000 5.000 0.000 peak 8352 weight 0.10000E+01 volume 0.78200E+00 ppm1 7.380 ppm2 2.704 ASSI { 8353} (segid " " and resid "49 " and name "HN ") (segid " " and resid "49 " and name "HG2 ") 5.000 5.000 0.000 peak 8353 weight 0.10000E+01 volume 0.64400E+00 ppm1 7.382 ppm2 2.222 ASSI { 8354} (segid " " and resid "49 " and name "HN ") (segid " " and resid "50 " and name "HN ") 5.000 5.000 0.000 peak 8354 weight 0.10000E+01 volume 0.87700E+00 ppm1 7.384 ppm2 7.183 ASSI { 8359} (segid " " and resid "50 " and name "HN ") (segid " " and resid "50 " and name "HA ") 5.000 5.000 0.000 peak 8359 weight 0.10000E+01 volume 0.33500E+00 ppm1 7.190 ppm2 4.642 ASSI { 8360} (segid " " and resid "50 " and name "HN ") (segid " " and resid "50 " and name "HB ") 6.000 6.000 0.000 peak 8360 weight 0.10000E+01 volume 0.28100E+00 ppm1 7.187 ppm2 2.508 ASSI { 8361} (segid " " and resid "50 " and name "HN ") (segid " " and resid "50 " and name "HG22") 3.300 3.300 0.000 peak 8361 weight 0.10000E+01 volume 0.26260E+01 ppm1 7.191 ppm2 0.898 OR { 8361} (segid " " and resid "50 " and name "HN ") (segid " " and resid "50 " and name "HG21") OR { 8361} (segid " " and resid "50 " and name "HN ") (segid " " and resid "50 " and name "HG23") ASSI { 8365} (segid " " and resid "51 " and name "HN ") (segid " " and resid "50 " and name "HA ") 6.000 6.000 0.000 peak 8365 weight 0.10000E+01 volume 0.24300E+00 ppm1 6.858 ppm2 4.644 ASSI { 8366} (segid " " and resid "51 " and name "HN ") (segid " " and resid "50 " and name "HG22") 5.000 5.000 0.000 peak 8366 weight 0.10000E+01 volume 0.76100E+00 ppm1 6.849 ppm2 0.904 OR { 8366} (segid " " and resid "51 " and name "HN ") (segid " " and resid "50 " and name "HG21") OR { 8366} (segid " " and resid "51 " and name "HN ") (segid " " and resid "50 " and name "HG23") ASSI { 8367} (segid " " and resid "51 " and name "HN ") (segid " " and resid "50 " and name "HN ") 3.300 3.300 0.000 peak 8367 weight 0.10000E+01 volume 0.18150E+01 ppm1 6.851 ppm2 7.183 ASSI { 8368} (segid " " and resid "51 " and name "HN ") (segid " " and resid "51 " and name "HA ") 5.000 5.000 0.000 peak 8368 weight 0.10000E+01 volume 0.47700E+00 ppm1 6.852 ppm2 3.446 ASSI { 8369} (segid " " and resid "51 " and name "HN ") (segid " " and resid "51 " and name "HB1 ") 5.000 5.000 0.000 peak 8369 weight 0.10000E+01 volume 0.87800E+00 ppm1 6.848 ppm2 1.947 ASSI { 8370} (segid " " and resid "51 " and name "HN ") (segid " " and resid "51 " and name "HB2 ") 5.000 5.000 0.000 peak 8370 weight 0.10000E+01 volume 0.43500E+00 ppm1 6.847 ppm2 1.440 ASSI { 8371} (segid " " and resid "51 " and name "HN ") (segid " " and resid "51 " and name "HG1 ") 5.000 5.000 0.000 peak 8371 weight 0.10000E+01 volume 0.12480E+01 ppm1 6.851 ppm2 2.324 ASSI { 8372} (segid " " and resid "51 " and name "HN ") (segid " " and resid "51 " and name "HG2 ") 5.000 5.000 0.000 peak 8372 weight 0.10000E+01 volume 0.64600E+00 ppm1 6.839 ppm2 1.179 ASSI { 8377} (segid " " and resid "52 " and name "HN ") (segid " " and resid "51 " and name "HA ") 5.000 5.000 0.000 peak 8377 weight 0.10000E+01 volume 0.13160E+01 ppm1 7.133 ppm2 3.442 ASSI { 8378} (segid " " and resid "52 " and name "HN ") (segid " " and resid "51 " and name "HB2 ") 5.000 5.000 0.000 peak 8378 weight 0.10000E+01 volume 0.49700E+00 ppm1 7.128 ppm2 1.442 ASSI { 8379} (segid " " and resid "52 " and name "HN ") (segid " " and resid "52 " and name "HA ") 3.300 3.300 0.000 peak 8379 weight 0.10000E+01 volume 0.16540E+01 ppm1 7.131 ppm2 4.277 ASSI { 8380} (segid " " and resid "52 " and name "HN ") (segid " " and resid "52 " and name "HB2 ") 5.000 5.000 0.000 peak 8380 weight 0.10000E+01 volume 0.87100E+00 ppm1 7.125 ppm2 1.844 ASSI { 8383} (segid " " and resid "53 " and name "HN ") (segid " " and resid "52 " and name "HA ") 3.300 3.300 0.000 peak 8383 weight 0.10000E+01 volume -0.22690E+01 ppm1 8.288 ppm2 4.245 ASSI { 8384} (segid " " and resid "53 " and name "HN ") (segid " " and resid "52 " and name "HG1 ") 6.000 6.000 0.000 peak 8384 weight 0.10000E+01 volume -0.21700E+00 ppm1 8.294 ppm2 2.562 ASSI { 8385} (segid " " and resid "53 " and name "HN ") (segid " " and resid "53 " and name "HA ") 5.000 5.000 0.000 peak 8385 weight 0.10000E+01 volume -0.44500E+00 ppm1 8.288 ppm2 3.915 ASSI { 8386} (segid " " and resid "53 " and name "HN ") (segid " " and resid "53 " and name "HB1 ") 5.000 5.000 0.000 peak 8386 weight 0.10000E+01 volume -0.56700E+00 ppm1 8.291 ppm2 2.837 ASSI { 8387} (segid " " and resid "53 " and name "HN ") (segid " " and resid "53 " and name "HB2 ") 5.000 5.000 0.000 peak 8387 weight 0.10000E+01 volume -0.10030E+01 ppm1 8.294 ppm2 2.717 ASSI { 8388} (segid " " and resid "53 " and name "HN ") (segid " " and resid "53 " and name "HD1 ") 5.000 5.000 0.000 peak 8388 weight 0.10000E+01 volume -0.47700E+00 ppm1 8.290 ppm2 7.193 OR { 8388} (segid " " and resid "53 " and name "HN ") (segid " " and resid "53 " and name "HD2 ") ASSI { 8389} (segid " " and resid "53 " and name "HN ") (segid " " and resid "53 " and name "HZ ") 6.000 6.000 0.000 peak 8389 weight 0.10000E+01 volume -0.96000E-01 ppm1 8.287 ppm2 7.446 ASSI { 8391} (segid " " and resid "54 " and name "HN ") (segid " " and resid "54 " and name "HA1 ") 5.000 5.000 0.000 peak 8391 weight 0.10000E+01 volume -0.64300E+00 ppm1 7.877 ppm2 3.198 ASSI { 8392} (segid " " and resid "54 " and name "HN ") (segid " " and resid "54 " and name "HA2 ") 5.000 5.000 0.000 peak 8392 weight 0.10000E+01 volume -0.60900E+00 ppm1 7.877 ppm2 3.143 ASSI { 8397} (segid " " and resid "55 " and name "HN ") (segid " " and resid "54 " and name "HA2 ") 5.000 5.000 0.000 peak 8397 weight 0.10000E+01 volume 0.52300E+00 ppm1 7.499 ppm2 3.158 ASSI { 8398} (segid " " and resid "55 " and name "HN ") (segid " " and resid "54 " and name "HN ") 6.000 6.000 0.000 peak 8398 weight 0.10000E+01 volume 0.28300E+00 ppm1 7.503 ppm2 7.890 ASSI { 8399} (segid " " and resid "55 " and name "HN ") (segid " " and resid "55 " and name "HA ") 5.000 5.000 0.000 peak 8399 weight 0.10000E+01 volume 0.32000E+00 ppm1 7.495 ppm2 5.065 ASSI { 8400} (segid " " and resid "55 " and name "HN ") (segid " " and resid "55 " and name "HB1 ") 3.300 3.300 0.000 peak 8400 weight 0.10000E+01 volume 0.16110E+01 ppm1 7.490 ppm2 3.982 ASSI { 8401} (segid " " and resid "55 " and name "HN ") (segid " " and resid "55 " and name "HB2 ") 5.000 5.000 0.000 peak 8401 weight 0.10000E+01 volume 0.13840E+01 ppm1 7.487 ppm2 3.703 ASSI { 8407} (segid " " and resid "57 " and name "HN ") (segid " " and resid "56 " and name "HB2 ") 5.000 5.000 0.000 peak 8407 weight 0.10000E+01 volume 0.91000E+00 ppm1 8.043 ppm2 1.973 OR { 8407} (segid " " and resid "57 " and name "HN ") (segid " " and resid "56 " and name "HB1 ") ASSI { 8408} (segid " " and resid "57 " and name "HN ") (segid " " and resid "56 " and name "HD2 ") 6.000 6.000 0.000 peak 8408 weight 0.10000E+01 volume 0.16600E+00 ppm1 8.043 ppm2 3.372 ASSI { 8409} (segid " " and resid "57 " and name "HN ") (segid " " and resid "56 " and name "HG2 ") 5.000 5.000 0.000 peak 8409 weight 0.10000E+01 volume 0.10740E+01 ppm1 8.046 ppm2 2.048 OR { 8409} (segid " " and resid "57 " and name "HN ") (segid " " and resid "56 " and name "HG1 ") ASSI { 8410} (segid " " and resid "57 " and name "HN ") (segid " " and resid "57 " and name "HA ") 5.000 5.000 0.000 peak 8410 weight 0.10000E+01 volume 0.82000E+00 ppm1 8.043 ppm2 4.104 ASSI { 8411} (segid " " and resid "57 " and name "HN ") (segid " " and resid "57 " and name "HB3 ") 3.300 3.300 0.000 peak 8411 weight 0.10000E+01 volume 0.25350E+01 ppm1 8.043 ppm2 1.442 OR { 8411} (segid " " and resid "57 " and name "HN ") (segid " " and resid "57 " and name "HB2 ") OR { 8411} (segid " " and resid "57 " and name "HN ") (segid " " and resid "57 " and name "HB1 ") ASSI { 8412} (segid " " and resid "57 " and name "HN ") (segid " " and resid "58 " and name "HN ") 5.000 5.000 0.000 peak 8412 weight 0.10000E+01 volume 0.59100E+00 ppm1 8.046 ppm2 7.799 ASSI { 8415} (segid " " and resid "58 " and name "HN ") (segid " " and resid "58 " and name "HA ") 5.000 5.000 0.000 peak 8415 weight 0.10000E+01 volume 0.77800E+00 ppm1 7.805 ppm2 3.414 ASSI { 8416} (segid " " and resid "58 " and name "HN ") (segid " " and resid "58 " and name "HB ") 3.300 3.300 0.000 peak 8416 weight 0.10000E+01 volume 0.21180E+01 ppm1 7.805 ppm2 2.322 ASSI { 8418} (segid " " and resid "58 " and name "HN ") (segid " " and resid "58 " and name "HG12") 3.300 3.300 0.000 peak 8418 weight 0.10000E+01 volume 0.26240E+01 ppm1 7.807 ppm2 0.918 OR { 8418} (segid " " and resid "58 " and name "HN ") (segid " " and resid "58 " and name "HG11") OR { 8418} (segid " " and resid "58 " and name "HN ") (segid " " and resid "58 " and name "HG13") ASSI { 8417} (segid " " and resid "58 " and name "HN ") (segid " " and resid "58 " and name "HG22") 2.700 2.700 0.000 peak 8417 weight 0.10000E+01 volume 0.31030E+01 ppm1 7.805 ppm2 0.982 OR { 8417} (segid " " and resid "58 " and name "HN ") (segid " " and resid "58 " and name "HG21") OR { 8417} (segid " " and resid "58 " and name "HN ") (segid " " and resid "58 " and name "HG23") ASSI { 8419} (segid " " and resid "58 " and name "HN ") (segid " " and resid "59 " and name "HN ") 5.000 5.000 0.000 peak 8419 weight 0.10000E+01 volume 0.12830E+01 ppm1 7.799 ppm2 7.069 ASSI { 8425} (segid " " and resid "59 " and name "HN ") (segid " " and resid "56 " and name "HA ") 5.000 5.000 0.000 peak 8425 weight 0.10000E+01 volume 0.40700E+00 ppm1 7.072 ppm2 4.316 ASSI { 8426} (segid " " and resid "59 " and name "HN ") (segid " " and resid "58 " and name "HA ") 5.000 5.000 0.000 peak 8426 weight 0.10000E+01 volume 0.40700E+00 ppm1 7.073 ppm2 3.417 ASSI { 8427} (segid " " and resid "59 " and name "HN ") (segid " " and resid "58 " and name "HB ") 5.000 5.000 0.000 peak 8427 weight 0.10000E+01 volume 0.99100E+00 ppm1 7.064 ppm2 2.318 ASSI { 8429} (segid " " and resid "59 " and name "HN ") (segid " " and resid "59 " and name "HA ") 5.000 5.000 0.000 peak 8429 weight 0.10000E+01 volume 0.67900E+00 ppm1 7.068 ppm2 3.733 ASSI { 8430} (segid " " and resid "59 " and name "HN ") (segid " " and resid "59 " and name "HB2 ") 3.300 3.300 0.000 peak 8430 weight 0.10000E+01 volume 0.24210E+01 ppm1 7.066 ppm2 1.312 OR { 8430} (segid " " and resid "59 " and name "HN ") (segid " " and resid "59 " and name "HB1 ") OR { 8430} (segid " " and resid "59 " and name "HN ") (segid " " and resid "59 " and name "HB3 ") ASSI { 8431} (segid " " and resid "59 " and name "HN ") (segid " " and resid "60 " and name "HN ") 5.000 5.000 0.000 peak 8431 weight 0.10000E+01 volume 0.72500E+00 ppm1 7.071 ppm2 8.383 ASSI { 8432} (segid " " and resid "60 " and name "HN ") (segid " " and resid "57 " and name "HA ") 5.000 5.000 0.000 peak 8432 weight 0.10000E+01 volume 0.44300E+00 ppm1 8.388 ppm2 4.098 ASSI { 8433} (segid " " and resid "60 " and name "HN ") (segid " " and resid "59 " and name "HA ") 5.000 5.000 0.000 peak 8433 weight 0.10000E+01 volume 0.10880E+01 ppm1 8.390 ppm2 3.726 ASSI { 8434} (segid " " and resid "60 " and name "HN ") (segid " " and resid "59 " and name "HB1 ") 3.300 3.300 0.000 peak 8434 weight 0.10000E+01 volume 0.20490E+01 ppm1 8.390 ppm2 1.313 OR { 8434} (segid " " and resid "60 " and name "HN ") (segid " " and resid "59 " and name "HB2 ") OR { 8434} (segid " " and resid "60 " and name "HN ") (segid " " and resid "59 " and name "HB3 ") ASSI { 8437} (segid " " and resid "60 " and name "HN ") (segid " " and resid "60 " and name "HA ") 5.000 5.000 0.000 peak 8437 weight 0.10000E+01 volume 0.11740E+01 ppm1 8.394 ppm2 3.628 ASSI { 8438} (segid " " and resid "60 " and name "HN ") (segid " " and resid "60 " and name "HB1 ") 2.700 2.700 0.000 peak 8438 weight 0.10000E+01 volume 0.32850E+01 ppm1 8.390 ppm2 1.786 ASSI { 8439} (segid " " and resid "60 " and name "HN ") (segid " " and resid "60 " and name "HB2 ") 2.700 2.700 0.000 peak 8439 weight 0.10000E+01 volume 0.30960E+01 ppm1 8.390 ppm2 1.600 ASSI { 8440} (segid " " and resid "60 " and name "HN ") (segid " " and resid "61 " and name "HN ") 5.000 5.000 0.000 peak 8440 weight 0.10000E+01 volume 0.82200E+00 ppm1 8.390 ppm2 7.636 ASSI { 8442} (segid " " and resid "61 " and name "HN ") (segid " " and resid "58 " and name "HA ") 6.000 6.000 0.000 peak 8442 weight 0.10000E+01 volume 0.16500E+00 ppm1 7.634 ppm2 3.413 ASSI { 8444} (segid " " and resid "61 " and name "HN ") (segid " " and resid "60 " and name "HA ") 6.000 6.000 0.000 peak 8444 weight 0.10000E+01 volume 0.14100E+00 ppm1 7.632 ppm2 3.633 ASSI { 8445} (segid " " and resid "61 " and name "HN ") (segid " " and resid "60 " and name "HB1 ") 5.000 5.000 0.000 peak 8445 weight 0.10000E+01 volume 0.13480E+01 ppm1 7.637 ppm2 1.794 ASSI { 8447} (segid " " and resid "61 " and name "HN ") (segid " " and resid "61 " and name "HA ") 5.000 5.000 0.000 peak 8447 weight 0.10000E+01 volume 0.75100E+00 ppm1 7.635 ppm2 3.875 ASSI { 8448} (segid " " and resid "61 " and name "HN ") (segid " " and resid "61 " and name "HB2 ") 3.300 3.300 0.000 peak 8448 weight 0.10000E+01 volume 0.22180E+01 ppm1 7.634 ppm2 1.935 OR { 8448} (segid " " and resid "61 " and name "HN ") (segid " " and resid "61 " and name "HB1 ") ASSI { 8449} (segid " " and resid "61 " and name "HN ") (segid " " and resid "61 " and name "HG1 ") 5.000 5.000 0.000 peak 8449 weight 0.10000E+01 volume 0.69100E+00 ppm1 7.635 ppm2 2.453 ASSI { 8450} (segid " " and resid "61 " and name "HN ") (segid " " and resid "61 " and name "HG2 ") 5.000 5.000 0.000 peak 8450 weight 0.10000E+01 volume 0.82700E+00 ppm1 7.638 ppm2 2.094 ASSI { 8451} (segid " " and resid "61 " and name "HN ") (segid " " and resid "62 " and name "HN ") 5.000 5.000 0.000 peak 8451 weight 0.10000E+01 volume 0.56900E+00 ppm1 7.635 ppm2 7.499 ASSI { 8457} (segid " " and resid "62 " and name "HN ") (segid " " and resid "61 " and name "HA ") 6.000 6.000 0.000 peak 8457 weight 0.10000E+01 volume 0.29300E+00 ppm1 7.502 ppm2 3.872 ASSI { 8460} (segid " " and resid "62 " and name "HN ") (segid " " and resid "62 " and name "HA ") 5.000 5.000 0.000 peak 8460 weight 0.10000E+01 volume 0.62000E+00 ppm1 7.502 ppm2 3.763 ASSI { 8461} (segid " " and resid "62 " and name "HN ") (segid " " and resid "62 " and name "HB1 ") 3.300 3.300 0.000 peak 8461 weight 0.10000E+01 volume 0.15580E+01 ppm1 7.503 ppm2 1.852 ASSI { 8462} (segid " " and resid "62 " and name "HN ") (segid " " and resid "62 " and name "HG ") 3.300 3.300 0.000 peak 8462 weight 0.10000E+01 volume 0.17430E+01 ppm1 7.504 ppm2 1.728 ASSI { 8463} (segid " " and resid "62 " and name "HN ") (segid " " and resid "63 " and name "HN ") 5.000 5.000 0.000 peak 8463 weight 0.10000E+01 volume 0.64300E+00 ppm1 7.505 ppm2 8.596 ASSI { 8465} (segid " " and resid "63 " and name "HN ") (segid " " and resid "60 " and name "HA ") 6.000 6.000 0.000 peak 8465 weight 0.10000E+01 volume 0.25000E+00 ppm1 8.590 ppm2 3.643 ASSI { 8466} (segid " " and resid "63 " and name "HN ") (segid " " and resid "62 " and name "HA ") 6.000 6.000 0.000 peak 8466 weight 0.10000E+01 volume 0.25800E+00 ppm1 8.583 ppm2 3.763 ASSI { 8469} (segid " " and resid "63 " and name "HN ") (segid " " and resid "63 " and name "HA ") 5.000 5.000 0.000 peak 8469 weight 0.10000E+01 volume 0.76100E+00 ppm1 8.587 ppm2 3.897 ASSI { 8470} (segid " " and resid "63 " and name "HN ") (segid " " and resid "63 " and name "HD12") 5.000 5.000 0.000 peak 8470 weight 0.10000E+01 volume 0.79400E+00 ppm1 8.591 ppm2 0.648 OR { 8470} (segid " " and resid "63 " and name "HN ") (segid " " and resid "63 " and name "HD13") OR { 8470} (segid " " and resid "63 " and name "HN ") (segid " " and resid "63 " and name "HD11") ASSI { 8471} (segid " " and resid "63 " and name "HN ") (segid " " and resid "63 " and name "HG ") 5.000 5.000 0.000 peak 8471 weight 0.10000E+01 volume 0.13080E+01 ppm1 8.591 ppm2 1.599 ASSI { 8472} (segid " " and resid "63 " and name "HN ") (segid " " and resid "64 " and name "HN ") 5.000 5.000 0.000 peak 8472 weight 0.10000E+01 volume 0.45900E+00 ppm1 8.591 ppm2 8.945 ASSI { 8479} (segid " " and resid "64 " and name "HN ") (segid " " and resid "63 " and name "HB1 ") 5.000 5.000 0.000 peak 8479 weight 0.10000E+01 volume 0.59400E+00 ppm1 8.947 ppm2 1.225 ASSI { 8480} (segid " " and resid "64 " and name "HN ") (segid " " and resid "63 " and name "HD11") 6.000 6.000 0.000 peak 8480 weight 0.10000E+01 volume 0.20100E+00 ppm1 8.958 ppm2 0.646 OR { 8480} (segid " " and resid "64 " and name "HN ") (segid " " and resid "63 " and name "HD12") OR { 8480} (segid " " and resid "64 " and name "HN ") (segid " " and resid "63 " and name "HD13") ASSI { 8481} (segid " " and resid "64 " and name "HN ") (segid " " and resid "63 " and name "HD23") 5.000 5.000 0.000 peak 8481 weight 0.10000E+01 volume 0.62600E+00 ppm1 8.958 ppm2 0.835 OR { 8481} (segid " " and resid "64 " and name "HN ") (segid " " and resid "63 " and name "HD21") OR { 8481} (segid " " and resid "64 " and name "HN ") (segid " " and resid "63 " and name "HD22") ASSI { 8483} (segid " " and resid "64 " and name "HN ") (segid " " and resid "64 " and name "HA ") 5.000 5.000 0.000 peak 8483 weight 0.10000E+01 volume 0.77200E+00 ppm1 8.952 ppm2 4.105 ASSI { 8484} (segid " " and resid "64 " and name "HN ") (segid " " and resid "64 " and name "HB1 ") 3.300 3.300 0.000 peak 8484 weight 0.10000E+01 volume 0.18030E+01 ppm1 8.952 ppm2 1.983 ASSI { 8485} (segid " " and resid "64 " and name "HN ") (segid " " and resid "64 " and name "HB2 ") 3.300 3.300 0.000 peak 8485 weight 0.10000E+01 volume 0.17690E+01 ppm1 8.955 ppm2 1.905 ASSI { 8486} (segid " " and resid "64 " and name "HN ") (segid " " and resid "64 " and name "HG2 ") 5.000 5.000 0.000 peak 8486 weight 0.10000E+01 volume 0.11600E+01 ppm1 8.954 ppm2 1.629 OR { 8486} (segid " " and resid "64 " and name "HN ") (segid " " and resid "64 " and name "HG1 ") ASSI { 8487} (segid " " and resid "64 " and name "HN ") (segid " " and resid "65 " and name "HN ") 5.000 5.000 0.000 peak 8487 weight 0.10000E+01 volume 0.85700E+00 ppm1 8.954 ppm2 6.997 ASSI { 8492} (segid " " and resid "65 " and name "HN ") (segid " " and resid "64 " and name "HB1 ") 5.000 5.000 0.000 peak 8492 weight 0.10000E+01 volume 0.12270E+01 ppm1 7.002 ppm2 1.931 OR { 8492} (segid " " and resid "65 " and name "HN ") (segid " " and resid "64 " and name "HB2 ") ASSI { 8494} (segid " " and resid "65 " and name "HN ") (segid " " and resid "65 " and name "HA ") 5.000 5.000 0.000 peak 8494 weight 0.10000E+01 volume 0.64400E+00 ppm1 7.002 ppm2 4.507 ASSI { 8495} (segid " " and resid "65 " and name "HN ") (segid " " and resid "65 " and name "HB1 ") 5.000 5.000 0.000 peak 8495 weight 0.10000E+01 volume 0.95400E+00 ppm1 6.997 ppm2 2.167 ASSI { 8496} (segid " " and resid "65 " and name "HN ") (segid " " and resid "65 " and name "HB2 ") 3.300 3.300 0.000 peak 8496 weight 0.10000E+01 volume 0.20330E+01 ppm1 6.996 ppm2 2.023 ASSI { 8497} (segid " " and resid "65 " and name "HN ") (segid " " and resid "65 " and name "HG1 ") 6.000 6.000 0.000 peak 8497 weight 0.10000E+01 volume 0.21800E+00 ppm1 7.005 ppm2 2.562 ASSI { 8498} (segid " " and resid "65 " and name "HN ") (segid " " and resid "65 " and name "HG2 ") 5.000 5.000 0.000 peak 8498 weight 0.10000E+01 volume 0.36300E+00 ppm1 7.003 ppm2 2.451 ASSI { 8499} (segid " " and resid "65 " and name "HN ") (segid " " and resid "66 " and name "HN ") 5.000 5.000 0.000 peak 8499 weight 0.10000E+01 volume 0.96200E+00 ppm1 7.003 ppm2 7.601 ASSI { 8506} (segid " " and resid "65 " and name "HE22") (segid " " and resid "65 " and name "HG1 ") 5.000 5.000 0.000 peak 8506 weight 0.10000E+01 volume 0.42000E+00 ppm1 6.795 ppm2 2.560 ASSI { 8507} (segid " " and resid "65 " and name "HE22") (segid " " and resid "65 " and name "HG2 ") 5.000 5.000 0.000 peak 8507 weight 0.10000E+01 volume 0.30100E+00 ppm1 6.784 ppm2 2.434 ASSI { 8515} (segid " " and resid "67 " and name "HN ") (segid " " and resid "67 " and name "HA ") 5.000 5.000 0.000 peak 8515 weight 0.10000E+01 volume 0.97800E+00 ppm1 8.029 ppm2 4.024 ASSI { 8516} (segid " " and resid "67 " and name "HN ") (segid " " and resid "67 " and name "HB1 ") 3.300 3.300 0.000 peak 8516 weight 0.10000E+01 volume 0.26890E+01 ppm1 8.024 ppm2 1.122 OR { 8516} (segid " " and resid "67 " and name "HN ") (segid " " and resid "67 " and name "HB3 ") OR { 8516} (segid " " and resid "67 " and name "HN ") (segid " " and resid "67 " and name "HB2 ") ASSI { 8517} (segid " " and resid "67 " and name "HN ") (segid " " and resid "68 " and name "HN ") 6.000 6.000 0.000 peak 8517 weight 0.10000E+01 volume 0.17500E+00 ppm1 8.022 ppm2 10.194 ASSI { 8520} (segid " " and resid "68 " and name "HN ") (segid " " and resid "67 " and name "HB3 ") 5.000 5.000 0.000 peak 8520 weight 0.10000E+01 volume 0.61800E+00 ppm1 10.197 ppm2 1.124 OR { 8520} (segid " " and resid "68 " and name "HN ") (segid " " and resid "67 " and name "HB1 ") OR { 8520} (segid " " and resid "68 " and name "HN ") (segid " " and resid "67 " and name "HB2 ") ASSI { 8529} (segid " " and resid "70 " and name "HN ") (segid " " and resid "69 " and name "HA ") 6.000 6.000 0.000 peak 8529 weight 0.10000E+01 volume 0.27800E+00 ppm1 7.981 ppm2 4.406 ASSI { 8530} (segid " " and resid "70 " and name "HN ") (segid " " and resid "70 " and name "HA ") 5.000 5.000 0.000 peak 8530 weight 0.10000E+01 volume 0.83200E+00 ppm1 7.982 ppm2 5.147 ASSI { 8531} (segid " " and resid "70 " and name "HN ") (segid " " and resid "70 " and name "HB1 ") 5.000 5.000 0.000 peak 8531 weight 0.10000E+01 volume 0.81500E+00 ppm1 7.983 ppm2 3.008 ASSI { 8532} (segid " " and resid "70 " and name "HN ") (segid " " and resid "70 " and name "HB2 ") 5.000 5.000 0.000 peak 8532 weight 0.10000E+01 volume 0.13330E+01 ppm1 7.979 ppm2 2.796 ASSI { 8539} (segid " " and resid "71 " and name "HN ") (segid " " and resid "70 " and name "HA ") 3.300 3.300 0.000 peak 8539 weight 0.10000E+01 volume 0.21870E+01 ppm1 6.879 ppm2 5.146 ASSI { 8540} (segid " " and resid "71 " and name "HN ") (segid " " and resid "70 " and name "HB1 ") 6.000 6.000 0.000 peak 8540 weight 0.10000E+01 volume 0.17300E+00 ppm1 6.882 ppm2 2.993 ASSI { 8541} (segid " " and resid "71 " and name "HN ") (segid " " and resid "70 " and name "HB2 ") 6.000 6.000 0.000 peak 8541 weight 0.10000E+01 volume 0.16600E+00 ppm1 6.866 ppm2 2.796 ASSI { 8542} (segid " " and resid "71 " and name "HN ") (segid " " and resid "70 " and name "HN ") 5.000 5.000 0.000 peak 8542 weight 0.10000E+01 volume 0.67800E+00 ppm1 6.882 ppm2 7.982 ASSI { 8543} (segid " " and resid "71 " and name "HN ") (segid " " and resid "71 " and name "HA ") 5.000 5.000 0.000 peak 8543 weight 0.10000E+01 volume 0.14300E+01 ppm1 6.876 ppm2 4.322 ASSI { 8544} (segid " " and resid "71 " and name "HN ") (segid " " and resid "71 " and name "HB ") 5.000 5.000 0.000 peak 8544 weight 0.10000E+01 volume 0.81500E+00 ppm1 6.882 ppm2 2.050 ASSI { 8546} (segid " " and resid "71 " and name "HN ") (segid " " and resid "71 " and name "HG13") 2.700 2.700 0.000 peak 8546 weight 0.10000E+01 volume 0.30220E+01 ppm1 6.879 ppm2 0.845 OR { 8546} (segid " " and resid "71 " and name "HN ") (segid " " and resid "71 " and name "HG12") OR { 8546} (segid " " and resid "71 " and name "HN ") (segid " " and resid "71 " and name "HG11") ASSI { 8545} (segid " " and resid "71 " and name "HN ") (segid " " and resid "71 " and name "HG21") 3.300 3.300 0.000 peak 8545 weight 0.10000E+01 volume 0.28390E+01 ppm1 6.879 ppm2 0.928 OR { 8545} (segid " " and resid "71 " and name "HN ") (segid " " and resid "71 " and name "HG23") OR { 8545} (segid " " and resid "71 " and name "HN ") (segid " " and resid "71 " and name "HG22") ASSI { 8547} (segid " " and resid "71 " and name "HN ") (segid " " and resid "72 " and name "HN ") 6.000 6.000 0.000 peak 8547 weight 0.10000E+01 volume 0.12400E+00 ppm1 6.882 ppm2 8.206 ASSI { 8549} (segid " " and resid "72 " and name "HN ") (segid " " and resid "71 " and name "HA ") 2.700 2.700 0.000 peak 8549 weight 0.10000E+01 volume 0.39630E+01 ppm1 8.200 ppm2 4.326 ASSI { 8550} (segid " " and resid "72 " and name "HN ") (segid " " and resid "71 " and name "HB ") 3.300 3.300 0.000 peak 8550 weight 0.10000E+01 volume 0.17370E+01 ppm1 8.203 ppm2 2.046 ASSI { 8552} (segid " " and resid "72 " and name "HN ") (segid " " and resid "71 " and name "HG12") 5.000 5.000 0.000 peak 8552 weight 0.10000E+01 volume 0.84600E+00 ppm1 8.198 ppm2 0.837 OR { 8552} (segid " " and resid "72 " and name "HN ") (segid " " and resid "71 " and name "HG11") OR { 8552} (segid " " and resid "72 " and name "HN ") (segid " " and resid "71 " and name "HG13") ASSI { 8551} (segid " " and resid "72 " and name "HN ") (segid " " and resid "71 " and name "HG23") 5.000 5.000 0.000 peak 8551 weight 0.10000E+01 volume 0.87500E+00 ppm1 8.199 ppm2 0.929 OR { 8551} (segid " " and resid "72 " and name "HN ") (segid " " and resid "71 " and name "HG22") OR { 8551} (segid " " and resid "72 " and name "HN ") (segid " " and resid "71 " and name "HG21") ASSI { 8553} (segid " " and resid "72 " and name "HN ") (segid " " and resid "72 " and name "HA ") 5.000 5.000 0.000 peak 8553 weight 0.10000E+01 volume 0.65400E+00 ppm1 8.200 ppm2 4.996 ASSI { 8554} (segid " " and resid "72 " and name "HN ") (segid " " and resid "72 " and name "HB2 ") 5.000 5.000 0.000 peak 8554 weight 0.10000E+01 volume 0.84000E+00 ppm1 8.197 ppm2 1.835 ASSI { 8555} (segid " " and resid "72 " and name "HN ") (segid " " and resid "72 " and name "HG1 ") 5.000 5.000 0.000 peak 8555 weight 0.10000E+01 volume 0.73900E+00 ppm1 8.193 ppm2 2.249 OR { 8555} (segid " " and resid "72 " and name "HN ") (segid " " and resid "72 " and name "HG2 ") ASSI { 8561} (segid " " and resid "73 " and name "HN ") (segid " " and resid "72 " and name "HA ") 3.300 3.300 0.000 peak 8561 weight 0.10000E+01 volume 0.29560E+01 ppm1 7.992 ppm2 4.996 ASSI { 8562} (segid " " and resid "73 " and name "HN ") (segid " " and resid "73 " and name "HA ") 3.300 3.300 0.000 peak 8562 weight 0.10000E+01 volume 0.24050E+01 ppm1 7.991 ppm2 4.921 ASSI { 8563} (segid " " and resid "73 " and name "HN ") (segid " " and resid "73 " and name "HB1 ") 5.000 5.000 0.000 peak 8563 weight 0.10000E+01 volume 0.32400E+00 ppm1 7.988 ppm2 3.527 ASSI { 8564} (segid " " and resid "73 " and name "HN ") (segid " " and resid "73 " and name "HB2 ") 5.000 5.000 0.000 peak 8564 weight 0.10000E+01 volume 0.71700E+00 ppm1 7.982 ppm2 2.664 ASSI { 8567} (segid " " and resid "75 " and name "HN ") (segid " " and resid "74 " and name "HA ") 5.000 5.000 0.000 peak 8567 weight 0.10000E+01 volume 0.44700E+00 ppm1 8.360 ppm2 4.242 ASSI { 8568} (segid " " and resid "75 " and name "HN ") (segid " " and resid "74 " and name "HB3 ") 5.000 5.000 0.000 peak 8568 weight 0.10000E+01 volume 0.52300E+00 ppm1 8.363 ppm2 1.548 OR { 8568} (segid " " and resid "75 " and name "HN ") (segid " " and resid "74 " and name "HB1 ") OR { 8568} (segid " " and resid "75 " and name "HN ") (segid " " and resid "74 " and name "HB2 ") ASSI { 8569} (segid " " and resid "75 " and name "HN ") (segid " " and resid "75 " and name "HA ") 3.300 3.300 0.000 peak 8569 weight 0.10000E+01 volume 0.15970E+01 ppm1 8.358 ppm2 4.674 ASSI { 8570} (segid " " and resid "75 " and name "HN ") (segid " " and resid "75 " and name "HB1 ") 5.000 5.000 0.000 peak 8570 weight 0.10000E+01 volume 0.83300E+00 ppm1 8.363 ppm2 4.110 ASSI { 8571} (segid " " and resid "75 " and name "HN ") (segid " " and resid "75 " and name "HB2 ") 5.000 5.000 0.000 peak 8571 weight 0.10000E+01 volume 0.64100E+00 ppm1 8.364 ppm2 4.011 ASSI { 8572} (segid " " and resid "75 " and name "HN ") (segid " " and resid "77 " and name "HN ") 5.000 5.000 0.000 peak 8572 weight 0.10000E+01 volume 0.31500E+00 ppm1 8.353 ppm2 8.164 ASSI { 8574} (segid " " and resid "76 " and name "HN ") (segid " " and resid "75 " and name "HA ") 5.000 5.000 0.000 peak 8574 weight 0.10000E+01 volume 0.32600E+00 ppm1 8.374 ppm2 4.656 ASSI { 8575} (segid " " and resid "76 " and name "HN ") (segid " " and resid "76 " and name "HA1 ") 3.300 3.300 0.000 peak 8575 weight 0.10000E+01 volume 0.17790E+01 ppm1 8.370 ppm2 4.237 ASSI { 8576} (segid " " and resid "76 " and name "HN ") (segid " " and resid "76 " and name "HA2 ") 3.300 3.300 0.000 peak 8576 weight 0.10000E+01 volume 0.17680E+01 ppm1 8.370 ppm2 3.783 ASSI { 8581} (segid " " and resid "77 " and name "HN ") (segid " " and resid "76 " and name "HN ") 3.300 3.300 0.000 peak 8581 weight 0.10000E+01 volume 0.21920E+01 ppm1 8.150 ppm2 8.371 ASSI { 8582} (segid " " and resid "77 " and name "HN ") (segid " " and resid "77 " and name "HG21") 5.000 5.000 0.000 peak 8582 weight 0.10000E+01 volume 0.54000E+00 ppm1 8.149 ppm2 1.245 OR { 8582} (segid " " and resid "77 " and name "HN ") (segid " " and resid "77 " and name "HG22") OR { 8582} (segid " " and resid "77 " and name "HN ") (segid " " and resid "77 " and name "HG23") ASSI { 8583} (segid " " and resid "78 " and name "HN ") (segid " " and resid "77 " and name "HA ") 3.300 3.300 0.000 peak 8583 weight 0.10000E+01 volume -0.19170E+01 ppm1 10.179 ppm2 3.776 ASSI { 8584} (segid " " and resid "78 " and name "HN ") (segid " " and resid "77 " and name "HG22") 5.000 5.000 0.000 peak 8584 weight 0.10000E+01 volume -0.48900E+00 ppm1 10.183 ppm2 1.229 OR { 8584} (segid " " and resid "78 " and name "HN ") (segid " " and resid "77 " and name "HG21") OR { 8584} (segid " " and resid "78 " and name "HN ") (segid " " and resid "77 " and name "HG23") ASSI { 8585} (segid " " and resid "78 " and name "HN ") (segid " " and resid "78 " and name "HA ") 6.000 6.000 0.000 peak 8585 weight 0.10000E+01 volume -0.17300E+00 ppm1 10.188 ppm2 5.867 ASSI { 8586} (segid " " and resid "78 " and name "HN ") (segid " " and resid "78 " and name "HB1 ") 6.000 6.000 0.000 peak 8586 weight 0.10000E+01 volume -0.19600E+00 ppm1 10.170 ppm2 4.458 ASSI { 8587} (segid " " and resid "78 " and name "HN ") (segid " " and resid "78 " and name "HB2 ") 5.000 5.000 0.000 peak 8587 weight 0.10000E+01 volume -0.46700E+00 ppm1 10.173 ppm2 4.287 ASSI { 8588} (segid " " and resid "78 " and name "HN ") (segid " " and resid "78 " and name "HG ") 6.000 6.000 0.000 peak 8588 weight 0.10000E+01 volume -0.28800E+00 ppm1 10.170 ppm2 6.300 ASSI { 8596} (segid " " and resid "80 " and name "HN ") (segid " " and resid "79 " and name "HB1 ") 5.000 5.000 0.000 peak 8596 weight 0.10000E+01 volume 0.34600E+00 ppm1 8.462 ppm2 2.452 ASSI { 8597} (segid " " and resid "80 " and name "HN ") (segid " " and resid "80 " and name "HA ") 5.000 5.000 0.000 peak 8597 weight 0.10000E+01 volume 0.76300E+00 ppm1 8.465 ppm2 3.685 ASSI { 8598} (segid " " and resid "80 " and name "HN ") (segid " " and resid "80 " and name "HB ") 3.300 3.300 0.000 peak 8598 weight 0.10000E+01 volume 0.22550E+01 ppm1 8.467 ppm2 1.916 ASSI { 8599} (segid " " and resid "80 " and name "HN ") (segid " " and resid "81 " and name "HN ") 5.000 5.000 0.000 peak 8599 weight 0.10000E+01 volume 0.51500E+00 ppm1 8.463 ppm2 7.712 ASSI { 8603} (segid " " and resid "81 " and name "HN ") (segid " " and resid "78 " and name "HG ") 5.000 5.000 0.000 peak 8603 weight 0.10000E+01 volume 0.42500E+00 ppm1 7.718 ppm2 6.309 ASSI { 8607} (segid " " and resid "81 " and name "HN ") (segid " " and resid "80 " and name "HB ") 5.000 5.000 0.000 peak 8607 weight 0.10000E+01 volume 0.61200E+00 ppm1 7.712 ppm2 1.911 ASSI { 8609} (segid " " and resid "81 " and name "HN ") (segid " " and resid "81 " and name "HA ") 5.000 5.000 0.000 peak 8609 weight 0.10000E+01 volume 0.10680E+01 ppm1 7.718 ppm2 3.887 ASSI { 8610} (segid " " and resid "81 " and name "HN ") (segid " " and resid "81 " and name "HB1 ") 5.000 5.000 0.000 peak 8610 weight 0.10000E+01 volume 0.12840E+01 ppm1 7.717 ppm2 3.770 ASSI { 8611} (segid " " and resid "81 " and name "HN ") (segid " " and resid "81 " and name "HB2 ") 5.000 5.000 0.000 peak 8611 weight 0.10000E+01 volume 0.54600E+00 ppm1 7.718 ppm2 3.277 ASSI { 8612} (segid " " and resid "81 " and name "HN ") (segid " " and resid "81 " and name "HD2 ") 6.000 6.000 0.000 peak 8612 weight 0.10000E+01 volume 0.14600E+00 ppm1 7.715 ppm2 6.496 ASSI { 8613} (segid " " and resid "81 " and name "HN ") (segid " " and resid "82 " and name "HN ") 5.000 5.000 0.000 peak 8613 weight 0.10000E+01 volume 0.12520E+01 ppm1 7.716 ppm2 7.364 ASSI { 8614} (segid " " and resid "81 " and name "HE2 ") (segid " " and resid "81 " and name "HD2 ") 6.000 6.000 0.000 peak 8614 weight 0.10000E+01 volume -0.11700E+00 ppm1 11.098 ppm2 6.512 ASSI { 8615} (segid " " and resid "81 " and name "HE2 ") (segid " " and resid "81 " and name "HE1 ") 6.000 6.000 0.000 peak 8615 weight 0.10000E+01 volume -0.24400E+00 ppm1 11.102 ppm2 7.457 ASSI { 8620} (segid " " and resid "82 " and name "HN ") (segid " " and resid "81 " and name "HB1 ") 5.000 5.000 0.000 peak 8620 weight 0.10000E+01 volume 0.79400E+00 ppm1 7.362 ppm2 3.781 ASSI { 8621} (segid " " and resid "82 " and name "HN ") (segid " " and resid "81 " and name "HB2 ") 5.000 5.000 0.000 peak 8621 weight 0.10000E+01 volume 0.43400E+00 ppm1 7.365 ppm2 3.268 ASSI { 8623} (segid " " and resid "82 " and name "HN ") (segid " " and resid "82 " and name "HA ") 5.000 5.000 0.000 peak 8623 weight 0.10000E+01 volume 0.55000E+00 ppm1 7.359 ppm2 4.448 ASSI { 8624} (segid " " and resid "82 " and name "HN ") (segid " " and resid "82 " and name "HB1 ") 3.300 3.300 0.000 peak 8624 weight 0.10000E+01 volume 0.15530E+01 ppm1 7.364 ppm2 2.304 ASSI { 8625} (segid " " and resid "82 " and name "HN ") (segid " " and resid "82 " and name "HB2 ") 5.000 5.000 0.000 peak 8625 weight 0.10000E+01 volume 0.10160E+01 ppm1 7.364 ppm2 1.985 ASSI { 8626} (segid " " and resid "82 " and name "HN ") (segid " " and resid "83 " and name "HN ") 5.000 5.000 0.000 peak 8626 weight 0.10000E+01 volume 0.89300E+00 ppm1 7.362 ppm2 8.755 ASSI { 8629} (segid " " and resid "83 " and name "HN ") (segid " " and resid "82 " and name "HB1 ") 5.000 5.000 0.000 peak 8629 weight 0.10000E+01 volume 0.75900E+00 ppm1 8.759 ppm2 2.303 ASSI { 8630} (segid " " and resid "83 " and name "HN ") (segid " " and resid "82 " and name "HB2 ") 5.000 5.000 0.000 peak 8630 weight 0.10000E+01 volume 0.69700E+00 ppm1 8.753 ppm2 1.977 ASSI { 8632} (segid " " and resid "83 " and name "HN ") (segid " " and resid "83 " and name "HA ") 5.000 5.000 0.000 peak 8632 weight 0.10000E+01 volume 0.90900E+00 ppm1 8.751 ppm2 3.790 ASSI { 8633} (segid " " and resid "83 " and name "HN ") (segid " " and resid "83 " and name "HB2 ") 3.300 3.300 0.000 peak 8633 weight 0.10000E+01 volume 0.23870E+01 ppm1 8.754 ppm2 1.313 OR { 8633} (segid " " and resid "83 " and name "HN ") (segid " " and resid "83 " and name "HB1 ") OR { 8633} (segid " " and resid "83 " and name "HN ") (segid " " and resid "83 " and name "HB3 ") ASSI { 8634} (segid " " and resid "83 " and name "HN ") (segid " " and resid "84 " and name "HN ") 5.000 5.000 0.000 peak 8634 weight 0.10000E+01 volume 0.11600E+01 ppm1 8.752 ppm2 7.847 ASSI { 8637} (segid " " and resid "84 " and name "HN ") (segid " " and resid "83 " and name "HA ") 5.000 5.000 0.000 peak 8637 weight 0.10000E+01 volume 0.46800E+00 ppm1 7.844 ppm2 3.795 ASSI { 8638} (segid " " and resid "84 " and name "HN ") (segid " " and resid "83 " and name "HB3 ") 3.300 3.300 0.000 peak 8638 weight 0.10000E+01 volume 0.17490E+01 ppm1 7.844 ppm2 1.315 OR { 8638} (segid " " and resid "84 " and name "HN ") (segid " " and resid "83 " and name "HB1 ") OR { 8638} (segid " " and resid "84 " and name "HN ") (segid " " and resid "83 " and name "HB2 ") ASSI { 8640} (segid " " and resid "84 " and name "HN ") (segid " " and resid "84 " and name "HA ") 5.000 5.000 0.000 peak 8640 weight 0.10000E+01 volume 0.10240E+01 ppm1 7.840 ppm2 3.996 ASSI { 8641} (segid " " and resid "84 " and name "HN ") (segid " " and resid "84 " and name "HB1 ") 2.700 2.700 0.000 peak 8641 weight 0.10000E+01 volume 0.40690E+01 ppm1 7.844 ppm2 1.442 OR { 8641} (segid " " and resid "84 " and name "HN ") (segid " " and resid "84 " and name "HB2 ") OR { 8641} (segid " " and resid "84 " and name "HN ") (segid " " and resid "84 " and name "HB3 ") ASSI { 8642} (segid " " and resid "84 " and name "HN ") (segid " " and resid "85 " and name "HN ") 5.000 5.000 0.000 peak 8642 weight 0.10000E+01 volume 0.88900E+00 ppm1 7.843 ppm2 8.631 ASSI { 8646} (segid " " and resid "85 " and name "HN ") (segid " " and resid "82 " and name "HA ") 5.000 5.000 0.000 peak 8646 weight 0.10000E+01 volume 0.54700E+00 ppm1 8.640 ppm2 4.445 ASSI { 8647} (segid " " and resid "85 " and name "HN ") (segid " " and resid "84 " and name "HA ") 6.000 6.000 0.000 peak 8647 weight 0.10000E+01 volume 0.26200E+00 ppm1 8.637 ppm2 3.987 ASSI { 8648} (segid " " and resid "85 " and name "HN ") (segid " " and resid "84 " and name "HB1 ") 5.000 5.000 0.000 peak 8648 weight 0.10000E+01 volume 0.12570E+01 ppm1 8.640 ppm2 1.440 OR { 8648} (segid " " and resid "85 " and name "HN ") (segid " " and resid "84 " and name "HB2 ") OR { 8648} (segid " " and resid "85 " and name "HN ") (segid " " and resid "84 " and name "HB3 ") ASSI { 8650} (segid " " and resid "85 " and name "HN ") (segid " " and resid "85 " and name "HA ") 5.000 5.000 0.000 peak 8650 weight 0.10000E+01 volume 0.67900E+00 ppm1 8.638 ppm2 3.749 ASSI { 8651} (segid " " and resid "85 " and name "HN ") (segid " " and resid "85 " and name "HB2 ") 3.300 3.300 0.000 peak 8651 weight 0.10000E+01 volume 0.23150E+01 ppm1 8.644 ppm2 2.054 OR { 8651} (segid " " and resid "85 " and name "HN ") (segid " " and resid "85 " and name "HB1 ") ASSI { 8652} (segid " " and resid "85 " and name "HN ") (segid " " and resid "86 " and name "HN ") 5.000 5.000 0.000 peak 8652 weight 0.10000E+01 volume 0.61400E+00 ppm1 8.638 ppm2 7.657 ASSI { 8654} (segid " " and resid "86 " and name "HN ") (segid " " and resid "85 " and name "HA ") 5.000 5.000 0.000 peak 8654 weight 0.10000E+01 volume -0.37800E+00 ppm1 7.661 ppm2 3.765 ASSI { 8655} (segid " " and resid "86 " and name "HN ") (segid " " and resid "85 " and name "HB1 ") 5.000 5.000 0.000 peak 8655 weight 0.10000E+01 volume -0.58200E+00 ppm1 7.648 ppm2 2.057 OR { 8655} (segid " " and resid "86 " and name "HN ") (segid " " and resid "85 " and name "HB2 ") ASSI { 8657} (segid " " and resid "86 " and name "HN ") (segid " " and resid "86 " and name "HA ") 3.300 3.300 0.000 peak 8657 weight 0.10000E+01 volume -0.16560E+01 ppm1 7.661 ppm2 4.352 ASSI { 8658} (segid " " and resid "86 " and name "HN ") (segid " " and resid "86 " and name "HG1 ") 3.300 3.300 0.000 peak 8658 weight 0.10000E+01 volume -0.24200E+01 ppm1 7.648 ppm2 4.458 ASSI { 8659} (segid " " and resid "86 " and name "HN ") (segid " " and resid "86 " and name "HG21") 5.000 5.000 0.000 peak 8659 weight 0.10000E+01 volume -0.12210E+01 ppm1 7.661 ppm2 1.336 OR { 8659} (segid " " and resid "86 " and name "HN ") (segid " " and resid "86 " and name "HG23") OR { 8659} (segid " " and resid "86 " and name "HN ") (segid " " and resid "86 " and name "HG22") ASSI { 8663} (segid " " and resid "87 " and name "HN ") (segid " " and resid "86 " and name "HA ") 5.000 5.000 0.000 peak 8663 weight 0.10000E+01 volume 0.37700E+00 ppm1 7.086 ppm2 4.331 ASSI { 8664} (segid " " and resid "87 " and name "HN ") (segid " " and resid "86 " and name "HG1 ") 5.000 5.000 0.000 peak 8664 weight 0.10000E+01 volume 0.45000E+00 ppm1 7.095 ppm2 4.451 ASSI { 8665} (segid " " and resid "87 " and name "HN ") (segid " " and resid "86 " and name "HG22") 6.000 6.000 0.000 peak 8665 weight 0.10000E+01 volume 0.16900E+00 ppm1 7.088 ppm2 1.334 OR { 8665} (segid " " and resid "87 " and name "HN ") (segid " " and resid "86 " and name "HG21") OR { 8665} (segid " " and resid "87 " and name "HN ") (segid " " and resid "86 " and name "HG23") ASSI { 8666} (segid " " and resid "87 " and name "HN ") (segid " " and resid "86 " and name "HN ") 3.300 3.300 0.000 peak 8666 weight 0.10000E+01 volume 0.20200E+01 ppm1 7.092 ppm2 7.656 ASSI { 8667} (segid " " and resid "87 " and name "HN ") (segid " " and resid "87 " and name "HA1 ") 3.300 3.300 0.000 peak 8667 weight 0.10000E+01 volume 0.17050E+01 ppm1 7.092 ppm2 2.756 ASSI { 8668} (segid " " and resid "87 " and name "HN ") (segid " " and resid "87 " and name "HA2 ") 5.000 5.000 0.000 peak 8668 weight 0.10000E+01 volume 0.13240E+01 ppm1 7.091 ppm2 2.584 ASSI { 8669} (segid " " and resid "87 " and name "HN ") (segid " " and resid "88 " and name "HN ") 3.300 3.300 0.000 peak 8669 weight 0.10000E+01 volume 0.21240E+01 ppm1 7.092 ppm2 7.581 ASSI { 8673} (segid " " and resid "88 " and name "HN ") (segid " " and resid "87 " and name "HA1 ") 5.000 5.000 0.000 peak 8673 weight 0.10000E+01 volume 0.63200E+00 ppm1 7.583 ppm2 2.760 ASSI { 8675} (segid " " and resid "88 " and name "HN ") (segid " " and resid "88 " and name "HA ") 5.000 5.000 0.000 peak 8675 weight 0.10000E+01 volume 0.42400E+00 ppm1 7.585 ppm2 4.666 ASSI { 8676} (segid " " and resid "88 " and name "HN ") (segid " " and resid "88 " and name "HB1 ") 5.000 5.000 0.000 peak 8676 weight 0.10000E+01 volume 0.92900E+00 ppm1 7.581 ppm2 3.445 ASSI { 8677} (segid " " and resid "88 " and name "HN ") (segid " " and resid "88 " and name "HB2 ") 3.300 3.300 0.000 peak 8677 weight 0.10000E+01 volume 0.18840E+01 ppm1 7.580 ppm2 2.521 ASSI { 8678} (segid " " and resid "88 " and name "HN ") (segid " " and resid "88 " and name "HD2 ") 5.000 5.000 0.000 peak 8678 weight 0.10000E+01 volume 0.74100E+00 ppm1 7.579 ppm2 7.446 OR { 8678} (segid " " and resid "88 " and name "HN ") (segid " " and resid "88 " and name "HD1 ") ASSI { 8679} (segid " " and resid "88 " and name "HN ") (segid " " and resid "89 " and name "HN ") 2.700 2.700 0.000 peak 8679 weight 0.10000E+01 volume 0.33200E+01 ppm1 7.577 ppm2 7.685 ASSI { 8682} (segid " " and resid "89 " and name "HN ") (segid " " and resid "88 " and name "HA ") 3.300 3.300 0.000 peak 8682 weight 0.10000E+01 volume 0.18110E+01 ppm1 7.692 ppm2 4.649 ASSI { 8683} (segid " " and resid "89 " and name "HN ") (segid " " and resid "88 " and name "HD1 ") 6.000 6.000 0.000 peak 8683 weight 0.10000E+01 volume 0.18900E+00 ppm1 7.690 ppm2 7.434 OR { 8683} (segid " " and resid "89 " and name "HN ") (segid " " and resid "88 " and name "HD2 ") ASSI { 8684} (segid " " and resid "89 " and name "HN ") (segid " " and resid "89 " and name "HA ") 5.000 5.000 0.000 peak 8684 weight 0.10000E+01 volume 0.37300E+00 ppm1 7.687 ppm2 3.711 ASSI { 8685} (segid " " and resid "89 " and name "HN ") (segid " " and resid "89 " and name "HB1 ") 5.000 5.000 0.000 peak 8685 weight 0.10000E+01 volume 0.98200E+00 ppm1 7.689 ppm2 1.827 ASSI { 8686} (segid " " and resid "89 " and name "HN ") (segid " " and resid "89 " and name "HB2 ") 5.000 5.000 0.000 peak 8686 weight 0.10000E+01 volume 0.13020E+01 ppm1 7.690 ppm2 1.236 ASSI { 8687} (segid " " and resid "89 " and name "HN ") (segid " " and resid "89 " and name "HD12") 6.000 6.000 0.000 peak 8687 weight 0.10000E+01 volume 0.29000E+00 ppm1 7.694 ppm2 0.818 OR { 8687} (segid " " and resid "89 " and name "HN ") (segid " " and resid "89 " and name "HD11") OR { 8687} (segid " " and resid "89 " and name "HN ") (segid " " and resid "89 " and name "HD13") ASSI { 8688} (segid " " and resid "89 " and name "HN ") (segid " " and resid "89 " and name "HD23") 6.000 6.000 0.000 peak 8688 weight 0.10000E+01 volume 0.14500E+00 ppm1 7.690 ppm2 0.609 OR { 8688} (segid " " and resid "89 " and name "HN ") (segid " " and resid "89 " and name "HD21") OR { 8688} (segid " " and resid "89 " and name "HN ") (segid " " and resid "89 " and name "HD22") ASSI { 8689} (segid " " and resid "89 " and name "HN ") (segid " " and resid "89 " and name "HG ") 5.000 5.000 0.000 peak 8689 weight 0.10000E+01 volume 0.10810E+01 ppm1 7.692 ppm2 1.302 ASSI { 8692} (segid " " and resid "90 " and name "HN ") (segid " " and resid "89 " and name "HB1 ") 6.000 6.000 0.000 peak 8692 weight 0.10000E+01 volume 0.28300E+00 ppm1 8.706 ppm2 1.822 ASSI { 8693} (segid " " and resid "90 " and name "HN ") (segid " " and resid "89 " and name "HB2 ") 5.000 5.000 0.000 peak 8693 weight 0.10000E+01 volume 0.35700E+00 ppm1 8.702 ppm2 1.263 ASSI { 8694} (segid " " and resid "90 " and name "HN ") (segid " " and resid "90 " and name "HA ") 6.000 6.000 0.000 peak 8694 weight 0.10000E+01 volume 0.26500E+00 ppm1 8.697 ppm2 4.252 ASSI { 8695} (segid " " and resid "90 " and name "HN ") (segid " " and resid "90 " and name "HB1 ") 5.000 5.000 0.000 peak 8695 weight 0.10000E+01 volume 0.50500E+00 ppm1 8.700 ppm2 2.759 ASSI { 8696} (segid " " and resid "90 " and name "HN ") (segid " " and resid "90 " and name "HB2 ") 5.000 5.000 0.000 peak 8696 weight 0.10000E+01 volume 0.36500E+00 ppm1 8.701 ppm2 2.574 ASSI { 8699} (segid " " and resid "91 " and name "HN ") (segid " " and resid "91 " and name "HA ") 3.300 3.300 0.000 peak 8699 weight 0.10000E+01 volume 0.17220E+01 ppm1 7.936 ppm2 3.757 ASSI { 8700} (segid " " and resid "91 " and name "HN ") (segid " " and resid "91 " and name "HB ") 3.300 3.300 0.000 peak 8700 weight 0.10000E+01 volume 0.27410E+01 ppm1 7.928 ppm2 4.189 ASSI { 8701} (segid " " and resid "91 " and name "HN ") (segid " " and resid "91 " and name "HG1 ") 5.000 5.000 0.000 peak 8701 weight 0.10000E+01 volume 0.37500E+00 ppm1 7.928 ppm2 5.175 ASSI { 8702} (segid " " and resid "91 " and name "HN ") (segid " " and resid "92 " and name "HN ") 2.700 2.700 0.000 peak 8702 weight 0.10000E+01 volume 0.39680E+01 ppm1 7.933 ppm2 8.056 ASSI { 8706} (segid " " and resid "92 " and name "HN ") (segid " " and resid "91 " and name "HB ") 5.000 5.000 0.000 peak 8706 weight 0.10000E+01 volume 0.77300E+00 ppm1 8.057 ppm2 4.196 ASSI { 8708} (segid " " and resid "92 " and name "HN ") (segid " " and resid "92 " and name "HA ") 3.300 3.300 0.000 peak 8708 weight 0.10000E+01 volume 0.18280E+01 ppm1 8.051 ppm2 3.870 ASSI { 8709} (segid " " and resid "92 " and name "HN ") (segid " " and resid "92 " and name "HB1 ") 3.300 3.300 0.000 peak 8709 weight 0.10000E+01 volume 0.15440E+01 ppm1 8.063 ppm2 2.066 ASSI { 8710} (segid " " and resid "92 " and name "HN ") (segid " " and resid "92 " and name "HB2 ") 3.300 3.300 0.000 peak 8710 weight 0.10000E+01 volume 0.21290E+01 ppm1 8.058 ppm2 1.365 ASSI { 8711} (segid " " and resid "92 " and name "HN ") (segid " " and resid "93 " and name "HN ") 5.000 5.000 0.000 peak 8711 weight 0.10000E+01 volume 0.71200E+00 ppm1 8.064 ppm2 8.577 ASSI { 8714} (segid " " and resid "93 " and name "HN ") (segid " " and resid "90 " and name "HA ") 6.000 6.000 0.000 peak 8714 weight 0.10000E+01 volume 0.24900E+00 ppm1 8.573 ppm2 4.247 ASSI { 8715} (segid " " and resid "93 " and name "HN ") (segid " " and resid "92 " and name "HB1 ") 5.000 5.000 0.000 peak 8715 weight 0.10000E+01 volume 0.12840E+01 ppm1 8.571 ppm2 2.075 ASSI { 8716} (segid " " and resid "93 " and name "HN ") (segid " " and resid "92 " and name "HB2 ") 5.000 5.000 0.000 peak 8716 weight 0.10000E+01 volume 0.99200E+00 ppm1 8.574 ppm2 1.338 ASSI { 8718} (segid " " and resid "93 " and name "HN ") (segid " " and resid "93 " and name "HA ") 5.000 5.000 0.000 peak 8718 weight 0.10000E+01 volume 0.10450E+01 ppm1 8.578 ppm2 3.709 ASSI { 8719} (segid " " and resid "93 " and name "HN ") (segid " " and resid "93 " and name "HB1 ") 5.000 5.000 0.000 peak 8719 weight 0.10000E+01 volume 0.86100E+00 ppm1 8.580 ppm2 1.763 ASSI { 8720} (segid " " and resid "93 " and name "HN ") (segid " " and resid "93 " and name "HB2 ") 3.300 3.300 0.000 peak 8720 weight 0.10000E+01 volume 0.15260E+01 ppm1 8.570 ppm2 1.655 ASSI { 8721} (segid " " and resid "93 " and name "HN ") (segid " " and resid "93 " and name "HG1 ") 5.000 5.000 0.000 peak 8721 weight 0.10000E+01 volume 0.13720E+01 ppm1 8.577 ppm2 1.090 ASSI { 8722} (segid " " and resid "93 " and name "HN ") (segid " " and resid "93 " and name "HG2 ") 5.000 5.000 0.000 peak 8722 weight 0.10000E+01 volume 0.72500E+00 ppm1 8.572 ppm2 0.612 ASSI { 8723} (segid " " and resid "93 " and name "HN ") (segid " " and resid "94 " and name "HN ") 5.000 5.000 0.000 peak 8723 weight 0.10000E+01 volume 0.92900E+00 ppm1 8.577 ppm2 7.371 ASSI { 8730} (segid " " and resid "94 " and name "HN ") (segid " " and resid "93 " and name "HB1 ") 5.000 5.000 0.000 peak 8730 weight 0.10000E+01 volume 0.10080E+01 ppm1 7.381 ppm2 1.757 ASSI { 8731} (segid " " and resid "94 " and name "HN ") (segid " " and resid "93 " and name "HB2 ") 5.000 5.000 0.000 peak 8731 weight 0.10000E+01 volume 0.11220E+01 ppm1 7.383 ppm2 1.663 ASSI { 8732} (segid " " and resid "94 " and name "HN ") (segid " " and resid "93 " and name "HG1 ") 5.000 5.000 0.000 peak 8732 weight 0.10000E+01 volume 0.52700E+00 ppm1 7.387 ppm2 1.087 ASSI { 8733} (segid " " and resid "94 " and name "HN ") (segid " " and resid "93 " and name "HG2 ") 6.000 6.000 0.000 peak 8733 weight 0.10000E+01 volume 0.14500E+00 ppm1 7.388 ppm2 0.613 ASSI { 8736} (segid " " and resid "94 " and name "HN ") (segid " " and resid "94 " and name "HA ") 5.000 5.000 0.000 peak 8736 weight 0.10000E+01 volume 0.89800E+00 ppm1 7.386 ppm2 4.034 ASSI { 8737} (segid " " and resid "94 " and name "HN ") (segid " " and resid "94 " and name "HG12") 3.300 3.300 0.000 peak 8737 weight 0.10000E+01 volume 0.20570E+01 ppm1 7.381 ppm2 1.183 OR { 8737} (segid " " and resid "94 " and name "HN ") (segid " " and resid "94 " and name "HG11") OR { 8737} (segid " " and resid "94 " and name "HN ") (segid " " and resid "94 " and name "HG13") ASSI { 8738} (segid " " and resid "94 " and name "HN ") (segid " " and resid "94 " and name "HG22") 5.000 5.000 0.000 peak 8738 weight 0.10000E+01 volume 0.96000E+00 ppm1 7.379 ppm2 0.963 OR { 8738} (segid " " and resid "94 " and name "HN ") (segid " " and resid "94 " and name "HG23") OR { 8738} (segid " " and resid "94 " and name "HN ") (segid " " and resid "94 " and name "HG21") ASSI { 8739} (segid " " and resid "94 " and name "HN ") (segid " " and resid "95 " and name "HN ") 5.000 5.000 0.000 peak 8739 weight 0.10000E+01 volume 0.99600E+00 ppm1 7.386 ppm2 8.081 ASSI { 8741} (segid " " and resid "95 " and name "HN ") (segid " " and resid "92 " and name "HA ") 5.000 5.000 0.000 peak 8741 weight 0.10000E+01 volume 0.10240E+01 ppm1 8.081 ppm2 3.890 ASSI { 8742} (segid " " and resid "95 " and name "HN ") (segid " " and resid "94 " and name "HA ") 5.000 5.000 0.000 peak 8742 weight 0.10000E+01 volume 0.69500E+00 ppm1 8.081 ppm2 4.057 ASSI { 8744} (segid " " and resid "95 " and name "HN ") (segid " " and resid "95 " and name "HA ") 5.000 5.000 0.000 peak 8744 weight 0.10000E+01 volume 0.10920E+01 ppm1 8.081 ppm2 3.918 ASSI { 8745} (segid " " and resid "95 " and name "HN ") (segid " " and resid "95 " and name "HB2 ") 3.300 3.300 0.000 peak 8745 weight 0.10000E+01 volume 0.21410E+01 ppm1 8.080 ppm2 1.154 ASSI { 8746} (segid " " and resid "95 " and name "HN ") (segid " " and resid "95 " and name "HG ") 3.300 3.300 0.000 peak 8746 weight 0.10000E+01 volume 0.17490E+01 ppm1 8.079 ppm2 1.739 ASSI { 8747} (segid " " and resid "95 " and name "HN ") (segid " " and resid "96 " and name "HN ") 5.000 5.000 0.000 peak 8747 weight 0.10000E+01 volume 0.11730E+01 ppm1 8.083 ppm2 8.461 ASSI { 8753} (segid " " and resid "96 " and name "HN ") (segid " " and resid "95 " and name "HD11") 5.000 5.000 0.000 peak 8753 weight 0.10000E+01 volume 0.30700E+00 ppm1 8.467 ppm2 0.762 OR { 8753} (segid " " and resid "96 " and name "HN ") (segid " " and resid "95 " and name "HD13") OR { 8753} (segid " " and resid "96 " and name "HN ") (segid " " and resid "95 " and name "HD12") ASSI { 8754} (segid " " and resid "96 " and name "HN ") (segid " " and resid "95 " and name "HG ") 6.000 6.000 0.000 peak 8754 weight 0.10000E+01 volume 0.22300E+00 ppm1 8.462 ppm2 1.731 ASSI { 8757} (segid " " and resid "96 " and name "HN ") (segid " " and resid "96 " and name "HA ") 5.000 5.000 0.000 peak 8757 weight 0.10000E+01 volume 0.10480E+01 ppm1 8.463 ppm2 3.753 ASSI { 8758} (segid " " and resid "96 " and name "HN ") (segid " " and resid "96 " and name "HB ") 3.300 3.300 0.000 peak 8758 weight 0.10000E+01 volume 0.23980E+01 ppm1 8.464 ppm2 2.330 ASSI { 8759} (segid " " and resid "96 " and name "HN ") (segid " " and resid "97 " and name "HN ") 5.000 5.000 0.000 peak 8759 weight 0.10000E+01 volume 0.66300E+00 ppm1 8.465 ppm2 8.805 ASSI { 8761} (segid " " and resid "97 " and name "HN ") (segid " " and resid "94 " and name "HA ") 5.000 5.000 0.000 peak 8761 weight 0.10000E+01 volume 0.12010E+01 ppm1 8.807 ppm2 4.042 ASSI { 8764} (segid " " and resid "97 " and name "HN ") (segid " " and resid "97 " and name "HA ") 5.000 5.000 0.000 peak 8764 weight 0.10000E+01 volume 0.13540E+01 ppm1 8.806 ppm2 4.111 ASSI { 8765} (segid " " and resid "97 " and name "HN ") (segid " " and resid "97 " and name "HB1 ") 3.300 3.300 0.000 peak 8765 weight 0.10000E+01 volume 0.22910E+01 ppm1 8.803 ppm2 2.263 ASSI { 8766} (segid " " and resid "97 " and name "HN ") (segid " " and resid "97 " and name "HB2 ") 5.000 5.000 0.000 peak 8766 weight 0.10000E+01 volume 0.11250E+01 ppm1 8.807 ppm2 2.019 ASSI { 8767} (segid " " and resid "97 " and name "HN ") (segid " " and resid "97 " and name "HG1 ") 3.300 3.300 0.000 peak 8767 weight 0.10000E+01 volume 0.16780E+01 ppm1 8.804 ppm2 2.393 ASSI { 8768} (segid " " and resid "97 " and name "HN ") (segid " " and resid "98 " and name "HN ") 5.000 5.000 0.000 peak 8768 weight 0.10000E+01 volume 0.89300E+00 ppm1 8.806 ppm2 7.463 ASSI { 8773} (segid " " and resid "98 " and name "HN ") (segid " " and resid "97 " and name "HA ") 5.000 5.000 0.000 peak 8773 weight 0.10000E+01 volume 0.50800E+00 ppm1 7.464 ppm2 4.117 ASSI { 8774} (segid " " and resid "98 " and name "HN ") (segid " " and resid "97 " and name "HB1 ") 5.000 5.000 0.000 peak 8774 weight 0.10000E+01 volume 0.31400E+00 ppm1 7.456 ppm2 2.270 ASSI { 8775} (segid " " and resid "98 " and name "HN ") (segid " " and resid "97 " and name "HB2 ") 5.000 5.000 0.000 peak 8775 weight 0.10000E+01 volume 0.37900E+00 ppm1 7.460 ppm2 2.012 ASSI { 8777} (segid " " and resid "98 " and name "HN ") (segid " " and resid "98 " and name "HA ") 5.000 5.000 0.000 peak 8777 weight 0.10000E+01 volume 0.55400E+00 ppm1 7.462 ppm2 4.588 ASSI { 8778} (segid " " and resid "98 " and name "HN ") (segid " " and resid "98 " and name "HB1 ") 5.000 5.000 0.000 peak 8778 weight 0.10000E+01 volume 0.14750E+01 ppm1 7.463 ppm2 3.712 ASSI { 8779} (segid " " and resid "98 " and name "HN ") (segid " " and resid "98 " and name "HB2 ") 5.000 5.000 0.000 peak 8779 weight 0.10000E+01 volume 0.12110E+01 ppm1 7.460 ppm2 2.848 ASSI { 8780} (segid " " and resid "98 " and name "HN ") (segid " " and resid "98 " and name "HD2 ") 6.000 6.000 0.000 peak 8780 weight 0.10000E+01 volume 0.11700E+00 ppm1 7.463 ppm2 7.081 ASSI { 8781} (segid " " and resid "98 " and name "HN ") (segid " " and resid "99 " and name "HN ") 5.000 5.000 0.000 peak 8781 weight 0.10000E+01 volume 0.12070E+01 ppm1 7.462 ppm2 7.637 ASSI { 8785} (segid " " and resid "99 " and name "HN ") (segid " " and resid "98 " and name "HA ") 5.000 5.000 0.000 peak 8785 weight 0.10000E+01 volume -0.64200E+00 ppm1 7.634 ppm2 4.592 ASSI { 8787} (segid " " and resid "99 " and name "HN ") (segid " " and resid "99 " and name "HA1 ") 3.300 3.300 0.000 peak 8787 weight 0.10000E+01 volume -0.17650E+01 ppm1 7.634 ppm2 4.352 ASSI { 8788} (segid " " and resid "99 " and name "HN ") (segid " " and resid "99 " and name "HA2 ") 2.700 2.700 0.000 peak 8788 weight 0.10000E+01 volume -0.36030E+01 ppm1 7.625 ppm2 3.850 ASSI { 8789} (segid " " and resid "99 " and name "HN ") (segid " " and resid "100 " and name "HN ") 5.000 5.000 0.000 peak 8789 weight 0.10000E+01 volume -0.13170E+01 ppm1 7.634 ppm2 8.248 ASSI { 8793} (segid " " and resid "100 " and name "HN ") (segid " " and resid "100 " and name "HA ") 5.000 5.000 0.000 peak 8793 weight 0.10000E+01 volume 0.79300E+00 ppm1 8.263 ppm2 4.224 ASSI { 8794} (segid " " and resid "100 " and name "HN ") (segid " " and resid "100 " and name "HB2 ") 2.700 2.700 0.000 peak 8794 weight 0.10000E+01 volume 0.31910E+01 ppm1 8.261 ppm2 1.123 OR { 8794} (segid " " and resid "100 " and name "HN ") (segid " " and resid "100 " and name "HB3 ") OR { 8794} (segid " " and resid "100 " and name "HN ") (segid " " and resid "100 " and name "HB1 ") ASSI { 8795} (segid " " and resid "100 " and name "HN ") (segid " " and resid "101 " and name "HN ") 6.000 6.000 0.000 peak 8795 weight 0.10000E+01 volume 0.11500E+00 ppm1 8.258 ppm2 8.964 ASSI { 8799} (segid " " and resid "101 " and name "HN ") (segid " " and resid "100 " and name "HA ") 3.300 3.300 0.000 peak 8799 weight 0.10000E+01 volume 0.20140E+01 ppm1 8.967 ppm2 4.219 ASSI { 8800} (segid " " and resid "101 " and name "HN ") (segid " " and resid "100 " and name "HB2 ") 5.000 5.000 0.000 peak 8800 weight 0.10000E+01 volume 0.60100E+00 ppm1 8.964 ppm2 1.121 OR { 8800} (segid " " and resid "101 " and name "HN ") (segid " " and resid "100 " and name "HB1 ") OR { 8800} (segid " " and resid "101 " and name "HN ") (segid " " and resid "100 " and name "HB3 ") ASSI { 8802} (segid " " and resid "101 " and name "HN ") (segid " " and resid "101 " and name "HA ") 5.000 5.000 0.000 peak 8802 weight 0.10000E+01 volume 0.36800E+00 ppm1 8.963 ppm2 4.639 ASSI { 8803} (segid " " and resid "101 " and name "HN ") (segid " " and resid "101 " and name "HB1 ") 5.000 5.000 0.000 peak 8803 weight 0.10000E+01 volume 0.12430E+01 ppm1 8.964 ppm2 2.780 ASSI { 8804} (segid " " and resid "101 " and name "HN ") (segid " " and resid "101 " and name "HB2 ") 5.000 5.000 0.000 peak 8804 weight 0.10000E+01 volume 0.12390E+01 ppm1 8.966 ppm2 2.660 ASSI { 8806} (segid " " and resid "102 " and name "HN ") (segid " " and resid "101 " and name "HA ") 2.700 2.700 0.000 peak 8806 weight 0.10000E+01 volume 0.31380E+01 ppm1 8.505 ppm2 4.650 ASSI { 8807} (segid " " and resid "102 " and name "HN ") (segid " " and resid "101 " and name "HB1 ") 6.000 6.000 0.000 peak 8807 weight 0.10000E+01 volume 0.13600E+00 ppm1 8.511 ppm2 2.782 ASSI { 8808} (segid " " and resid "102 " and name "HN ") (segid " " and resid "101 " and name "HB2 ") 5.000 5.000 0.000 peak 8808 weight 0.10000E+01 volume 0.32200E+00 ppm1 8.508 ppm2 2.646 ASSI { 8811} (segid " " and resid "102 " and name "HN ") (segid " " and resid "102 " and name "HA ") 5.000 5.000 0.000 peak 8811 weight 0.10000E+01 volume 0.54500E+00 ppm1 8.506 ppm2 3.879 ASSI { 8812} (segid " " and resid "102 " and name "HN ") (segid " " and resid "102 " and name "HB ") 5.000 5.000 0.000 peak 8812 weight 0.10000E+01 volume 0.50500E+00 ppm1 8.502 ppm2 2.198 ASSI { 8816} (segid " " and resid "103 " and name "HN ") (segid " " and resid "102 " and name "HA ") 5.000 5.000 0.000 peak 8816 weight 0.10000E+01 volume 0.47800E+00 ppm1 8.550 ppm2 3.880 ASSI { 8817} (segid " " and resid "103 " and name "HN ") (segid " " and resid "103 " and name "HA ") 5.000 5.000 0.000 peak 8817 weight 0.10000E+01 volume 0.65900E+00 ppm1 8.546 ppm2 5.340 ASSI { 8818} (segid " " and resid "103 " and name "HN ") (segid " " and resid "103 " and name "HB1 ") 5.000 5.000 0.000 peak 8818 weight 0.10000E+01 volume 0.76700E+00 ppm1 8.547 ppm2 2.942 ASSI { 8819} (segid " " and resid "103 " and name "HN ") (segid " " and resid "103 " and name "HB2 ") 5.000 5.000 0.000 peak 8819 weight 0.10000E+01 volume 0.12950E+01 ppm1 8.544 ppm2 2.574 ASSI { 8820} (segid " " and resid "103 " and name "HN ") (segid " " and resid "103 " and name "HD21") 6.000 6.000 0.000 peak 8820 weight 0.10000E+01 volume 0.12300E+00 ppm1 8.543 ppm2 7.549 ASSI { 8821} (segid " " and resid "103 " and name "HN ") (segid " " and resid "103 " and name "HD22") 6.000 6.000 0.000 peak 8821 weight 0.10000E+01 volume 0.10300E+00 ppm1 8.547 ppm2 6.753 ASSI { 8822} (segid " " and resid "103 " and name "HN ") (segid " " and resid "104 " and name "HN ") 3.300 3.300 0.000 peak 8822 weight 0.10000E+01 volume 0.15120E+01 ppm1 8.546 ppm2 6.326 ASSI { 8830} (segid " " and resid "103 " and name "HD22") (segid " " and resid "103 " and name "HB1 ") 5.000 5.000 0.000 peak 8830 weight 0.10000E+01 volume 0.30600E+00 ppm1 6.762 ppm2 2.960 ASSI { 8831} (segid " " and resid "103 " and name "HD22") (segid " " and resid "103 " and name "HB2 ") 5.000 5.000 0.000 peak 8831 weight 0.10000E+01 volume 0.56100E+00 ppm1 6.757 ppm2 2.587 ASSI { 8836} (segid " " and resid "104 " and name "HN ") (segid " " and resid "103 " and name "HA ") 5.000 5.000 0.000 peak 8836 weight 0.10000E+01 volume 0.63700E+00 ppm1 6.335 ppm2 5.341 ASSI { 8837} (segid " " and resid "104 " and name "HN ") (segid " " and resid "103 " and name "HB2 ") 6.000 6.000 0.000 peak 8837 weight 0.10000E+01 volume 0.12900E+00 ppm1 6.326 ppm2 2.581 ASSI { 8839} (segid " " and resid "104 " and name "HN ") (segid " " and resid "104 " and name "HA ") 5.000 5.000 0.000 peak 8839 weight 0.10000E+01 volume 0.82800E+00 ppm1 6.326 ppm2 4.154 ASSI { 8840} (segid " " and resid "104 " and name "HN ") (segid " " and resid "104 " and name "HB2 ") 2.700 2.700 0.000 peak 8840 weight 0.10000E+01 volume 0.32280E+01 ppm1 6.327 ppm2 1.330 OR { 8840} (segid " " and resid "104 " and name "HN ") (segid " " and resid "104 " and name "HB1 ") OR { 8840} (segid " " and resid "104 " and name "HN ") (segid " " and resid "104 " and name "HB3 ") ASSI { 8842} (segid " " and resid "105 " and name "HN ") (segid " " and resid "104 " and name "HA ") 2.700 2.700 0.000 peak 8842 weight 0.10000E+01 volume 0.46760E+01 ppm1 8.239 ppm2 4.145 ASSI { 8843} (segid " " and resid "105 " and name "HN ") (segid " " and resid "104 " and name "HB3 ") 3.300 3.300 0.000 peak 8843 weight 0.10000E+01 volume 0.25310E+01 ppm1 8.243 ppm2 1.327 OR { 8843} (segid " " and resid "105 " and name "HN ") (segid " " and resid "104 " and name "HB2 ") OR { 8843} (segid " " and resid "105 " and name "HN ") (segid " " and resid "104 " and name "HB1 ") ASSI { 8844} (segid " " and resid "105 " and name "HN ") (segid " " and resid "104 " and name "HN ") 6.000 6.000 0.000 peak 8844 weight 0.10000E+01 volume 0.15000E+00 ppm1 8.232 ppm2 6.328 ASSI { 8845} (segid " " and resid "105 " and name "HN ") (segid " " and resid "105 " and name "HA ") 5.000 5.000 0.000 peak 8845 weight 0.10000E+01 volume 0.55100E+00 ppm1 8.237 ppm2 4.937 ASSI { 8846} (segid " " and resid "105 " and name "HN ") (segid " " and resid "105 " and name "HB1 ") 5.000 5.000 0.000 peak 8846 weight 0.10000E+01 volume 0.13790E+01 ppm1 8.243 ppm2 1.821 ASSI { 8847} (segid " " and resid "105 " and name "HN ") (segid " " and resid "105 " and name "HD12") 5.000 5.000 0.000 peak 8847 weight 0.10000E+01 volume 0.44500E+00 ppm1 8.235 ppm2 0.833 OR { 8847} (segid " " and resid "105 " and name "HN ") (segid " " and resid "105 " and name "HD11") OR { 8847} (segid " " and resid "105 " and name "HN ") (segid " " and resid "105 " and name "HD13") ASSI { 8848} (segid " " and resid "105 " and name "HN ") (segid " " and resid "105 " and name "HD21") 5.000 5.000 0.000 peak 8848 weight 0.10000E+01 volume 0.42200E+00 ppm1 8.238 ppm2 0.385 OR { 8848} (segid " " and resid "105 " and name "HN ") (segid " " and resid "105 " and name "HD23") OR { 8848} (segid " " and resid "105 " and name "HN ") (segid " " and resid "105 " and name "HD22") ASSI { 8849} (segid " " and resid "105 " and name "HN ") (segid " " and resid "105 " and name "HG ") 3.300 3.300 0.000 peak 8849 weight 0.10000E+01 volume 0.17290E+01 ppm1 8.243 ppm2 1.660 ASSI { 8851} (segid " " and resid "106 " and name "HN ") (segid " " and resid "81 " and name "HE2 ") 5.000 5.000 0.000 peak 8851 weight 0.10000E+01 volume 0.44100E+00 ppm1 7.642 ppm2 11.101 ASSI { 8852} (segid " " and resid "106 " and name "HN ") (segid " " and resid "105 " and name "HB1 ") 5.000 5.000 0.000 peak 8852 weight 0.10000E+01 volume 0.36600E+00 ppm1 7.648 ppm2 1.817 ASSI { 8853} (segid " " and resid "106 " and name "HN ") (segid " " and resid "105 " and name "HB2 ") 5.000 5.000 0.000 peak 8853 weight 0.10000E+01 volume 0.10630E+01 ppm1 7.640 ppm2 1.282 ASSI { 8854} (segid " " and resid "106 " and name "HN ") (segid " " and resid "105 " and name "HD21") 5.000 5.000 0.000 peak 8854 weight 0.10000E+01 volume 0.48200E+00 ppm1 7.647 ppm2 0.377 OR { 8854} (segid " " and resid "106 " and name "HN ") (segid " " and resid "105 " and name "HD23") OR { 8854} (segid " " and resid "106 " and name "HN ") (segid " " and resid "105 " and name "HD22") ASSI { 8855} (segid " " and resid "106 " and name "HN ") (segid " " and resid "105 " and name "HG ") 6.000 6.000 0.000 peak 8855 weight 0.10000E+01 volume 0.24700E+00 ppm1 7.649 ppm2 1.682 ASSI { 8856} (segid " " and resid "106 " and name "HN ") (segid " " and resid "106 " and name "HA ") 2.700 2.700 0.000 peak 8856 weight 0.10000E+01 volume 0.32990E+01 ppm1 7.646 ppm2 4.935 ASSI { 8857} (segid " " and resid "106 " and name "HN ") (segid " " and resid "106 " and name "HB1 ") 6.000 6.000 0.000 peak 8857 weight 0.10000E+01 volume 0.26300E+00 ppm1 7.639 ppm2 2.888 ASSI { 8858} (segid " " and resid "106 " and name "HN ") (segid " " and resid "106 " and name "HB2 ") 5.000 5.000 0.000 peak 8858 weight 0.10000E+01 volume 0.11230E+01 ppm1 7.644 ppm2 1.363 ASSI { 8859} (segid " " and resid "106 " and name "HN ") (segid " " and resid "110 " and name "HN ") 5.000 5.000 0.000 peak 8859 weight 0.10000E+01 volume 0.80700E+00 ppm1 7.645 ppm2 8.005 ASSI { 8862} (segid " " and resid "107 " and name "HN ") (segid " " and resid "106 " and name "HA ") 5.000 5.000 0.000 peak 8862 weight 0.10000E+01 volume 0.79000E+00 ppm1 8.185 ppm2 4.907 ASSI { 8863} (segid " " and resid "107 " and name "HN ") (segid " " and resid "106 " and name "HB1 ") 5.000 5.000 0.000 peak 8863 weight 0.10000E+01 volume 0.13270E+01 ppm1 8.189 ppm2 2.889 ASSI { 8864} (segid " " and resid "107 " and name "HN ") (segid " " and resid "106 " and name "HB2 ") 5.000 5.000 0.000 peak 8864 weight 0.10000E+01 volume 0.86600E+00 ppm1 8.192 ppm2 1.361 ASSI { 8866} (segid " " and resid "107 " and name "HN ") (segid " " and resid "107 " and name "HA ") 5.000 5.000 0.000 peak 8866 weight 0.10000E+01 volume 0.10550E+01 ppm1 8.190 ppm2 4.289 ASSI { 8867} (segid " " and resid "107 " and name "HN ") (segid " " and resid "107 " and name "HB2 ") 5.000 5.000 0.000 peak 8867 weight 0.10000E+01 volume 0.14110E+01 ppm1 8.184 ppm2 4.042 OR { 8867} (segid " " and resid "107 " and name "HN ") (segid " " and resid "107 " and name "HB1 ") ASSI { 8868} (segid " " and resid "107 " and name "HN ") (segid " " and resid "108 " and name "HN ") 5.000 5.000 0.000 peak 8868 weight 0.10000E+01 volume 0.73700E+00 ppm1 8.181 ppm2 8.478 ASSI { 8875} (segid " " and resid "108 " and name "HN ") (segid " " and resid "108 " and name "HA ") 5.000 5.000 0.000 peak 8875 weight 0.10000E+01 volume 0.87700E+00 ppm1 8.480 ppm2 4.614 ASSI { 8876} (segid " " and resid "108 " and name "HN ") (segid " " and resid "108 " and name "HG23") 5.000 5.000 0.000 peak 8876 weight 0.10000E+01 volume 0.11050E+01 ppm1 8.477 ppm2 1.151 OR { 8876} (segid " " and resid "108 " and name "HN ") (segid " " and resid "108 " and name "HG21") OR { 8876} (segid " " and resid "108 " and name "HN ") (segid " " and resid "108 " and name "HG22") ASSI { 8877} (segid " " and resid "108 " and name "HN ") (segid " " and resid "110 " and name "HN ") 5.000 5.000 0.000 peak 8877 weight 0.10000E+01 volume 0.34800E+00 ppm1 8.478 ppm2 7.998 ASSI { 8884} (segid " " and resid "109 " and name "HN ") (segid " " and resid "105 " and name "HD21") 6.000 6.000 0.000 peak 8884 weight 0.10000E+01 volume 0.95000E-01 ppm1 8.503 ppm2 0.388 OR { 8884} (segid " " and resid "109 " and name "HN ") (segid " " and resid "105 " and name "HD23") OR { 8884} (segid " " and resid "109 " and name "HN ") (segid " " and resid "105 " and name "HD22") ASSI { 8885} (segid " " and resid "109 " and name "HN ") (segid " " and resid "108 " and name "HA ") 5.000 5.000 0.000 peak 8885 weight 0.10000E+01 volume 0.47500E+00 ppm1 8.511 ppm2 4.608 ASSI { 8886} (segid " " and resid "109 " and name "HN ") (segid " " and resid "108 " and name "HG21") 6.000 6.000 0.000 peak 8886 weight 0.10000E+01 volume 0.16700E+00 ppm1 8.514 ppm2 1.157 OR { 8886} (segid " " and resid "109 " and name "HN ") (segid " " and resid "108 " and name "HG23") OR { 8886} (segid " " and resid "109 " and name "HN ") (segid " " and resid "108 " and name "HG22") ASSI { 8887} (segid " " and resid "109 " and name "HN ") (segid " " and resid "109 " and name "HA1 ") 3.300 3.300 0.000 peak 8887 weight 0.10000E+01 volume 0.15040E+01 ppm1 8.511 ppm2 4.309 ASSI { 8888} (segid " " and resid "109 " and name "HN ") (segid " " and resid "109 " and name "HA2 ") 3.300 3.300 0.000 peak 8888 weight 0.10000E+01 volume 0.15670E+01 ppm1 8.506 ppm2 3.810 ASSI { 8889} (segid " " and resid "109 " and name "HN ") (segid " " and resid "110 " and name "HN ") 5.000 5.000 0.000 peak 8889 weight 0.10000E+01 volume 0.98500E+00 ppm1 8.511 ppm2 8.004 ASSI { 8896} (segid " " and resid "110 " and name "HN ") (segid " " and resid "109 " and name "HA1 ") 6.000 6.000 0.000 peak 8896 weight 0.10000E+01 volume 0.26900E+00 ppm1 8.006 ppm2 4.322 ASSI { 8897} (segid " " and resid "110 " and name "HN ") (segid " " and resid "111 " and name "HN ") 6.000 6.000 0.000 peak 8897 weight 0.10000E+01 volume 0.13700E+00 ppm1 8.010 ppm2 9.455 ASSI { 8899} (segid " " and resid "111 " and name "HN ") (segid " " and resid "110 " and name "HB2 ") 5.000 5.000 0.000 peak 8899 weight 0.10000E+01 volume 0.32200E+00 ppm1 9.447 ppm2 3.712 ASSI { 8900} (segid " " and resid "111 " and name "HN ") (segid " " and resid "111 " and name "HA ") 6.000 6.000 0.000 peak 8900 weight 0.10000E+01 volume 0.25200E+00 ppm1 9.446 ppm2 5.268 ASSI { 8901} (segid " " and resid "111 " and name "HN ") (segid " " and resid "111 " and name "HB1 ") 5.000 5.000 0.000 peak 8901 weight 0.10000E+01 volume 0.37100E+00 ppm1 9.444 ppm2 2.431 ASSI { 8902} (segid " " and resid "111 " and name "HN ") (segid " " and resid "111 " and name "HB2 ") 5.000 5.000 0.000 peak 8902 weight 0.10000E+01 volume 0.79600E+00 ppm1 9.450 ppm2 2.014 ASSI { 8903} (segid " " and resid "111 " and name "HN ") (segid " " and resid "111 " and name "HD11") 6.000 6.000 0.000 peak 8903 weight 0.10000E+01 volume 0.19900E+00 ppm1 9.449 ppm2 1.183 OR { 8903} (segid " " and resid "111 " and name "HN ") (segid " " and resid "111 " and name "HD12") OR { 8903} (segid " " and resid "111 " and name "HN ") (segid " " and resid "111 " and name "HD13") ASSI { 8904} (segid " " and resid "111 " and name "HN ") (segid " " and resid "111 " and name "HD22") 6.000 6.000 0.000 peak 8904 weight 0.10000E+01 volume 0.26100E+00 ppm1 9.448 ppm2 0.988 OR { 8904} (segid " " and resid "111 " and name "HN ") (segid " " and resid "111 " and name "HD23") OR { 8904} (segid " " and resid "111 " and name "HN ") (segid " " and resid "111 " and name "HD21") ASSI { 8905} (segid " " and resid "111 " and name "HN ") (segid " " and resid "111 " and name "HG ") 5.000 5.000 0.000 peak 8905 weight 0.10000E+01 volume 0.83100E+00 ppm1 9.449 ppm2 1.950 ASSI { 8914} (segid " " and resid "113 " and name "HN ") (segid " " and resid "112 " and name "HB1 ") 5.000 5.000 0.000 peak 8914 weight 0.10000E+01 volume 0.10510E+01 ppm1 8.274 ppm2 1.995 ASSI { 8915} (segid " " and resid "113 " and name "HN ") (segid " " and resid "113 " and name "HA ") 5.000 5.000 0.000 peak 8915 weight 0.10000E+01 volume 0.47200E+00 ppm1 8.274 ppm2 3.837 ASSI { 8916} (segid " " and resid "113 " and name "HN ") (segid " " and resid "113 " and name "HB ") 5.000 5.000 0.000 peak 8916 weight 0.10000E+01 volume 0.10540E+01 ppm1 8.279 ppm2 1.727 ASSI { 8917} (segid " " and resid "113 " and name "HN ") (segid " " and resid "113 " and name "HG11") 6.000 6.000 0.000 peak 8917 weight 0.10000E+01 volume 0.26900E+00 ppm1 8.276 ppm2 1.448 ASSI { 8918} (segid " " and resid "113 " and name "HN ") (segid " " and resid "113 " and name "HG12") 6.000 6.000 0.000 peak 8918 weight 0.10000E+01 volume 0.20300E+00 ppm1 8.286 ppm2 1.333 ASSI { 8919} (segid " " and resid "113 " and name "HN ") (segid " " and resid "113 " and name "HG21") 3.300 3.300 0.000 peak 8919 weight 0.10000E+01 volume 0.19050E+01 ppm1 8.277 ppm2 0.732 OR { 8919} (segid " " and resid "113 " and name "HN ") (segid " " and resid "113 " and name "HG22") OR { 8919} (segid " " and resid "113 " and name "HN ") (segid " " and resid "113 " and name "HG23") ASSI { 8932} (segid " " and resid "114 " and name "HN ") (segid " " and resid "113 " and name "HA ") 5.000 5.000 0.000 peak 8932 weight 0.10000E+01 volume 0.34400E+00 ppm1 7.664 ppm2 3.835 ASSI { 8933} (segid " " and resid "114 " and name "HN ") (segid " " and resid "113 " and name "HG23") 5.000 5.000 0.000 peak 8933 weight 0.10000E+01 volume 0.12240E+01 ppm1 7.666 ppm2 0.743 OR { 8933} (segid " " and resid "114 " and name "HN ") (segid " " and resid "113 " and name "HG22") OR { 8933} (segid " " and resid "114 " and name "HN ") (segid " " and resid "113 " and name "HG21") ASSI { 8934} (segid " " and resid "114 " and name "HN ") (segid " " and resid "113 " and name "HN ") 5.000 5.000 0.000 peak 8934 weight 0.10000E+01 volume 0.50100E+00 ppm1 7.669 ppm2 8.270 ASSI { 8935} (segid " " and resid "114 " and name "HN ") (segid " " and resid "114 " and name "HA ") 5.000 5.000 0.000 peak 8935 weight 0.10000E+01 volume 0.83000E+00 ppm1 7.665 ppm2 3.973 ASSI { 8936} (segid " " and resid "114 " and name "HN ") (segid " " and resid "114 " and name "HB1 ") 5.000 5.000 0.000 peak 8936 weight 0.10000E+01 volume 0.10640E+01 ppm1 7.670 ppm2 3.660 ASSI { 8937} (segid " " and resid "114 " and name "HN ") (segid " " and resid "114 " and name "HB2 ") 5.000 5.000 0.000 peak 8937 weight 0.10000E+01 volume 0.59900E+00 ppm1 7.666 ppm2 3.506 ASSI { 8938} (segid " " and resid "114 " and name "HN ") (segid " " and resid "115 " and name "HN ") 5.000 5.000 0.000 peak 8938 weight 0.10000E+01 volume 0.89200E+00 ppm1 7.669 ppm2 7.298 ASSI { 8940} (segid " " and resid "115 " and name "HN ") (segid " " and resid "114 " and name "HA ") 5.000 5.000 0.000 peak 8940 weight 0.10000E+01 volume 0.37200E+00 ppm1 7.309 ppm2 3.958 ASSI { 8941} (segid " " and resid "115 " and name "HN ") (segid " " and resid "114 " and name "HB1 ") 5.000 5.000 0.000 peak 8941 weight 0.10000E+01 volume 0.47500E+00 ppm1 7.306 ppm2 3.651 ASSI { 8942} (segid " " and resid "115 " and name "HN ") (segid " " and resid "114 " and name "HB2 ") 6.000 6.000 0.000 peak 8942 weight 0.10000E+01 volume 0.23700E+00 ppm1 7.314 ppm2 3.501 ASSI { 8944} (segid " " and resid "115 " and name "HN ") (segid " " and resid "115 " and name "HA ") 5.000 5.000 0.000 peak 8944 weight 0.10000E+01 volume 0.69100E+00 ppm1 7.309 ppm2 4.088 ASSI { 8945} (segid " " and resid "115 " and name "HN ") (segid " " and resid "115 " and name "HB1 ") 5.000 5.000 0.000 peak 8945 weight 0.10000E+01 volume 0.74700E+00 ppm1 7.305 ppm2 2.210 ASSI { 8946} (segid " " and resid "115 " and name "HN ") (segid " " and resid "115 " and name "HB2 ") 5.000 5.000 0.000 peak 8946 weight 0.10000E+01 volume 0.51000E+00 ppm1 7.311 ppm2 1.398 ASSI { 8947} (segid " " and resid "115 " and name "HN ") (segid " " and resid "115 " and name "HD13") 5.000 5.000 0.000 peak 8947 weight 0.10000E+01 volume 0.52400E+00 ppm1 7.311 ppm2 1.223 OR { 8947} (segid " " and resid "115 " and name "HN ") (segid " " and resid "115 " and name "HD12") OR { 8947} (segid " " and resid "115 " and name "HN ") (segid " " and resid "115 " and name "HD11") ASSI { 8948} (segid " " and resid "115 " and name "HN ") (segid " " and resid "115 " and name "HD23") 5.000 5.000 0.000 peak 8948 weight 0.10000E+01 volume 0.46200E+00 ppm1 7.309 ppm2 0.956 OR { 8948} (segid " " and resid "115 " and name "HN ") (segid " " and resid "115 " and name "HD22") OR { 8948} (segid " " and resid "115 " and name "HN ") (segid " " and resid "115 " and name "HD21") ASSI { 8949} (segid " " and resid "115 " and name "HN ") (segid " " and resid "115 " and name "HG ") 3.300 3.300 0.000 peak 8949 weight 0.10000E+01 volume 0.17600E+01 ppm1 7.300 ppm2 2.032 ASSI { 8950} (segid " " and resid "115 " and name "HN ") (segid " " and resid "116 " and name "HN ") 5.000 5.000 0.000 peak 8950 weight 0.10000E+01 volume 0.72300E+00 ppm1 7.298 ppm2 7.904 ASSI { 8954} (segid " " and resid "116 " and name "HN ") (segid " " and resid "116 " and name "HB2 ") 2.700 2.700 0.000 peak 8954 weight 0.10000E+01 volume 0.32610E+01 ppm1 7.892 ppm2 1.488 OR { 8954} (segid " " and resid "116 " and name "HN ") (segid " " and resid "116 " and name "HB3 ") OR { 8954} (segid " " and resid "116 " and name "HN ") (segid " " and resid "116 " and name "HB1 ") ASSI { 8961} (segid " " and resid "117 " and name "HN ") (segid " " and resid "116 " and name "HB1 ") 5.000 5.000 0.000 peak 8961 weight 0.10000E+01 volume 0.10130E+01 ppm1 7.943 ppm2 1.487 OR { 8961} (segid " " and resid "117 " and name "HN ") (segid " " and resid "116 " and name "HB2 ") OR { 8961} (segid " " and resid "117 " and name "HN ") (segid " " and resid "116 " and name "HB3 ") ASSI { 8962} (segid " " and resid "117 " and name "HN ") (segid " " and resid "117 " and name "HA ") 5.000 5.000 0.000 peak 8962 weight 0.10000E+01 volume 0.67500E+00 ppm1 7.949 ppm2 3.522 ASSI { 8963} (segid " " and resid "117 " and name "HN ") (segid " " and resid "117 " and name "HB ") 2.700 2.700 0.000 peak 8963 weight 0.10000E+01 volume 0.31000E+01 ppm1 7.943 ppm2 2.058 ASSI { 8964} (segid " " and resid "117 " and name "HN ") (segid " " and resid "117 " and name "HD11") 5.000 5.000 0.000 peak 8964 weight 0.10000E+01 volume 0.14890E+01 ppm1 7.946 ppm2 0.884 OR { 8964} (segid " " and resid "117 " and name "HN ") (segid " " and resid "117 " and name "HD13") OR { 8964} (segid " " and resid "117 " and name "HN ") (segid " " and resid "117 " and name "HD12") ASSI { 8965} (segid " " and resid "117 " and name "HN ") (segid " " and resid "117 " and name "HG23") 5.000 5.000 0.000 peak 8965 weight 0.10000E+01 volume 0.14430E+01 ppm1 7.942 ppm2 0.757 OR { 8965} (segid " " and resid "117 " and name "HN ") (segid " " and resid "117 " and name "HG21") OR { 8965} (segid " " and resid "117 " and name "HN ") (segid " " and resid "117 " and name "HG22") ASSI { 8966} (segid " " and resid "117 " and name "HN ") (segid " " and resid "118 " and name "HN ") 5.000 5.000 0.000 peak 8966 weight 0.10000E+01 volume 0.12490E+01 ppm1 7.943 ppm2 8.113 ASSI { 8968} (segid " " and resid "118 " and name "HN ") (segid " " and resid "115 " and name "HA ") 3.300 3.300 0.000 peak 8968 weight 0.10000E+01 volume 0.18240E+01 ppm1 8.119 ppm2 4.044 ASSI { 8969} (segid " " and resid "118 " and name "HN ") (segid " " and resid "117 " and name "HA ") 5.000 5.000 0.000 peak 8969 weight 0.10000E+01 volume 0.35200E+00 ppm1 8.113 ppm2 3.519 ASSI { 8970} (segid " " and resid "118 " and name "HN ") (segid " " and resid "117 " and name "HG23") 3.300 3.300 0.000 peak 8970 weight 0.10000E+01 volume 0.21670E+01 ppm1 8.125 ppm2 0.778 OR { 8970} (segid " " and resid "118 " and name "HN ") (segid " " and resid "117 " and name "HG21") OR { 8970} (segid " " and resid "118 " and name "HN ") (segid " " and resid "117 " and name "HG22") ASSI { 8972} (segid " " and resid "118 " and name "HN ") (segid " " and resid "118 " and name "HA ") 5.000 5.000 0.000 peak 8972 weight 0.10000E+01 volume 0.13370E+01 ppm1 8.120 ppm2 3.678 ASSI { 8973} (segid " " and resid "118 " and name "HN ") (segid " " and resid "119 " and name "HN ") 5.000 5.000 0.000 peak 8973 weight 0.10000E+01 volume 0.95500E+00 ppm1 8.116 ppm2 7.323 ASSI { 8975} (segid " " and resid "119 " and name "HN ") (segid " " and resid "116 " and name "HA ") 6.000 6.000 0.000 peak 8975 weight 0.10000E+01 volume 0.22100E+00 ppm1 7.324 ppm2 4.138 ASSI { 8976} (segid " " and resid "119 " and name "HN ") (segid " " and resid "118 " and name "HA ") 6.000 6.000 0.000 peak 8976 weight 0.10000E+01 volume 0.29100E+00 ppm1 7.318 ppm2 3.677 ASSI { 8977} (segid " " and resid "119 " and name "HN ") (segid " " and resid "118 " and name "HG1 ") 6.000 6.000 0.000 peak 8977 weight 0.10000E+01 volume 0.27600E+00 ppm1 7.329 ppm2 1.921 ASSI { 8979} (segid " " and resid "119 " and name "HN ") (segid " " and resid "119 " and name "HA ") 5.000 5.000 0.000 peak 8979 weight 0.10000E+01 volume 0.46800E+00 ppm1 7.324 ppm2 4.261 ASSI { 8980} (segid " " and resid "119 " and name "HN ") (segid " " and resid "119 " and name "HB1 ") 3.300 3.300 0.000 peak 8980 weight 0.10000E+01 volume 0.18560E+01 ppm1 7.328 ppm2 2.053 ASSI { 8981} (segid " " and resid "119 " and name "HN ") (segid " " and resid "119 " and name "HB2 ") 5.000 5.000 0.000 peak 8981 weight 0.10000E+01 volume 0.10300E+01 ppm1 7.327 ppm2 1.546 ASSI { 8982} (segid " " and resid "119 " and name "HN ") (segid " " and resid "119 " and name "HG1 ") 5.000 5.000 0.000 peak 8982 weight 0.10000E+01 volume 0.68600E+00 ppm1 7.330 ppm2 2.961 ASSI { 8983} (segid " " and resid "119 " and name "HN ") (segid " " and resid "119 " and name "HG2 ") 5.000 5.000 0.000 peak 8983 weight 0.10000E+01 volume 0.92500E+00 ppm1 7.330 ppm2 2.404 ASSI { 8984} (segid " " and resid "119 " and name "HN ") (segid " " and resid "120 " and name "HN ") 5.000 5.000 0.000 peak 8984 weight 0.10000E+01 volume 0.92800E+00 ppm1 7.326 ppm2 7.477 ASSI { 8991} (segid " " and resid "120 " and name "HN ") (segid " " and resid "119 " and name "HA ") 6.000 6.000 0.000 peak 8991 weight 0.10000E+01 volume -0.61000E-01 ppm1 7.480 ppm2 4.259 ASSI { 8992} (segid " " and resid "120 " and name "HN ") (segid " " and resid "119 " and name "HB1 ") 5.000 5.000 0.000 peak 8992 weight 0.10000E+01 volume -0.34900E+00 ppm1 7.478 ppm2 2.057 ASSI { 8993} (segid " " and resid "120 " and name "HN ") (segid " " and resid "119 " and name "HB2 ") 6.000 6.000 0.000 peak 8993 weight 0.10000E+01 volume -0.12400E+00 ppm1 7.487 ppm2 1.549 ASSI { 8995} (segid " " and resid "120 " and name "HN ") (segid " " and resid "120 " and name "HA1 ") 5.000 5.000 0.000 peak 8995 weight 0.10000E+01 volume -0.14980E+01 ppm1 7.474 ppm2 4.031 ASSI { 8996} (segid " " and resid "120 " and name "HN ") (segid " " and resid "120 " and name "HA2 ") 3.300 3.300 0.000 peak 8996 weight 0.10000E+01 volume -0.24610E+01 ppm1 7.477 ppm2 3.538 ASSI { 8997} (segid " " and resid "120 " and name "HN ") (segid " " and resid "121 " and name "HN ") 5.000 5.000 0.000 peak 8997 weight 0.10000E+01 volume -0.13550E+01 ppm1 7.477 ppm2 7.836 ASSI { 9002} (segid " " and resid "121 " and name "HN ") (segid " " and resid "120 " and name "HA1 ") 5.000 5.000 0.000 peak 9002 weight 0.10000E+01 volume 0.78400E+00 ppm1 7.844 ppm2 4.030 ASSI { 9003} (segid " " and resid "121 " and name "HN ") (segid " " and resid "120 " and name "HA2 ") 5.000 5.000 0.000 peak 9003 weight 0.10000E+01 volume 0.83100E+00 ppm1 7.837 ppm2 3.542 ASSI { 9005} (segid " " and resid "121 " and name "HN ") (segid " " and resid "121 " and name "HA ") 5.000 5.000 0.000 peak 9005 weight 0.10000E+01 volume 0.72300E+00 ppm1 7.831 ppm2 5.232 ASSI { 9006} (segid " " and resid "121 " and name "HN ") (segid " " and resid "121 " and name "HB1 ") 5.000 5.000 0.000 peak 9006 weight 0.10000E+01 volume 0.85900E+00 ppm1 7.833 ppm2 3.151 ASSI { 9007} (segid " " and resid "121 " and name "HN ") (segid " " and resid "121 " and name "HB2 ") 3.300 3.300 0.000 peak 9007 weight 0.10000E+01 volume 0.15120E+01 ppm1 7.834 ppm2 3.018 ASSI { 9008} (segid " " and resid "121 " and name "HN ") (segid " " and resid "121 " and name "HD2 ") 5.000 5.000 0.000 peak 9008 weight 0.10000E+01 volume 0.76200E+00 ppm1 7.837 ppm2 7.282 ASSI { 9016} (segid " " and resid "124 " and name "HN ") (segid " " and resid "123 " and name "HB2 ") 6.000 6.000 0.000 peak 9016 weight 0.10000E+01 volume 0.28000E+00 ppm1 7.132 ppm2 3.993 OR { 9016} (segid " " and resid "124 " and name "HN ") (segid " " and resid "123 " and name "HB1 ") ASSI { 9017} (segid " " and resid "124 " and name "HN ") (segid " " and resid "124 " and name "HA ") 5.000 5.000 0.000 peak 9017 weight 0.10000E+01 volume 0.51200E+00 ppm1 7.135 ppm2 3.739 ASSI { 9018} (segid " " and resid "124 " and name "HN ") (segid " " and resid "124 " and name "HB ") 5.000 5.000 0.000 peak 9018 weight 0.10000E+01 volume 0.93600E+00 ppm1 7.130 ppm2 2.383 ASSI { 9019} (segid " " and resid "124 " and name "HN ") (segid " " and resid "124 " and name "HG21") 3.300 3.300 0.000 peak 9019 weight 0.10000E+01 volume 0.20280E+01 ppm1 7.132 ppm2 0.936 OR { 9019} (segid " " and resid "124 " and name "HN ") (segid " " and resid "124 " and name "HG23") OR { 9019} (segid " " and resid "124 " and name "HN ") (segid " " and resid "124 " and name "HG22") ASSI { 9021} (segid " " and resid "125 " and name "HN ") (segid " " and resid "124 " and name "HB ") 5.000 5.000 0.000 peak 9021 weight 0.10000E+01 volume 0.97700E+00 ppm1 8.132 ppm2 2.381 ASSI { 9024} (segid " " and resid "125 " and name "HN ") (segid " " and resid "125 " and name "HA ") 5.000 5.000 0.000 peak 9024 weight 0.10000E+01 volume 0.83100E+00 ppm1 8.139 ppm2 3.372 ASSI { 9025} (segid " " and resid "125 " and name "HN ") (segid " " and resid "126 " and name "HN ") 3.300 3.300 0.000 peak 9025 weight 0.10000E+01 volume 0.18150E+01 ppm1 8.127 ppm2 8.493 ASSI { 9033} (segid " " and resid "126 " and name "HN ") (segid " " and resid "125 " and name "HB ") 5.000 5.000 0.000 peak 9033 weight 0.10000E+01 volume 0.13410E+01 ppm1 8.496 ppm2 2.227 ASSI { 9035} (segid " " and resid "126 " and name "HN ") (segid " " and resid "126 " and name "HA ") 2.700 2.700 0.000 peak 9035 weight 0.10000E+01 volume 0.37150E+01 ppm1 8.497 ppm2 4.009 ASSI { 9036} (segid " " and resid "126 " and name "HN ") (segid " " and resid "127 " and name "HN ") 5.000 5.000 0.000 peak 9036 weight 0.10000E+01 volume 0.81000E+00 ppm1 8.499 ppm2 7.419 ASSI { 9040} (segid " " and resid "127 " and name "HN ") (segid " " and resid "124 " and name "HA ") 5.000 5.000 0.000 peak 9040 weight 0.10000E+01 volume 0.84500E+00 ppm1 7.423 ppm2 3.747 ASSI { 9041} (segid " " and resid "127 " and name "HN ") (segid " " and resid "126 " and name "HA ") 3.300 3.300 0.000 peak 9041 weight 0.10000E+01 volume 0.15120E+01 ppm1 7.425 ppm2 4.008 ASSI { 9042} (segid " " and resid "127 " and name "HN ") (segid " " and resid "127 " and name "HA ") 5.000 5.000 0.000 peak 9042 weight 0.10000E+01 volume 0.11220E+01 ppm1 7.424 ppm2 4.314 ASSI { 9043} (segid " " and resid "127 " and name "HN ") (segid " " and resid "127 " and name "HB1 ") 3.300 3.300 0.000 peak 9043 weight 0.10000E+01 volume 0.15460E+01 ppm1 7.423 ppm2 3.419 ASSI { 9044} (segid " " and resid "127 " and name "HN ") (segid " " and resid "127 " and name "HB2 ") 3.300 3.300 0.000 peak 9044 weight 0.10000E+01 volume 0.18030E+01 ppm1 7.425 ppm2 2.935 ASSI { 9045} (segid " " and resid "127 " and name "HN ") (segid " " and resid "127 " and name "HD1 ") 5.000 5.000 0.000 peak 9045 weight 0.10000E+01 volume 0.33800E+00 ppm1 7.423 ppm2 7.126 OR { 9045} (segid " " and resid "127 " and name "HN ") (segid " " and resid "127 " and name "HD2 ") ASSI { 9046} (segid " " and resid "127 " and name "HN ") (segid " " and resid "128 " and name "HN ") 5.000 5.000 0.000 peak 9046 weight 0.10000E+01 volume 0.11000E+01 ppm1 7.426 ppm2 8.228 ASSI { 9047} (segid " " and resid "127 " and name "HN ") (segid " " and resid "129 " and name "HN ") 5.000 5.000 0.000 peak 9047 weight 0.10000E+01 volume 0.10560E+01 ppm1 7.423 ppm2 8.292 ASSI { 9056} (segid " " and resid "128 " and name "HN ") (segid " " and resid "127 " and name "HA ") 6.000 6.000 0.000 peak 9056 weight 0.10000E+01 volume 0.18000E+00 ppm1 8.232 ppm2 4.301 ASSI { 9057} (segid " " and resid "128 " and name "HN ") (segid " " and resid "127 " and name "HB1 ") 5.000 5.000 0.000 peak 9057 weight 0.10000E+01 volume 0.68200E+00 ppm1 8.230 ppm2 3.397 ASSI { 9058} (segid " " and resid "128 " and name "HN ") (segid " " and resid "127 " and name "HB2 ") 5.000 5.000 0.000 peak 9058 weight 0.10000E+01 volume 0.56900E+00 ppm1 8.232 ppm2 2.943 ASSI { 9059} (segid " " and resid "128 " and name "HN ") (segid " " and resid "127 " and name "HD1 ") 5.000 5.000 0.000 peak 9059 weight 0.10000E+01 volume 0.37600E+00 ppm1 8.230 ppm2 7.125 OR { 9059} (segid " " and resid "128 " and name "HN ") (segid " " and resid "127 " and name "HD2 ") ASSI { 9061} (segid " " and resid "128 " and name "HN ") (segid " " and resid "128 " and name "HA ") 5.000 5.000 0.000 peak 9061 weight 0.10000E+01 volume 0.61300E+00 ppm1 8.227 ppm2 3.870 ASSI { 9062} (segid " " and resid "128 " and name "HN ") (segid " " and resid "128 " and name "HB1 ") 5.000 5.000 0.000 peak 9062 weight 0.10000E+01 volume 0.98500E+00 ppm1 8.231 ppm2 1.717 ASSI { 9063} (segid " " and resid "128 " and name "HN ") (segid " " and resid "128 " and name "HD12") 5.000 5.000 0.000 peak 9063 weight 0.10000E+01 volume 0.82000E+00 ppm1 8.229 ppm2 0.722 OR { 9063} (segid " " and resid "128 " and name "HN ") (segid " " and resid "128 " and name "HD11") OR { 9063} (segid " " and resid "128 " and name "HN ") (segid " " and resid "128 " and name "HD13") ASSI { 9064} (segid " " and resid "128 " and name "HN ") (segid " " and resid "128 " and name "HD21") 5.000 5.000 0.000 peak 9064 weight 0.10000E+01 volume 0.10670E+01 ppm1 8.234 ppm2 0.892 OR { 9064} (segid " " and resid "128 " and name "HN ") (segid " " and resid "128 " and name "HD23") OR { 9064} (segid " " and resid "128 " and name "HN ") (segid " " and resid "128 " and name "HD22") ASSI { 9065} (segid " " and resid "128 " and name "HN ") (segid " " and resid "128 " and name "HG ") 5.000 5.000 0.000 peak 9065 weight 0.10000E+01 volume 0.11060E+01 ppm1 8.229 ppm2 2.004 ASSI { 9072} (segid " " and resid "129 " and name "HN ") (segid " " and resid "126 " and name "HA ") 6.000 6.000 0.000 peak 9072 weight 0.10000E+01 volume 0.23700E+00 ppm1 8.297 ppm2 4.009 ASSI { 9073} (segid " " and resid "129 " and name "HN ") (segid " " and resid "128 " and name "HA ") 5.000 5.000 0.000 peak 9073 weight 0.10000E+01 volume 0.40100E+00 ppm1 8.297 ppm2 3.871 ASSI { 9074} (segid " " and resid "129 " and name "HN ") (segid " " and resid "128 " and name "HB1 ") 5.000 5.000 0.000 peak 9074 weight 0.10000E+01 volume 0.45800E+00 ppm1 8.298 ppm2 1.730 ASSI { 9075} (segid " " and resid "129 " and name "HN ") (segid " " and resid "128 " and name "HB2 ") 5.000 5.000 0.000 peak 9075 weight 0.10000E+01 volume 0.13950E+01 ppm1 8.294 ppm2 1.222 ASSI { 9076} (segid " " and resid "129 " and name "HN ") (segid " " and resid "128 " and name "HD12") 5.000 5.000 0.000 peak 9076 weight 0.10000E+01 volume 0.10130E+01 ppm1 8.284 ppm2 0.725 OR { 9076} (segid " " and resid "129 " and name "HN ") (segid " " and resid "128 " and name "HD11") OR { 9076} (segid " " and resid "129 " and name "HN ") (segid " " and resid "128 " and name "HD13") ASSI { 9077} (segid " " and resid "129 " and name "HN ") (segid " " and resid "128 " and name "HG ") 6.000 6.000 0.000 peak 9077 weight 0.10000E+01 volume 0.12900E+00 ppm1 8.291 ppm2 2.005 ASSI { 9078} (segid " " and resid "129 " and name "HN ") (segid " " and resid "129 " and name "HA ") 5.000 5.000 0.000 peak 9078 weight 0.10000E+01 volume 0.94100E+00 ppm1 8.290 ppm2 3.742 ASSI { 9079} (segid " " and resid "129 " and name "HN ") (segid " " and resid "129 " and name "HB3 ") 3.300 3.300 0.000 peak 9079 weight 0.10000E+01 volume 0.29590E+01 ppm1 8.291 ppm2 1.126 OR { 9079} (segid " " and resid "129 " and name "HN ") (segid " " and resid "129 " and name "HB1 ") OR { 9079} (segid " " and resid "129 " and name "HN ") (segid " " and resid "129 " and name "HB2 ") ASSI { 9080} (segid " " and resid "129 " and name "HN ") (segid " " and resid "130 " and name "HD1 ") 5.000 5.000 0.000 peak 9080 weight 0.10000E+01 volume 0.71400E+00 ppm1 8.293 ppm2 3.472 ASSI { 9081} (segid " " and resid "129 " and name "HN ") (segid " " and resid "130 " and name "HD2 ") 5.000 5.000 0.000 peak 9081 weight 0.10000E+01 volume 0.57900E+00 ppm1 8.287 ppm2 3.069 ASSI { 9090} (segid " " and resid "131 " and name "HN ") (segid " " and resid "130 " and name "HA ") 5.000 5.000 0.000 peak 9090 weight 0.10000E+01 volume 0.39500E+00 ppm1 6.828 ppm2 4.157 ASSI { 9092} (segid " " and resid "131 " and name "HN ") (segid " " and resid "131 " and name "HA ") 5.000 5.000 0.000 peak 9092 weight 0.10000E+01 volume 0.65700E+00 ppm1 6.827 ppm2 4.551 ASSI { 9093} (segid " " and resid "131 " and name "HN ") (segid " " and resid "131 " and name "HB1 ") 5.000 5.000 0.000 peak 9093 weight 0.10000E+01 volume 0.78100E+00 ppm1 6.821 ppm2 2.290 ASSI { 9094} (segid " " and resid "131 " and name "HN ") (segid " " and resid "131 " and name "HG1 ") 5.000 5.000 0.000 peak 9094 weight 0.10000E+01 volume 0.59200E+00 ppm1 6.826 ppm2 2.074 ASSI { 9095} (segid " " and resid "131 " and name "HN ") (segid " " and resid "131 " and name "HG2 ") 5.000 5.000 0.000 peak 9095 weight 0.10000E+01 volume 0.11410E+01 ppm1 6.825 ppm2 1.968 ASSI { 9101} (segid " " and resid "132 " and name "HN ") (segid " " and resid "131 " and name "HA ") 6.000 6.000 0.000 peak 9101 weight 0.10000E+01 volume 0.23500E+00 ppm1 7.008 ppm2 4.543 ASSI { 9102} (segid " " and resid "132 " and name "HN ") (segid " " and resid "131 " and name "HB2 ") 6.000 6.000 0.000 peak 9102 weight 0.10000E+01 volume 0.24000E+00 ppm1 7.008 ppm2 1.475 ASSI { 9103} (segid " " and resid "132 " and name "HN ") (segid " " and resid "131 " and name "HG2 ") 6.000 6.000 0.000 peak 9103 weight 0.10000E+01 volume 0.20400E+00 ppm1 7.009 ppm2 1.968 ASSI { 9105} (segid " " and resid "132 " and name "HN ") (segid " " and resid "132 " and name "HA ") 5.000 5.000 0.000 peak 9105 weight 0.10000E+01 volume 0.44400E+00 ppm1 7.018 ppm2 5.071 ASSI { 9106} (segid " " and resid "132 " and name "HN ") (segid " " and resid "132 " and name "HB1 ") 3.300 3.300 0.000 peak 9106 weight 0.10000E+01 volume 0.16410E+01 ppm1 7.017 ppm2 3.525 OR { 9106} (segid " " and resid "132 " and name "HN ") (segid " " and resid "132 " and name "HB2 ") ASSI { 9107} (segid " " and resid "132 " and name "HN ") (segid " " and resid "132 " and name "HG ") 5.000 5.000 0.000 peak 9107 weight 0.10000E+01 volume 0.97600E+00 ppm1 7.012 ppm2 4.778 ASSI { 9108} (segid " " and resid "132 " and name "HN ") (segid " " and resid "133 " and name "HN ") 6.000 6.000 0.000 peak 9108 weight 0.10000E+01 volume 0.89000E-01 ppm1 7.014 ppm2 8.701 ASSI { 9115} (segid " " and resid "133 " and name "HN ") (segid " " and resid "132 " and name "HA ") 3.300 3.300 0.000 peak 9115 weight 0.10000E+01 volume 0.18820E+01 ppm1 8.718 ppm2 5.071 ASSI { 9116} (segid " " and resid "133 " and name "HN ") (segid " " and resid "132 " and name "HB1 ") 5.000 5.000 0.000 peak 9116 weight 0.10000E+01 volume 0.52700E+00 ppm1 8.714 ppm2 3.540 OR { 9116} (segid " " and resid "133 " and name "HN ") (segid " " and resid "132 " and name "HB2 ") ASSI { 9117} (segid " " and resid "133 " and name "HN ") (segid " " and resid "133 " and name "HA ") 5.000 5.000 0.000 peak 9117 weight 0.10000E+01 volume 0.77200E+00 ppm1 8.715 ppm2 4.688 ASSI { 9118} (segid " " and resid "133 " and name "HN ") (segid " " and resid "133 " and name "HB1 ") 5.000 5.000 0.000 peak 9118 weight 0.10000E+01 volume 0.95700E+00 ppm1 8.718 ppm2 2.919 ASSI { 9119} (segid " " and resid "133 " and name "HN ") (segid " " and resid "133 " and name "HB2 ") 5.000 5.000 0.000 peak 9119 weight 0.10000E+01 volume 0.97200E+00 ppm1 8.713 ppm2 2.588 ASSI { 9120} (segid " " and resid "133 " and name "HN ") (segid " " and resid "134 " and name "HN ") 6.000 6.000 0.000 peak 9120 weight 0.10000E+01 volume 0.10200E+00 ppm1 8.721 ppm2 7.974 ASSI { 9123} (segid " " and resid "134 " and name "HN ") (segid " " and resid "133 " and name "HA ") 3.300 3.300 0.000 peak 9123 weight 0.10000E+01 volume 0.26270E+01 ppm1 7.965 ppm2 4.689 ASSI { 9125} (segid " " and resid "134 " and name "HN ") (segid " " and resid "134 " and name "HA ") 5.000 5.000 0.000 peak 9125 weight 0.10000E+01 volume 0.66300E+00 ppm1 7.964 ppm2 3.876 ASSI { 9126} (segid " " and resid "134 " and name "HN ") (segid " " and resid "134 " and name "HB1 ") 3.300 3.300 0.000 peak 9126 weight 0.10000E+01 volume 0.17730E+01 ppm1 7.968 ppm2 1.672 ASSI { 9127} (segid " " and resid "134 " and name "HN ") (segid " " and resid "134 " and name "HB2 ") 3.300 3.300 0.000 peak 9127 weight 0.10000E+01 volume 0.17080E+01 ppm1 7.960 ppm2 1.608 ASSI { 9128} (segid " " and resid "134 " and name "HN ") (segid " " and resid "134 " and name "HD11") 5.000 5.000 0.000 peak 9128 weight 0.10000E+01 volume 0.53800E+00 ppm1 7.964 ppm2 0.930 OR { 9128} (segid " " and resid "134 " and name "HN ") (segid " " and resid "134 " and name "HD13") OR { 9128} (segid " " and resid "134 " and name "HN ") (segid " " and resid "134 " and name "HD12") ASSI { 9129} (segid " " and resid "134 " and name "HN ") (segid " " and resid "134 " and name "HD21") 5.000 5.000 0.000 peak 9129 weight 0.10000E+01 volume 0.56000E+00 ppm1 7.956 ppm2 0.692 OR { 9129} (segid " " and resid "134 " and name "HN ") (segid " " and resid "134 " and name "HD23") OR { 9129} (segid " " and resid "134 " and name "HN ") (segid " " and resid "134 " and name "HD22") ASSI { 9130} (segid " " and resid "134 " and name "HN ") (segid " " and resid "134 " and name "HG ") 3.300 3.300 0.000 peak 9130 weight 0.10000E+01 volume 0.18040E+01 ppm1 7.957 ppm2 1.949 ASSI { 9133} (segid " " and resid "135 " and name "HN ") (segid " " and resid "134 " and name "HA ") 6.000 6.000 0.000 peak 9133 weight 0.10000E+01 volume 0.26800E+00 ppm1 8.049 ppm2 3.880 ASSI { 9134} (segid " " and resid "135 " and name "HN ") (segid " " and resid "134 " and name "HB1 ") 6.000 6.000 0.000 peak 9134 weight 0.10000E+01 volume 0.15600E+00 ppm1 8.047 ppm2 1.688 ASSI { 9135} (segid " " and resid "135 " and name "HN ") (segid " " and resid "134 " and name "HD21") 6.000 6.000 0.000 peak 9135 weight 0.10000E+01 volume 0.17800E+00 ppm1 8.054 ppm2 0.693 OR { 9135} (segid " " and resid "135 " and name "HN ") (segid " " and resid "134 " and name "HD23") OR { 9135} (segid " " and resid "135 " and name "HN ") (segid " " and resid "134 " and name "HD22") ASSI { 9136} (segid " " and resid "135 " and name "HN ") (segid " " and resid "134 " and name "HG ") 6.000 6.000 0.000 peak 9136 weight 0.10000E+01 volume 0.14900E+00 ppm1 8.052 ppm2 1.949 ASSI { 9137} (segid " " and resid "135 " and name "HN ") (segid " " and resid "135 " and name "HA ") 5.000 5.000 0.000 peak 9137 weight 0.10000E+01 volume 0.14900E+01 ppm1 8.053 ppm2 4.720 ASSI { 9138} (segid " " and resid "135 " and name "HN ") (segid " " and resid "135 " and name "HB1 ") 5.000 5.000 0.000 peak 9138 weight 0.10000E+01 volume 0.11430E+01 ppm1 8.056 ppm2 3.337 ASSI { 9139} (segid " " and resid "135 " and name "HN ") (segid " " and resid "135 " and name "HB2 ") 5.000 5.000 0.000 peak 9139 weight 0.10000E+01 volume 0.14950E+01 ppm1 8.049 ppm2 3.107 ASSI { 9140} (segid " " and resid "135 " and name "HN ") (segid " " and resid "135 " and name "HD2 ") 6.000 6.000 0.000 peak 9140 weight 0.10000E+01 volume 0.25700E+00 ppm1 8.051 ppm2 7.100 ASSI { 9146} (segid " " and resid "136 " and name "HN ") (segid " " and resid "135 " and name "HA ") 5.000 5.000 0.000 peak 9146 weight 0.10000E+01 volume 0.58600E+00 ppm1 7.555 ppm2 4.722 ASSI { 9148} (segid " " and resid "136 " and name "HN ") (segid " " and resid "136 " and name "HA ") 5.000 5.000 0.000 peak 9148 weight 0.10000E+01 volume 0.88600E+00 ppm1 7.557 ppm2 4.291 ASSI { 9151} (segid " " and resid "137 " and name "HN ") (segid " " and resid "136 " and name "HA ") 2.700 2.700 0.000 peak 9151 weight 0.10000E+01 volume 0.34770E+01 ppm1 7.446 ppm2 4.288 ASSI { 9153} (segid " " and resid "137 " and name "HN ") (segid " " and resid "137 " and name "HB1 ") 5.000 5.000 0.000 peak 9153 weight 0.10000E+01 volume 0.10220E+01 ppm1 7.446 ppm2 1.546 ASSI { 9154} (segid " " and resid "137 " and name "HN ") (segid " " and resid "137 " and name "HB2 ") 5.000 5.000 0.000 peak 9154 weight 0.10000E+01 volume 0.76800E+00 ppm1 7.451 ppm2 1.259 ASSI { 9155} (segid " " and resid "137 " and name "HN ") (segid " " and resid "137 " and name "HD2 ") 5.000 5.000 0.000 peak 9155 weight 0.10000E+01 volume 0.62200E+00 ppm1 7.446 ppm2 3.122 OR { 9155} (segid " " and resid "137 " and name "HN ") (segid " " and resid "137 " and name "HD1 ") ASSI { 9156} (segid " " and resid "137 " and name "HN ") (segid " " and resid "137 " and name "HG1 ") 5.000 5.000 0.000 peak 9156 weight 0.10000E+01 volume 0.98600E+00 ppm1 7.451 ppm2 1.677 ASSI { 9157} (segid " " and resid "137 " and name "HN ") (segid " " and resid "137 " and name "HG2 ") 5.000 5.000 0.000 peak 9157 weight 0.10000E+01 volume 0.46700E+00 ppm1 7.450 ppm2 1.438 ASSI { 9162} (segid " " and resid "138 " and name "HN ") (segid " " and resid "137 " and name "HA ") 3.300 3.300 0.000 peak 9162 weight 0.10000E+01 volume 0.25570E+01 ppm1 7.705 ppm2 4.214 ASSI { 9163} (segid " " and resid "138 " and name "HN ") (segid " " and resid "137 " and name "HB2 ") 5.000 5.000 0.000 peak 9163 weight 0.10000E+01 volume 0.50300E+00 ppm1 7.706 ppm2 1.266 ASSI { 9164} (segid " " and resid "138 " and name "HN ") (segid " " and resid "137 " and name "HG1 ") 5.000 5.000 0.000 peak 9164 weight 0.10000E+01 volume 0.71400E+00 ppm1 7.704 ppm2 1.672 ASSI { 9165} (segid " " and resid "138 " and name "HN ") (segid " " and resid "137 " and name "HN ") 6.000 6.000 0.000 peak 9165 weight 0.10000E+01 volume 0.14300E+00 ppm1 7.705 ppm2 7.436 ASSI { 9166} (segid " " and resid "138 " and name "HN ") (segid " " and resid "138 " and name "HA ") 5.000 5.000 0.000 peak 9166 weight 0.10000E+01 volume 0.58500E+00 ppm1 7.701 ppm2 4.569 ASSI { 9167} (segid " " and resid "138 " and name "HN ") (segid " " and resid "138 " and name "HB1 ") 5.000 5.000 0.000 peak 9167 weight 0.10000E+01 volume 0.36600E+00 ppm1 7.706 ppm2 2.858 ASSI { 9168} (segid " " and resid "138 " and name "HN ") (segid " " and resid "142 " and name "HN ") 5.000 5.000 0.000 peak 9168 weight 0.10000E+01 volume 0.53700E+00 ppm1 7.704 ppm2 8.193 ASSI { 9172} (segid " " and resid "139 " and name "HN ") (segid " " and resid "138 " and name "HA ") 5.000 5.000 0.000 peak 9172 weight 0.10000E+01 volume 0.14330E+01 ppm1 8.296 ppm2 4.571 ASSI { 9173} (segid " " and resid "139 " and name "HN ") (segid " " and resid "138 " and name "HB1 ") 3.300 3.300 0.000 peak 9173 weight 0.10000E+01 volume 0.15770E+01 ppm1 8.296 ppm2 2.856 ASSI { 9174} (segid " " and resid "139 " and name "HN ") (segid " " and resid "138 " and name "HB2 ") 5.000 5.000 0.000 peak 9174 weight 0.10000E+01 volume 0.12730E+01 ppm1 8.299 ppm2 1.597 ASSI { 9175} (segid " " and resid "139 " and name "HN ") (segid " " and resid "138 " and name "HN ") 6.000 6.000 0.000 peak 9175 weight 0.10000E+01 volume 0.14600E+00 ppm1 8.296 ppm2 7.712 ASSI { 9176} (segid " " and resid "139 " and name "HN ") (segid " " and resid "139 " and name "HA ") 3.300 3.300 0.000 peak 9176 weight 0.10000E+01 volume 0.23110E+01 ppm1 8.291 ppm2 4.128 ASSI { 9177} (segid " " and resid "139 " and name "HN ") (segid " " and resid "139 " and name "HB2 ") 3.300 3.300 0.000 peak 9177 weight 0.10000E+01 volume 0.28910E+01 ppm1 8.297 ppm2 1.394 OR { 9177} (segid " " and resid "139 " and name "HN ") (segid " " and resid "139 " and name "HB1 ") OR { 9177} (segid " " and resid "139 " and name "HN ") (segid " " and resid "139 " and name "HB3 ") ASSI { 9178} (segid " " and resid "139 " and name "HN ") (segid " " and resid "140 " and name "HN ") 3.300 3.300 0.000 peak 9178 weight 0.10000E+01 volume 0.24090E+01 ppm1 8.297 ppm2 8.143 ASSI { 9183} (segid " " and resid "140 " and name "HN ") (segid " " and resid "139 " and name "HA ") 3.300 3.300 0.000 peak 9183 weight 0.10000E+01 volume 0.17380E+01 ppm1 8.138 ppm2 4.117 ASSI { 9184} (segid " " and resid "140 " and name "HN ") (segid " " and resid "139 " and name "HB1 ") 5.000 5.000 0.000 peak 9184 weight 0.10000E+01 volume 0.81200E+00 ppm1 8.136 ppm2 1.399 OR { 9184} (segid " " and resid "140 " and name "HN ") (segid " " and resid "139 " and name "HB3 ") OR { 9184} (segid " " and resid "140 " and name "HN ") (segid " " and resid "139 " and name "HB2 ") ASSI { 9186} (segid " " and resid "140 " and name "HN ") (segid " " and resid "140 " and name "HA ") 5.000 5.000 0.000 peak 9186 weight 0.10000E+01 volume 0.11680E+01 ppm1 8.140 ppm2 4.516 ASSI { 9187} (segid " " and resid "140 " and name "HN ") (segid " " and resid "140 " and name "HB2 ") 5.000 5.000 0.000 peak 9187 weight 0.10000E+01 volume 0.78900E+00 ppm1 8.132 ppm2 3.918 ASSI { 9192} (segid " " and resid "141 " and name "HN ") (segid " " and resid "140 " and name "HN ") 2.700 2.700 0.000 peak 9192 weight 0.10000E+01 volume 0.33330E+01 ppm1 8.449 ppm2 8.145 ASSI { 9193} (segid " " and resid "141 " and name "HN ") (segid " " and resid "141 " and name "HA1 ") 5.000 5.000 0.000 peak 9193 weight 0.10000E+01 volume 0.12740E+01 ppm1 8.450 ppm2 4.322 ASSI { 9194} (segid " " and resid "141 " and name "HN ") (segid " " and resid "141 " and name "HA2 ") 3.300 3.300 0.000 peak 9194 weight 0.10000E+01 volume 0.16730E+01 ppm1 8.451 ppm2 3.686 ASSI { 9195} (segid " " and resid "141 " and name "HN ") (segid " " and resid "142 " and name "HN ") 3.300 3.300 0.000 peak 9195 weight 0.10000E+01 volume 0.28950E+01 ppm1 8.451 ppm2 8.205 ASSI { 9199} (segid " " and resid "142 " and name "HN ") (segid " " and resid "141 " and name "HA1 ") 5.000 5.000 0.000 peak 9199 weight 0.10000E+01 volume 0.37200E+00 ppm1 8.199 ppm2 4.324 ASSI { 9200} (segid " " and resid "142 " and name "HN ") (segid " " and resid "141 " and name "HA2 ") 5.000 5.000 0.000 peak 9200 weight 0.10000E+01 volume 0.47500E+00 ppm1 8.195 ppm2 3.692 ASSI { 9202} (segid " " and resid "142 " and name "HN ") (segid " " and resid "142 " and name "HA ") 5.000 5.000 0.000 peak 9202 weight 0.10000E+01 volume 0.50700E+00 ppm1 8.203 ppm2 4.992 ASSI { 9203} (segid " " and resid "142 " and name "HN ") (segid " " and resid "142 " and name "HB1 ") 5.000 5.000 0.000 peak 9203 weight 0.10000E+01 volume 0.96900E+00 ppm1 8.199 ppm2 2.063 ASSI { 9204} (segid " " and resid "142 " and name "HN ") (segid " " and resid "142 " and name "HB2 ") 5.000 5.000 0.000 peak 9204 weight 0.10000E+01 volume 0.72200E+00 ppm1 8.202 ppm2 1.318 ASSI { 9205} (segid " " and resid "142 " and name "HN ") (segid " " and resid "142 " and name "HD11") 6.000 6.000 0.000 peak 9205 weight 0.10000E+01 volume 0.26300E+00 ppm1 8.194 ppm2 0.881 OR { 9205} (segid " " and resid "142 " and name "HN ") (segid " " and resid "142 " and name "HD12") OR { 9205} (segid " " and resid "142 " and name "HN ") (segid " " and resid "142 " and name "HD13") ASSI { 9206} (segid " " and resid "142 " and name "HN ") (segid " " and resid "142 " and name "HD23") 5.000 5.000 0.000 peak 9206 weight 0.10000E+01 volume 0.30000E+00 ppm1 8.196 ppm2 0.746 OR { 9206} (segid " " and resid "142 " and name "HN ") (segid " " and resid "142 " and name "HD21") OR { 9206} (segid " " and resid "142 " and name "HN ") (segid " " and resid "142 " and name "HD22") ASSI { 9207} (segid " " and resid "142 " and name "HN ") (segid " " and resid "142 " and name "HG ") 5.000 5.000 0.000 peak 9207 weight 0.10000E+01 volume 0.13700E+01 ppm1 8.198 ppm2 1.505 ASSI { 9208} (segid " " and resid "142 " and name "HN ") (segid " " and resid "143 " and name "HN ") 5.000 5.000 0.000 peak 9208 weight 0.10000E+01 volume 0.50400E+00 ppm1 8.203 ppm2 8.552 ASSI { 9211} (segid " " and resid "143 " and name "HN ") (segid " " and resid "142 " and name "HA ") 3.300 3.300 0.000 peak 9211 weight 0.10000E+01 volume 0.17290E+01 ppm1 8.540 ppm2 4.988 ASSI { 9212} (segid " " and resid "143 " and name "HN ") (segid " " and resid "142 " and name "HD21") 5.000 5.000 0.000 peak 9212 weight 0.10000E+01 volume 0.46700E+00 ppm1 8.542 ppm2 0.742 OR { 9212} (segid " " and resid "143 " and name "HN ") (segid " " and resid "142 " and name "HD23") OR { 9212} (segid " " and resid "143 " and name "HN ") (segid " " and resid "142 " and name "HD22") ASSI { 9214} (segid " " and resid "143 " and name "HN ") (segid " " and resid "143 " and name "HA ") 5.000 5.000 0.000 peak 9214 weight 0.10000E+01 volume 0.34600E+00 ppm1 8.541 ppm2 5.345 ASSI { 9215} (segid " " and resid "143 " and name "HN ") (segid " " and resid "143 " and name "HG22") 5.000 5.000 0.000 peak 9215 weight 0.10000E+01 volume 0.12910E+01 ppm1 8.542 ppm2 1.251 OR { 9215} (segid " " and resid "143 " and name "HN ") (segid " " and resid "143 " and name "HG23") OR { 9215} (segid " " and resid "143 " and name "HN ") (segid " " and resid "143 " and name "HG21") ASSI { 9224} (segid " " and resid "145 " and name "HN ") (segid " " and resid "145 " and name "HA ") 5.000 5.000 0.000 peak 9224 weight 0.10000E+01 volume 0.66000E+00 ppm1 8.795 ppm2 3.923 ASSI { 9225} (segid " " and resid "145 " and name "HN ") (segid " " and resid "145 " and name "HB1 ") 3.300 3.300 0.000 peak 9225 weight 0.10000E+01 volume 0.20130E+01 ppm1 8.794 ppm2 1.759 ASSI { 9226} (segid " " and resid "145 " and name "HN ") (segid " " and resid "145 " and name "HB2 ") 5.000 5.000 0.000 peak 9226 weight 0.10000E+01 volume 0.13440E+01 ppm1 8.796 ppm2 1.399 ASSI { 9227} (segid " " and resid "145 " and name "HN ") (segid " " and resid "145 " and name "HG ") 5.000 5.000 0.000 peak 9227 weight 0.10000E+01 volume 0.54700E+00 ppm1 8.796 ppm2 1.524 ASSI { 9228} (segid " " and resid "145 " and name "HN ") (segid " " and resid "146 " and name "HN ") 5.000 5.000 0.000 peak 9228 weight 0.10000E+01 volume 0.62100E+00 ppm1 8.799 ppm2 7.652 ASSI { 9234} (segid " " and resid "146 " and name "HN ") (segid " " and resid "145 " and name "HB1 ") 5.000 5.000 0.000 peak 9234 weight 0.10000E+01 volume 0.46600E+00 ppm1 7.642 ppm2 1.741 ASSI { 9235} (segid " " and resid "146 " and name "HN ") (segid " " and resid "145 " and name "HB2 ") 5.000 5.000 0.000 peak 9235 weight 0.10000E+01 volume 0.39800E+00 ppm1 7.644 ppm2 1.390 ASSI { 9236} (segid " " and resid "146 " and name "HN ") (segid " " and resid "145 " and name "HD23") 6.000 6.000 0.000 peak 9236 weight 0.10000E+01 volume 0.23200E+00 ppm1 7.643 ppm2 1.015 OR { 9236} (segid " " and resid "146 " and name "HN ") (segid " " and resid "145 " and name "HD21") OR { 9236} (segid " " and resid "146 " and name "HN ") (segid " " and resid "145 " and name "HD22") ASSI { 9237} (segid " " and resid "146 " and name "HN ") (segid " " and resid "145 " and name "HG ") 5.000 5.000 0.000 peak 9237 weight 0.10000E+01 volume 0.37600E+00 ppm1 7.645 ppm2 1.523 ASSI { 9238} (segid " " and resid "146 " and name "HN ") (segid " " and resid "146 " and name "HA ") 5.000 5.000 0.000 peak 9238 weight 0.10000E+01 volume 0.75100E+00 ppm1 7.642 ppm2 3.985 ASSI { 9239} (segid " " and resid "146 " and name "HN ") (segid " " and resid "146 " and name "HB2 ") 3.300 3.300 0.000 peak 9239 weight 0.10000E+01 volume 0.17150E+01 ppm1 7.643 ppm2 2.135 OR { 9239} (segid " " and resid "146 " and name "HN ") (segid " " and resid "146 " and name "HB1 ") ASSI { 9240} (segid " " and resid "146 " and name "HN ") (segid " " and resid "146 " and name "HG1 ") 5.000 5.000 0.000 peak 9240 weight 0.10000E+01 volume 0.13270E+01 ppm1 7.644 ppm2 2.425 ASSI { 9241} (segid " " and resid "146 " and name "HN ") (segid " " and resid "146 " and name "HG2 ") 5.000 5.000 0.000 peak 9241 weight 0.10000E+01 volume 0.13250E+01 ppm1 7.646 ppm2 2.345 ASSI { 9242} (segid " " and resid "146 " and name "HN ") (segid " " and resid "147 " and name "HN ") 3.300 3.300 0.000 peak 9242 weight 0.10000E+01 volume 0.15710E+01 ppm1 7.646 ppm2 8.763 ASSI { 9247} (segid " " and resid "147 " and name "HN ") (segid " " and resid "144 " and name "HA ") 5.000 5.000 0.000 peak 9247 weight 0.10000E+01 volume 0.62500E+00 ppm1 8.750 ppm2 3.679 ASSI { 9248} (segid " " and resid "147 " and name "HN ") (segid " " and resid "146 " and name "HA ") 5.000 5.000 0.000 peak 9248 weight 0.10000E+01 volume 0.44700E+00 ppm1 8.759 ppm2 3.983 ASSI { 9249} (segid " " and resid "147 " and name "HN ") (segid " " and resid "146 " and name "HB1 ") 3.300 3.300 0.000 peak 9249 weight 0.10000E+01 volume 0.24280E+01 ppm1 8.755 ppm2 2.139 OR { 9249} (segid " " and resid "147 " and name "HN ") (segid " " and resid "146 " and name "HB2 ") ASSI { 9251} (segid " " and resid "147 " and name "HN ") (segid " " and resid "147 " and name "HA ") 5.000 5.000 0.000 peak 9251 weight 0.10000E+01 volume 0.67000E+00 ppm1 8.754 ppm2 4.208 ASSI { 9252} (segid " " and resid "147 " and name "HN ") (segid " " and resid "147 " and name "HD13") 5.000 5.000 0.000 peak 9252 weight 0.10000E+01 volume 0.77700E+00 ppm1 8.757 ppm2 1.176 OR { 9252} (segid " " and resid "147 " and name "HN ") (segid " " and resid "147 " and name "HD11") OR { 9252} (segid " " and resid "147 " and name "HN ") (segid " " and resid "147 " and name "HD12") ASSI { 9253} (segid " " and resid "147 " and name "HN ") (segid " " and resid "147 " and name "HD23") 5.000 5.000 0.000 peak 9253 weight 0.10000E+01 volume 0.38300E+00 ppm1 8.753 ppm2 1.039 OR { 9253} (segid " " and resid "147 " and name "HN ") (segid " " and resid "147 " and name "HD22") OR { 9253} (segid " " and resid "147 " and name "HN ") (segid " " and resid "147 " and name "HD21") ASSI { 9254} (segid " " and resid "147 " and name "HN ") (segid " " and resid "148 " and name "HN ") 5.000 5.000 0.000 peak 9254 weight 0.10000E+01 volume 0.78700E+00 ppm1 8.756 ppm2 8.275 ASSI { 9262} (segid " " and resid "148 " and name "HN ") (segid " " and resid "145 " and name "HA ") 5.000 5.000 0.000 peak 9262 weight 0.10000E+01 volume 0.42900E+00 ppm1 8.276 ppm2 3.934 ASSI { 9263} (segid " " and resid "148 " and name "HN ") (segid " " and resid "147 " and name "HA ") 5.000 5.000 0.000 peak 9263 weight 0.10000E+01 volume 0.51200E+00 ppm1 8.276 ppm2 4.214 ASSI { 9264} (segid " " and resid "148 " and name "HN ") (segid " " and resid "147 " and name "HB1 ") 3.300 3.300 0.000 peak 9264 weight 0.10000E+01 volume 0.16550E+01 ppm1 8.278 ppm2 2.134 ASSI { 9265} (segid " " and resid "148 " and name "HN ") (segid " " and resid "147 " and name "HB2 ") 5.000 5.000 0.000 peak 9265 weight 0.10000E+01 volume 0.14170E+01 ppm1 8.278 ppm2 1.546 ASSI { 9266} (segid " " and resid "148 " and name "HN ") (segid " " and resid "147 " and name "HD11") 5.000 5.000 0.000 peak 9266 weight 0.10000E+01 volume 0.32500E+00 ppm1 8.275 ppm2 1.192 OR { 9266} (segid " " and resid "148 " and name "HN ") (segid " " and resid "147 " and name "HD12") OR { 9266} (segid " " and resid "148 " and name "HN ") (segid " " and resid "147 " and name "HD13") ASSI { 9267} (segid " " and resid "148 " and name "HN ") (segid " " and resid "147 " and name "HD22") 5.000 5.000 0.000 peak 9267 weight 0.10000E+01 volume 0.69400E+00 ppm1 8.281 ppm2 1.024 OR { 9267} (segid " " and resid "148 " and name "HN ") (segid " " and resid "147 " and name "HD23") OR { 9267} (segid " " and resid "148 " and name "HN ") (segid " " and resid "147 " and name "HD21") ASSI { 9269} (segid " " and resid "148 " and name "HN ") (segid " " and resid "148 " and name "HA ") 5.000 5.000 0.000 peak 9269 weight 0.10000E+01 volume 0.94800E+00 ppm1 8.274 ppm2 3.744 ASSI { 9270} (segid " " and resid "148 " and name "HN ") (segid " " and resid "148 " and name "HB2 ") 2.700 2.700 0.000 peak 9270 weight 0.10000E+01 volume 0.30150E+01 ppm1 8.277 ppm2 1.432 OR { 9270} (segid " " and resid "148 " and name "HN ") (segid " " and resid "148 " and name "HB1 ") OR { 9270} (segid " " and resid "148 " and name "HN ") (segid " " and resid "148 " and name "HB3 ") ASSI { 9271} (segid " " and resid "148 " and name "HN ") (segid " " and resid "149 " and name "HN ") 5.000 5.000 0.000 peak 9271 weight 0.10000E+01 volume 0.11840E+01 ppm1 8.279 ppm2 8.560 ASSI { 9275} (segid " " and resid "149 " and name "HN ") (segid " " and resid "146 " and name "HA ") 5.000 5.000 0.000 peak 9275 weight 0.10000E+01 volume 0.47000E+00 ppm1 8.557 ppm2 3.986 ASSI { 9276} (segid " " and resid "149 " and name "HN ") (segid " " and resid "148 " and name "HA ") 6.000 6.000 0.000 peak 9276 weight 0.10000E+01 volume 0.22700E+00 ppm1 8.557 ppm2 3.734 ASSI { 9277} (segid " " and resid "149 " and name "HN ") (segid " " and resid "148 " and name "HB1 ") 5.000 5.000 0.000 peak 9277 weight 0.10000E+01 volume 0.12610E+01 ppm1 8.557 ppm2 1.427 OR { 9277} (segid " " and resid "149 " and name "HN ") (segid " " and resid "148 " and name "HB2 ") OR { 9277} (segid " " and resid "149 " and name "HN ") (segid " " and resid "148 " and name "HB3 ") ASSI { 9279} (segid " " and resid "149 " and name "HN ") (segid " " and resid "149 " and name "HA ") 5.000 5.000 0.000 peak 9279 weight 0.10000E+01 volume 0.92800E+00 ppm1 8.557 ppm2 4.337 ASSI { 9280} (segid " " and resid "149 " and name "HN ") (segid " " and resid "149 " and name "HB1 ") 3.300 3.300 0.000 peak 9280 weight 0.10000E+01 volume 0.20790E+01 ppm1 8.558 ppm2 1.978 ASSI { 9281} (segid " " and resid "149 " and name "HN ") (segid " " and resid "149 " and name "HB2 ") 3.300 3.300 0.000 peak 9281 weight 0.10000E+01 volume 0.22280E+01 ppm1 8.558 ppm2 1.869 ASSI { 9282} (segid " " and resid "149 " and name "HN ") (segid " " and resid "149 " and name "HG1 ") 5.000 5.000 0.000 peak 9282 weight 0.10000E+01 volume 0.12100E+01 ppm1 8.556 ppm2 1.765 ASSI { 9283} (segid " " and resid "149 " and name "HN ") (segid " " and resid "149 " and name "HG2 ") 5.000 5.000 0.000 peak 9283 weight 0.10000E+01 volume 0.44000E+00 ppm1 8.558 ppm2 1.577 ASSI { 9284} (segid " " and resid "149 " and name "HN ") (segid " " and resid "150 " and name "HN ") 2.700 2.700 0.000 peak 9284 weight 0.10000E+01 volume 0.51390E+01 ppm1 8.558 ppm2 8.436 ASSI { 9288} (segid " " and resid "150 " and name "HN ") (segid " " and resid "147 " and name "HA ") 5.000 5.000 0.000 peak 9288 weight 0.10000E+01 volume 0.38900E+00 ppm1 8.432 ppm2 4.194 ASSI { 9289} (segid " " and resid "150 " and name "HN ") (segid " " and resid "149 " and name "HA ") 5.000 5.000 0.000 peak 9289 weight 0.10000E+01 volume 0.43700E+00 ppm1 8.437 ppm2 4.325 ASSI { 9290} (segid " " and resid "150 " and name "HN ") (segid " " and resid "149 " and name "HB1 ") 5.000 5.000 0.000 peak 9290 weight 0.10000E+01 volume 0.12040E+01 ppm1 8.434 ppm2 1.978 ASSI { 9291} (segid " " and resid "150 " and name "HN ") (segid " " and resid "149 " and name "HB2 ") 5.000 5.000 0.000 peak 9291 weight 0.10000E+01 volume 0.98900E+00 ppm1 8.438 ppm2 1.873 ASSI { 9292} (segid " " and resid "150 " and name "HN ") (segid " " and resid "149 " and name "HG1 ") 5.000 5.000 0.000 peak 9292 weight 0.10000E+01 volume 0.45100E+00 ppm1 8.433 ppm2 1.761 ASSI { 9293} (segid " " and resid "150 " and name "HN ") (segid " " and resid "149 " and name "HG2 ") 6.000 6.000 0.000 peak 9293 weight 0.10000E+01 volume 0.18100E+00 ppm1 8.423 ppm2 1.582 ASSI { 9295} (segid " " and resid "150 " and name "HN ") (segid " " and resid "150 " and name "HA ") 5.000 5.000 0.000 peak 9295 weight 0.10000E+01 volume 0.14200E+01 ppm1 8.435 ppm2 4.055 ASSI { 9296} (segid " " and resid "150 " and name "HN ") (segid " " and resid "150 " and name "HB1 ") 3.300 3.300 0.000 peak 9296 weight 0.10000E+01 volume 0.18530E+01 ppm1 8.432 ppm2 2.395 ASSI { 9297} (segid " " and resid "150 " and name "HN ") (segid " " and resid "150 " and name "HB2 ") 3.300 3.300 0.000 peak 9297 weight 0.10000E+01 volume 0.18840E+01 ppm1 8.434 ppm2 2.227 ASSI { 9298} (segid " " and resid "150 " and name "HN ") (segid " " and resid "150 " and name "HG1 ") 5.000 5.000 0.000 peak 9298 weight 0.10000E+01 volume 0.42500E+00 ppm1 8.433 ppm2 2.559 ASSI { 9299} (segid " " and resid "150 " and name "HN ") (segid " " and resid "151 " and name "HN ") 5.000 5.000 0.000 peak 9299 weight 0.10000E+01 volume 0.10810E+01 ppm1 8.433 ppm2 7.798 ASSI { 9309} (segid " " and resid "151 " and name "HN ") (segid " " and resid "148 " and name "HA ") 6.000 6.000 0.000 peak 9309 weight 0.10000E+01 volume 0.17200E+00 ppm1 7.797 ppm2 3.745 ASSI { 9310} (segid " " and resid "151 " and name "HN ") (segid " " and resid "150 " and name "HA ") 5.000 5.000 0.000 peak 9310 weight 0.10000E+01 volume 0.46500E+00 ppm1 7.796 ppm2 4.058 ASSI { 9311} (segid " " and resid "151 " and name "HN ") (segid " " and resid "150 " and name "HB1 ") 5.000 5.000 0.000 peak 9311 weight 0.10000E+01 volume 0.14030E+01 ppm1 7.798 ppm2 2.389 ASSI { 9312} (segid " " and resid "151 " and name "HN ") (segid " " and resid "150 " and name "HB2 ") 5.000 5.000 0.000 peak 9312 weight 0.10000E+01 volume 0.14000E+01 ppm1 7.799 ppm2 2.208 ASSI { 9314} (segid " " and resid "151 " and name "HN ") (segid " " and resid "151 " and name "HA ") 5.000 5.000 0.000 peak 9314 weight 0.10000E+01 volume 0.11430E+01 ppm1 7.795 ppm2 4.297 ASSI { 9315} (segid " " and resid "151 " and name "HN ") (segid " " and resid "151 " and name "HB1 ") 5.000 5.000 0.000 peak 9315 weight 0.10000E+01 volume 0.13850E+01 ppm1 7.797 ppm2 2.157 ASSI { 9316} (segid " " and resid "151 " and name "HN ") (segid " " and resid "151 " and name "HB2 ") 2.700 2.700 0.000 peak 9316 weight 0.10000E+01 volume 0.36790E+01 ppm1 7.797 ppm2 1.794 ASSI { 9317} (segid " " and resid "151 " and name "HN ") (segid " " and resid "152 " and name "HN ") 5.000 5.000 0.000 peak 9317 weight 0.10000E+01 volume 0.12870E+01 ppm1 7.797 ppm2 7.987 ASSI { 9324} (segid " " and resid "152 " and name "HN ") (segid " " and resid "151 " and name "HA ") 5.000 5.000 0.000 peak 9324 weight 0.10000E+01 volume 0.83400E+00 ppm1 7.996 ppm2 4.308 ASSI { 9325} (segid " " and resid "152 " and name "HN ") (segid " " and resid "152 " and name "HA1 ") 3.300 3.300 0.000 peak 9325 weight 0.10000E+01 volume 0.22910E+01 ppm1 7.993 ppm2 4.040 ASSI { 9326} (segid " " and resid "152 " and name "HN ") (segid " " and resid "152 " and name "HA2 ") 3.300 3.300 0.000 peak 9326 weight 0.10000E+01 volume 0.28500E+01 ppm1 7.994 ppm2 3.868 ASSI { 9327} (segid " " and resid "152 " and name "HN ") (segid " " and resid "153 " and name "HN ") 3.300 3.300 0.000 peak 9327 weight 0.10000E+01 volume 0.28480E+01 ppm1 7.996 ppm2 7.818 ASSI { 9331} (segid " " and resid "153 " and name "HN ") (segid " " and resid "152 " and name "HA1 ") 3.300 3.300 0.000 peak 9331 weight 0.10000E+01 volume 0.17970E+01 ppm1 7.839 ppm2 4.034 ASSI { 9332} (segid " " and resid "153 " and name "HN ") (segid " " and resid "152 " and name "HA2 ") 5.000 5.000 0.000 peak 9332 weight 0.10000E+01 volume 0.69500E+00 ppm1 7.839 ppm2 3.866 ASSI { 9334} (segid " " and resid "153 " and name "HN ") (segid " " and resid "153 " and name "HB3 ") 2.700 2.700 0.000 peak 9334 weight 0.10000E+01 volume 0.58040E+01 ppm1 7.834 ppm2 1.368 OR { 9334} (segid " " and resid "153 " and name "HN ") (segid " " and resid "153 " and name "HB2 ") OR { 9334} (segid " " and resid "153 " and name "HN ") (segid " " and resid "153 " and name "HB1 ") ASSI { 9339} (segid " " and resid "156 " and name "HN ") (segid " " and resid "156 " and name "HA ") 5.000 5.000 0.000 peak 9339 weight 0.10000E+01 volume 0.35900E+00 ppm1 7.132 ppm2 4.146 ASSI { 9340} (segid " " and resid "156 " and name "HN ") (segid " " and resid "156 " and name "HB1 ") 5.000 5.000 0.000 peak 9340 weight 0.10000E+01 volume 0.85500E+00 ppm1 7.136 ppm2 2.079 ASSI { 9341} (segid " " and resid "156 " and name "HN ") (segid " " and resid "156 " and name "HB2 ") 5.000 5.000 0.000 peak 9341 weight 0.10000E+01 volume 0.45500E+00 ppm1 7.136 ppm2 1.149 ASSI { 9342} (segid " " and resid "156 " and name "HN ") (segid " " and resid "156 " and name "HD11") 5.000 5.000 0.000 peak 9342 weight 0.10000E+01 volume 0.56500E+00 ppm1 7.135 ppm2 0.993 OR { 9342} (segid " " and resid "156 " and name "HN ") (segid " " and resid "156 " and name "HD12") OR { 9342} (segid " " and resid "156 " and name "HN ") (segid " " and resid "156 " and name "HD13") ASSI { 9343} (segid " " and resid "156 " and name "HN ") (segid " " and resid "156 " and name "HD22") 5.000 5.000 0.000 peak 9343 weight 0.10000E+01 volume 0.59500E+00 ppm1 7.135 ppm2 0.724 OR { 9343} (segid " " and resid "156 " and name "HN ") (segid " " and resid "156 " and name "HD23") OR { 9343} (segid " " and resid "156 " and name "HN ") (segid " " and resid "156 " and name "HD21") ASSI { 9344} (segid " " and resid "156 " and name "HN ") (segid " " and resid "156 " and name "HG ") 3.300 3.300 0.000 peak 9344 weight 0.10000E+01 volume 0.21460E+01 ppm1 7.137 ppm2 1.880 ASSI { 9351} (segid " " and resid "157 " and name "HN ") (segid " " and resid "156 " and name "HA ") 5.000 5.000 0.000 peak 9351 weight 0.10000E+01 volume 0.98300E+00 ppm1 8.177 ppm2 4.146 ASSI { 9352} (segid " " and resid "157 " and name "HN ") (segid " " and resid "156 " and name "HB1 ") 5.000 5.000 0.000 peak 9352 weight 0.10000E+01 volume 0.12420E+01 ppm1 8.173 ppm2 2.066 ASSI { 9353} (segid " " and resid "157 " and name "HN ") (segid " " and resid "156 " and name "HB2 ") 5.000 5.000 0.000 peak 9353 weight 0.10000E+01 volume 0.39500E+00 ppm1 8.178 ppm2 1.167 ASSI { 9354} (segid " " and resid "157 " and name "HN ") (segid " " and resid "156 " and name "HD11") 5.000 5.000 0.000 peak 9354 weight 0.10000E+01 volume 0.38200E+00 ppm1 8.180 ppm2 0.993 OR { 9354} (segid " " and resid "157 " and name "HN ") (segid " " and resid "156 " and name "HD12") OR { 9354} (segid " " and resid "157 " and name "HN ") (segid " " and resid "156 " and name "HD13") ASSI { 9356} (segid " " and resid "157 " and name "HN ") (segid " " and resid "157 " and name "HA ") 5.000 5.000 0.000 peak 9356 weight 0.10000E+01 volume 0.92600E+00 ppm1 8.176 ppm2 3.710 ASSI { 9357} (segid " " and resid "157 " and name "HN ") (segid " " and resid "157 " and name "HB1 ") 3.300 3.300 0.000 peak 9357 weight 0.10000E+01 volume 0.28970E+01 ppm1 8.173 ppm2 2.287 ASSI { 9358} (segid " " and resid "157 " and name "HN ") (segid " " and resid "157 " and name "HB2 ") 3.300 3.300 0.000 peak 9358 weight 0.10000E+01 volume 0.16490E+01 ppm1 8.173 ppm2 2.167 ASSI { 9359} (segid " " and resid "157 " and name "HN ") (segid " " and resid "157 " and name "HG1 ") 2.700 2.700 0.000 peak 9359 weight 0.10000E+01 volume 0.30340E+01 ppm1 8.173 ppm2 2.339 OR { 9359} (segid " " and resid "157 " and name "HN ") (segid " " and resid "157 " and name "HG2 ") ASSI { 9366} (segid " " and resid "158 " and name "HN ") (segid " " and resid "155 " and name "HA ") 5.000 5.000 0.000 peak 9366 weight 0.10000E+01 volume 0.35600E+00 ppm1 8.301 ppm2 4.487 ASSI { 9368} (segid " " and resid "158 " and name "HN ") (segid " " and resid "157 " and name "HA ") 6.000 6.000 0.000 peak 9368 weight 0.10000E+01 volume 0.23800E+00 ppm1 8.300 ppm2 3.728 ASSI { 9369} (segid " " and resid "158 " and name "HN ") (segid " " and resid "157 " and name "HB2 ") 5.000 5.000 0.000 peak 9369 weight 0.10000E+01 volume 0.11300E+01 ppm1 8.306 ppm2 2.165 ASSI { 9371} (segid " " and resid "158 " and name "HN ") (segid " " and resid "158 " and name "HA ") 5.000 5.000 0.000 peak 9371 weight 0.10000E+01 volume 0.11900E+01 ppm1 8.302 ppm2 4.348 ASSI { 9372} (segid " " and resid "158 " and name "HN ") (segid " " and resid "158 " and name "HB1 ") 3.300 3.300 0.000 peak 9372 weight 0.10000E+01 volume 0.16160E+01 ppm1 8.303 ppm2 2.796 ASSI { 9373} (segid " " and resid "158 " and name "HN ") (segid " " and resid "158 " and name "HB2 ") 5.000 5.000 0.000 peak 9373 weight 0.10000E+01 volume 0.12710E+01 ppm1 8.300 ppm2 2.675 ASSI { 9374} (segid " " and resid "158 " and name "HN ") (segid " " and resid "159 " and name "HN ") 5.000 5.000 0.000 peak 9374 weight 0.10000E+01 volume 0.88600E+00 ppm1 8.299 ppm2 7.375 ASSI { 9377} (segid " " and resid "159 " and name "HN ") (segid " " and resid "156 " and name "HA ") 5.000 5.000 0.000 peak 9377 weight 0.10000E+01 volume 0.53100E+00 ppm1 7.385 ppm2 4.155 ASSI { 9378} (segid " " and resid "159 " and name "HN ") (segid " " and resid "158 " and name "HB1 ") 5.000 5.000 0.000 peak 9378 weight 0.10000E+01 volume 0.68900E+00 ppm1 7.386 ppm2 2.793 ASSI { 9379} (segid " " and resid "159 " and name "HN ") (segid " " and resid "158 " and name "HB2 ") 5.000 5.000 0.000 peak 9379 weight 0.10000E+01 volume 0.60200E+00 ppm1 7.372 ppm2 2.687 ASSI { 9381} (segid " " and resid "159 " and name "HN ") (segid " " and resid "159 " and name "HA ") 5.000 5.000 0.000 peak 9381 weight 0.10000E+01 volume 0.10030E+01 ppm1 7.377 ppm2 3.764 ASSI { 9382} (segid " " and resid "159 " and name "HN ") (segid " " and resid "159 " and name "HB ") 3.300 3.300 0.000 peak 9382 weight 0.10000E+01 volume 0.29120E+01 ppm1 7.380 ppm2 1.864 ASSI { 9383} (segid " " and resid "159 " and name "HN ") (segid " " and resid "159 " and name "HD12") 3.300 3.300 0.000 peak 9383 weight 0.10000E+01 volume 0.17060E+01 ppm1 7.380 ppm2 0.920 OR { 9383} (segid " " and resid "159 " and name "HN ") (segid " " and resid "159 " and name "HD13") OR { 9383} (segid " " and resid "159 " and name "HN ") (segid " " and resid "159 " and name "HD11") ASSI { 9384} (segid " " and resid "159 " and name "HN ") (segid " " and resid "159 " and name "HG11") 3.300 3.300 0.000 peak 9384 weight 0.10000E+01 volume 0.25050E+01 ppm1 7.377 ppm2 1.940 ASSI { 9385} (segid " " and resid "159 " and name "HN ") (segid " " and resid "159 " and name "HG12") 5.000 5.000 0.000 peak 9385 weight 0.10000E+01 volume 0.81600E+00 ppm1 7.379 ppm2 1.143 ASSI { 9386} (segid " " and resid "159 " and name "HN ") (segid " " and resid "159 " and name "HG23") 3.300 3.300 0.000 peak 9386 weight 0.10000E+01 volume 0.15650E+01 ppm1 7.380 ppm2 0.898 OR { 9386} (segid " " and resid "159 " and name "HN ") (segid " " and resid "159 " and name "HG22") OR { 9386} (segid " " and resid "159 " and name "HN ") (segid " " and resid "159 " and name "HG21") ASSI { 9387} (segid " " and resid "159 " and name "HN ") (segid " " and resid "160 " and name "HN ") 5.000 5.000 0.000 peak 9387 weight 0.10000E+01 volume 0.77900E+00 ppm1 7.380 ppm2 7.951 ASSI { 9389} (segid " " and resid "160 " and name "HN ") (segid " " and resid "160 " and name "HA ") 5.000 5.000 0.000 peak 9389 weight 0.10000E+01 volume 0.11800E+01 ppm1 7.941 ppm2 3.882 ASSI { 9390} (segid " " and resid "160 " and name "HN ") (segid " " and resid "160 " and name "HD13") 5.000 5.000 0.000 peak 9390 weight 0.10000E+01 volume 0.62400E+00 ppm1 7.941 ppm2 0.626 OR { 9390} (segid " " and resid "160 " and name "HN ") (segid " " and resid "160 " and name "HD11") OR { 9390} (segid " " and resid "160 " and name "HN ") (segid " " and resid "160 " and name "HD12") ASSI { 9391} (segid " " and resid "160 " and name "HN ") (segid " " and resid "160 " and name "HD23") 5.000 5.000 0.000 peak 9391 weight 0.10000E+01 volume 0.77900E+00 ppm1 7.945 ppm2 0.749 OR { 9391} (segid " " and resid "160 " and name "HN ") (segid " " and resid "160 " and name "HD22") OR { 9391} (segid " " and resid "160 " and name "HN ") (segid " " and resid "160 " and name "HD21") ASSI { 9392} (segid " " and resid "160 " and name "HN ") (segid " " and resid "160 " and name "HG ") 3.300 3.300 0.000 peak 9392 weight 0.10000E+01 volume 0.28580E+01 ppm1 7.943 ppm2 1.771 ASSI { 9397} (segid " " and resid "161 " and name "HN ") (segid " " and resid "158 " and name "HA ") 6.000 6.000 0.000 peak 9397 weight 0.10000E+01 volume 0.18200E+00 ppm1 8.767 ppm2 4.353 ASSI { 9398} (segid " " and resid "161 " and name "HN ") (segid " " and resid "160 " and name "HA ") 5.000 5.000 0.000 peak 9398 weight 0.10000E+01 volume 0.39200E+00 ppm1 8.756 ppm2 3.898 ASSI { 9399} (segid " " and resid "161 " and name "HN ") (segid " " and resid "160 " and name "HB1 ") 5.000 5.000 0.000 peak 9399 weight 0.10000E+01 volume 0.93700E+00 ppm1 8.760 ppm2 1.943 ASSI { 9400} (segid " " and resid "161 " and name "HN ") (segid " " and resid "160 " and name "HB2 ") 5.000 5.000 0.000 peak 9400 weight 0.10000E+01 volume 0.47200E+00 ppm1 8.752 ppm2 1.278 ASSI { 9401} (segid " " and resid "161 " and name "HN ") (segid " " and resid "160 " and name "HD11") 6.000 6.000 0.000 peak 9401 weight 0.10000E+01 volume 0.17300E+00 ppm1 8.763 ppm2 0.634 OR { 9401} (segid " " and resid "161 " and name "HN ") (segid " " and resid "160 " and name "HD12") OR { 9401} (segid " " and resid "161 " and name "HN ") (segid " " and resid "160 " and name "HD13") ASSI { 9402} (segid " " and resid "161 " and name "HN ") (segid " " and resid "160 " and name "HD21") 6.000 6.000 0.000 peak 9402 weight 0.10000E+01 volume 0.21800E+00 ppm1 8.764 ppm2 0.754 OR { 9402} (segid " " and resid "161 " and name "HN ") (segid " " and resid "160 " and name "HD22") OR { 9402} (segid " " and resid "161 " and name "HN ") (segid " " and resid "160 " and name "HD23") ASSI { 9404} (segid " " and resid "161 " and name "HN ") (segid " " and resid "161 " and name "HA ") 5.000 5.000 0.000 peak 9404 weight 0.10000E+01 volume 0.97700E+00 ppm1 8.760 ppm2 4.021 ASSI { 9405} (segid " " and resid "161 " and name "HN ") (segid " " and resid "161 " and name "HB1 ") 3.300 3.300 0.000 peak 9405 weight 0.10000E+01 volume 0.29650E+01 ppm1 8.757 ppm2 2.201 ASSI { 9406} (segid " " and resid "161 " and name "HN ") (segid " " and resid "161 " and name "HB2 ") 3.300 3.300 0.000 peak 9406 weight 0.10000E+01 volume 0.28680E+01 ppm1 8.756 ppm2 2.124 ASSI { 9407} (segid " " and resid "161 " and name "HN ") (segid " " and resid "161 " and name "HG1 ") 5.000 5.000 0.000 peak 9407 weight 0.10000E+01 volume 0.65500E+00 ppm1 8.758 ppm2 2.530 ASSI { 9408} (segid " " and resid "161 " and name "HN ") (segid " " and resid "161 " and name "HG2 ") 5.000 5.000 0.000 peak 9408 weight 0.10000E+01 volume 0.41200E+00 ppm1 8.760 ppm2 2.372 ASSI { 9409} (segid " " and resid "161 " and name "HN ") (segid " " and resid "162 " and name "HN ") 5.000 5.000 0.000 peak 9409 weight 0.10000E+01 volume 0.72900E+00 ppm1 8.757 ppm2 7.580 ASSI { 9415} (segid " " and resid "161 " and name "HE21") (segid " " and resid "161 " and name "HG1 ") 6.000 6.000 0.000 peak 9415 weight 0.10000E+01 volume 0.18700E+00 ppm1 7.190 ppm2 2.527 ASSI { 9416} (segid " " and resid "161 " and name "HE21") (segid " " and resid "161 " and name "HG2 ") 6.000 6.000 0.000 peak 9416 weight 0.10000E+01 volume 0.15900E+00 ppm1 7.185 ppm2 2.377 ASSI { 9418} (segid " " and resid "162 " and name "HN ") (segid " " and resid "162 " and name "HA1 ") 3.300 3.300 0.000 peak 9418 weight 0.10000E+01 volume -0.27270E+01 ppm1 7.581 ppm2 3.951 ASSI { 9419} (segid " " and resid "162 " and name "HN ") (segid " " and resid "163 " and name "HN ") 2.700 2.700 0.000 peak 9419 weight 0.10000E+01 volume -0.44930E+01 ppm1 7.581 ppm2 7.482 ASSI { 9422} (segid " " and resid "163 " and name "HN ") (segid " " and resid "162 " and name "HA1 ") 5.000 5.000 0.000 peak 9422 weight 0.10000E+01 volume 0.38300E+00 ppm1 7.472 ppm2 3.961 ASSI { 9423} (segid " " and resid "163 " and name "HN ") (segid " " and resid "162 " and name "HA2 ") 5.000 5.000 0.000 peak 9423 weight 0.10000E+01 volume 0.41900E+00 ppm1 7.478 ppm2 3.812 ASSI { 9424} (segid " " and resid "163 " and name "HN ") (segid " " and resid "163 " and name "HA ") 5.000 5.000 0.000 peak 9424 weight 0.10000E+01 volume 0.31600E+00 ppm1 7.473 ppm2 4.620 ASSI { 9425} (segid " " and resid "163 " and name "HN ") (segid " " and resid "163 " and name "HB1 ") 5.000 5.000 0.000 peak 9425 weight 0.10000E+01 volume 0.42900E+00 ppm1 7.475 ppm2 3.265 ASSI { 9426} (segid " " and resid "163 " and name "HN ") (segid " " and resid "163 " and name "HB2 ") 5.000 5.000 0.000 peak 9426 weight 0.10000E+01 volume 0.10770E+01 ppm1 7.474 ppm2 2.722 ASSI { 9427} (segid " " and resid "163 " and name "HN ") (segid " " and resid "163 " and name "HD2 ") 6.000 6.000 0.000 peak 9427 weight 0.10000E+01 volume 0.20100E+00 ppm1 7.481 ppm2 7.006 ASSI { 9429} (segid " " and resid "164 " and name "HN ") (segid " " and resid "161 " and name "HA ") 5.000 5.000 0.000 peak 9429 weight 0.10000E+01 volume 0.32200E+00 ppm1 7.601 ppm2 4.017 ASSI { 9430} (segid " " and resid "164 " and name "HN ") (segid " " and resid "163 " and name "HA ") 6.000 6.000 0.000 peak 9430 weight 0.10000E+01 volume 0.23000E+00 ppm1 7.604 ppm2 4.636 ASSI { 9431} (segid " " and resid "164 " and name "HN ") (segid " " and resid "163 " and name "HN ") 5.000 5.000 0.000 peak 9431 weight 0.10000E+01 volume 0.14240E+01 ppm1 7.600 ppm2 7.463 ASSI { 9432} (segid " " and resid "164 " and name "HN ") (segid " " and resid "164 " and name "HA ") 5.000 5.000 0.000 peak 9432 weight 0.10000E+01 volume 0.66300E+00 ppm1 7.599 ppm2 4.502 ASSI { 9433} (segid " " and resid "164 " and name "HN ") (segid " " and resid "164 " and name "HB1 ") 5.000 5.000 0.000 peak 9433 weight 0.10000E+01 volume 0.95800E+00 ppm1 7.599 ppm2 2.301 ASSI { 9434} (segid " " and resid "164 " and name "HN ") (segid " " and resid "164 " and name "HB2 ") 5.000 5.000 0.000 peak 9434 weight 0.10000E+01 volume 0.11000E+01 ppm1 7.600 ppm2 1.945 ASSI { 9435} (segid " " and resid "164 " and name "HN ") (segid " " and resid "164 " and name "HG1 ") 5.000 5.000 0.000 peak 9435 weight 0.10000E+01 volume 0.89700E+00 ppm1 7.604 ppm2 2.713 ASSI { 9436} (segid " " and resid "164 " and name "HN ") (segid " " and resid "164 " and name "HG2 ") 5.000 5.000 0.000 peak 9436 weight 0.10000E+01 volume 0.90600E+00 ppm1 7.601 ppm2 2.354 ASSI { 9438} (segid " " and resid "166 " and name "HN ") (segid " " and resid "165 " and name "HA ") 3.300 3.300 0.000 peak 9438 weight 0.10000E+01 volume 0.16860E+01 ppm1 8.104 ppm2 4.493 ASSI { 9439} (segid " " and resid "166 " and name "HN ") (segid " " and resid "165 " and name "HB2 ") 5.000 5.000 0.000 peak 9439 weight 0.10000E+01 volume 0.30200E+00 ppm1 8.110 ppm2 2.103 OR { 9439} (segid " " and resid "166 " and name "HN ") (segid " " and resid "165 " and name "HB1 ") ASSI { 9440} (segid " " and resid "166 " and name "HN ") (segid " " and resid "166 " and name "HA ") 3.300 3.300 0.000 peak 9440 weight 0.10000E+01 volume 0.16990E+01 ppm1 8.102 ppm2 4.532 ASSI { 9441} (segid " " and resid "166 " and name "HN ") (segid " " and resid "166 " and name "HB ") 5.000 5.000 0.000 peak 9441 weight 0.10000E+01 volume 0.62400E+00 ppm1 8.101 ppm2 1.915 ASSI { 9442} (segid " " and resid "166 " and name "HN ") (segid " " and resid "166 " and name "HG11") 6.000 6.000 0.000 peak 9442 weight 0.10000E+01 volume 0.20500E+00 ppm1 8.109 ppm2 1.552 ASSI { 9444} (segid " " and resid "168 " and name "HN ") (segid " " and resid "167 " and name "HA ") 3.300 3.300 0.000 peak 9444 weight 0.10000E+01 volume 0.29170E+01 ppm1 7.957 ppm2 4.454 ASSI { 9445} (segid " " and resid "168 " and name "HN ") (segid " " and resid "168 " and name "HA ") 5.000 5.000 0.000 peak 9445 weight 0.10000E+01 volume 0.35300E+00 ppm1 7.955 ppm2 4.298 ASSI { 9446} (segid " " and resid "168 " and name "HN ") (segid " " and resid "168 " and name "HB2 ") 5.000 5.000 0.000 peak 9446 weight 0.10000E+01 volume 0.44000E+00 ppm1 7.958 ppm2 1.970 ASSI { 1087} (segid " " and resid "8 " and name "HN ") (segid " " and resid "9 " and name "HN ") 7.000 7.000 0.000 peak 1087 weight 0.10000E+01 volume 0.39000E-01 ppm1 8.312 ppm2 8.581 ASSI { 1092} (segid " " and resid "12 " and name "HN ") (segid " " and resid "13 " and name "HN ") 7.000 7.000 0.000 peak 1092 weight 0.10000E+01 volume 0.11900E+00 ppm1 8.073 ppm2 7.992 ASSI { 1093} (segid " " and resid "12 " and name "HN ") (segid " " and resid "14 " and name "HN ") 7.000 7.000 0.000 peak 1093 weight 0.10000E+01 volume 0.17000E+00 ppm1 8.072 ppm2 8.351 ASSI { 1094} (segid " " and resid "12 " and name "HN ") (segid " " and resid "42 " and name "HN ") 7.000 7.000 0.000 peak 1094 weight 0.10000E+01 volume 0.60000E-01 ppm1 8.057 ppm2 9.857 ASSI { 1096} (segid " " and resid "13 " and name "HN ") (segid " " and resid "14 " and name "HN ") 7.000 7.000 0.000 peak 1096 weight 0.10000E+01 volume 0.23000E+00 ppm1 7.995 ppm2 8.348 ASSI { 1099} (segid " " and resid "14 " and name "HN ") (segid " " and resid "15 " and name "HN ") 5.000 5.000 0.000 peak 1099 weight 0.10000E+01 volume 0.21650E+01 ppm1 8.341 ppm2 8.247 ASSI { 1100} (segid " " and resid "14 " and name "HN ") (segid " " and resid "16 " and name "HN ") 5.000 5.000 0.000 peak 1100 weight 0.10000E+01 volume 0.52400E+00 ppm1 8.341 ppm2 8.339 ASSI { 1101} (segid " " and resid "14 " and name "HN ") (segid " " and resid "17 " and name "HN ") 5.000 5.000 0.000 peak 1101 weight 0.10000E+01 volume 0.33500E+00 ppm1 8.348 ppm2 7.619 ASSI { 1105} (segid " " and resid "15 " and name "HN ") (segid " " and resid "17 " and name "HN ") 7.000 7.000 0.000 peak 1105 weight 0.10000E+01 volume 0.20300E+00 ppm1 8.244 ppm2 7.616 ASSI { 1106} (segid " " and resid "15 " and name "HN ") (segid " " and resid "18 " and name "HN ") 7.000 7.000 0.000 peak 1106 weight 0.10000E+01 volume 0.12400E+00 ppm1 8.243 ppm2 8.357 ASSI { 1107} (segid " " and resid "15 " and name "HN ") (segid " " and resid "47 " and name "HN ") 7.000 7.000 0.000 peak 1107 weight 0.10000E+01 volume 0.29000E-01 ppm1 8.220 ppm2 10.259 ASSI { 1111} (segid " " and resid "16 " and name "HN ") (segid " " and resid "18 " and name "HN ") 5.000 5.000 0.000 peak 1111 weight 0.10000E+01 volume 0.44400E+00 ppm1 8.339 ppm2 8.356 ASSI { 1112} (segid " " and resid "16 " and name "HN ") (segid " " and resid "19 " and name "HN ") 7.000 7.000 0.000 peak 1112 weight 0.10000E+01 volume 0.16600E+00 ppm1 8.326 ppm2 8.969 ASSI { 1117} (segid " " and resid "17 " and name "HN ") (segid " " and resid "19 " and name "HN ") 5.000 5.000 0.000 peak 1117 weight 0.10000E+01 volume 0.49600E+00 ppm1 7.616 ppm2 8.965 ASSI { 1118} (segid " " and resid "17 " and name "HN ") (segid " " and resid "20 " and name "HN ") 7.000 7.000 0.000 peak 1118 weight 0.10000E+01 volume 0.10500E+00 ppm1 7.618 ppm2 7.413 ASSI { 1123} (segid " " and resid "18 " and name "HN ") (segid " " and resid "20 " and name "HN ") 5.000 5.000 0.000 peak 1123 weight 0.10000E+01 volume 0.37400E+00 ppm1 8.351 ppm2 7.413 ASSI { 1124} (segid " " and resid "18 " and name "HN ") (segid " " and resid "21 " and name "HN ") 7.000 7.000 0.000 peak 1124 weight 0.10000E+01 volume 0.14000E+00 ppm1 8.357 ppm2 7.900 ASSI { 1125} (segid " " and resid "18 " and name "HN ") (segid " " and resid "52 " and name "HN ") 7.000 7.000 0.000 peak 1125 weight 0.10000E+01 volume 0.81000E-01 ppm1 8.366 ppm2 7.139 ASSI { 1130} (segid " " and resid "19 " and name "HN ") (segid " " and resid "21 " and name "HN ") 5.000 5.000 0.000 peak 1130 weight 0.10000E+01 volume 0.44800E+00 ppm1 8.970 ppm2 7.900 ASSI { 1131} (segid " " and resid "19 " and name "HN ") (segid " " and resid "22 " and name "HN ") 7.000 7.000 0.000 peak 1131 weight 0.10000E+01 volume 0.12000E+00 ppm1 8.977 ppm2 8.160 ASSI { 1132} (segid " " and resid "19 " and name "HN ") (segid " " and resid "52 " and name "HN ") 7.000 7.000 0.000 peak 1132 weight 0.10000E+01 volume 0.11900E+00 ppm1 8.960 ppm2 7.143 ASSI { 1137} (segid " " and resid "20 " and name "HN ") (segid " " and resid "22 " and name "HN ") 5.000 5.000 0.000 peak 1137 weight 0.10000E+01 volume 0.89400E+00 ppm1 7.410 ppm2 8.154 ASSI { 1138} (segid " " and resid "20 " and name "HN ") (segid " " and resid "52 " and name "HN ") 7.000 7.000 0.000 peak 1138 weight 0.10000E+01 volume 0.19600E+00 ppm1 7.413 ppm2 7.145 ASSI { 1143} (segid " " and resid "21 " and name "HN ") (segid " " and resid "52 " and name "HN ") 5.000 5.000 0.000 peak 1143 weight 0.10000E+01 volume 0.49600E+00 ppm1 7.900 ppm2 7.138 ASSI { 1147} (segid " " and resid "22 " and name "HN ") (segid " " and resid "23 " and name "HN ") 5.000 5.000 0.000 peak 1147 weight 0.10000E+01 volume 0.40400E+00 ppm1 8.158 ppm2 7.866 ASSI { 1148} (segid " " and resid "22 " and name "HN ") (segid " " and resid "24 " and name "HN ") 5.000 5.000 0.000 peak 1148 weight 0.10000E+01 volume 0.58000E+00 ppm1 8.149 ppm2 8.438 ASSI { 1149} (segid " " and resid "22 " and name "HN ") (segid " " and resid "25 " and name "HN ") 5.000 5.000 0.000 peak 1149 weight 0.10000E+01 volume 0.15000E+01 ppm1 8.135 ppm2 7.750 ASSI { 1150} (segid " " and resid "22 " and name "HN ") (segid " " and resid "52 " and name "HN ") 7.000 7.000 0.000 peak 1150 weight 0.10000E+01 volume 0.12000E+00 ppm1 8.154 ppm2 7.137 ASSI { 1153} (segid " " and resid "23 " and name "HN ") (segid " " and resid "25 " and name "HN ") 5.000 5.000 0.000 peak 1153 weight 0.10000E+01 volume 0.61900E+00 ppm1 7.871 ppm2 7.751 ASSI { 1154} (segid " " and resid "23 " and name "HN ") (segid " " and resid "26 " and name "HN ") 5.000 5.000 0.000 peak 1154 weight 0.10000E+01 volume 0.48600E+00 ppm1 7.871 ppm2 8.139 ASSI { 1158} (segid " " and resid "24 " and name "HN ") (segid " " and resid "26 " and name "HN ") 5.000 5.000 0.000 peak 1158 weight 0.10000E+01 volume 0.63500E+00 ppm1 8.439 ppm2 8.122 ASSI { 1163} (segid " " and resid "25 " and name "HN ") (segid " " and resid "27 " and name "HN ") 5.000 5.000 0.000 peak 1163 weight 0.10000E+01 volume 0.39400E+00 ppm1 7.754 ppm2 8.399 ASSI { 1164} (segid " " and resid "25 " and name "HN ") (segid " " and resid "28 " and name "HN ") 5.000 5.000 0.000 peak 1164 weight 0.10000E+01 volume 0.21720E+01 ppm1 7.752 ppm2 8.130 ASSI { 1168} (segid " " and resid "26 " and name "HN ") (segid " " and resid "27 " and name "HN ") 3.000 3.000 0.000 peak 1168 weight 0.10000E+01 volume 0.39200E+01 ppm1 8.113 ppm2 8.404 ASSI { 1172} (segid " " and resid "27 " and name "HN ") (segid " " and resid "28 " and name "HN ") 3.000 3.000 0.000 peak 1172 weight 0.10000E+01 volume 0.42560E+01 ppm1 8.397 ppm2 8.131 ASSI { 1176} (segid " " and resid "28 " and name "HN ") (segid " " and resid "30 " and name "HN ") 5.000 5.000 0.000 peak 1176 weight 0.10000E+01 volume 0.43300E+00 ppm1 8.132 ppm2 8.141 ASSI { 1177} (segid " " and resid "28 " and name "HN ") (segid " " and resid "31 " and name "HN ") 7.000 7.000 0.000 peak 1177 weight 0.10000E+01 volume 0.12000E+00 ppm1 8.140 ppm2 8.744 ASSI { 1181} (segid " " and resid "29 " and name "HN ") (segid " " and resid "31 " and name "HN ") 7.000 7.000 0.000 peak 1181 weight 0.10000E+01 volume 0.25800E+00 ppm1 8.576 ppm2 8.744 ASSI { 1182} (segid " " and resid "29 " and name "HN ") (segid " " and resid "32 " and name "HN ") 5.000 5.000 0.000 peak 1182 weight 0.10000E+01 volume 0.55000E+00 ppm1 8.578 ppm2 8.403 ASSI { 1183} (segid " " and resid "29 " and name "HN ") (segid " " and resid "33 " and name "HN ") 5.000 5.000 0.000 peak 1183 weight 0.10000E+01 volume 0.43500E+00 ppm1 8.580 ppm2 7.556 ASSI { 1188} (segid " " and resid "30 " and name "HN ") (segid " " and resid "32 " and name "HN ") 5.000 5.000 0.000 peak 1188 weight 0.10000E+01 volume 0.50200E+00 ppm1 8.141 ppm2 8.403 ASSI { 1189} (segid " " and resid "30 " and name "HN ") (segid " " and resid "33 " and name "HN ") 7.000 7.000 0.000 peak 1189 weight 0.10000E+01 volume 0.24700E+00 ppm1 8.136 ppm2 7.549 ASSI { 1194} (segid " " and resid "31 " and name "HN ") (segid " " and resid "33 " and name "HN ") 5.000 5.000 0.000 peak 1194 weight 0.10000E+01 volume 0.60200E+00 ppm1 8.743 ppm2 7.556 ASSI { 1195} (segid " " and resid "31 " and name "HN ") (segid " " and resid "34 " and name "HN ") 7.000 7.000 0.000 peak 1195 weight 0.10000E+01 volume 0.14000E+00 ppm1 8.743 ppm2 6.805 ASSI { 1200} (segid " " and resid "32 " and name "HN ") (segid " " and resid "34 " and name "HN ") 5.000 5.000 0.000 peak 1200 weight 0.10000E+01 volume 0.48100E+00 ppm1 8.403 ppm2 6.805 ASSI { 1213} (segid " " and resid "35 " and name "HN ") (segid " " and resid "32 " and name "HN ") 5.000 5.000 0.000 peak 1213 weight 0.10000E+01 volume 0.30200E+00 ppm1 7.973 ppm2 8.404 ASSI { 1215} (segid " " and resid "35 " and name "HN ") (segid " " and resid "36 " and name "HN ") 7.000 7.000 0.000 peak 1215 weight 0.10000E+01 volume -0.19100E+00 ppm1 7.966 ppm2 8.798 ASSI { 1217} (segid " " and resid "36 " and name "HN ") (segid " " and resid "38 " and name "HN ") 7.000 7.000 0.000 peak 1217 weight 0.10000E+01 volume -0.52000E-01 ppm1 8.794 ppm2 10.205 ASSI { 1218} (segid " " and resid "36 " and name "HN ") (segid " " and resid "39 " and name "HN ") 7.000 7.000 0.000 peak 1218 weight 0.10000E+01 volume -0.15000E+00 ppm1 8.797 ppm2 7.869 ASSI { 1220} (segid " " and resid "38 " and name "HN ") (segid " " and resid "40 " and name "HN ") 7.000 7.000 0.000 peak 1220 weight 0.10000E+01 volume 0.44000E-01 ppm1 10.209 ppm2 8.297 ASSI { 1223} (segid " " and resid "39 " and name "HN ") (segid " " and resid "40 " and name "HN ") 7.000 7.000 0.000 peak 1223 weight 0.10000E+01 volume 0.20400E+00 ppm1 7.859 ppm2 8.298 ASSI { 1229} (segid " " and resid "41 " and name "HN ") (segid " " and resid "41 " and name "HD21") 7.000 7.000 0.000 peak 1229 weight 0.10000E+01 volume 0.14900E+00 ppm1 8.836 ppm2 7.932 ASSI { 1230} (segid " " and resid "41 " and name "HN ") (segid " " and resid "41 " and name "HD22") 7.000 7.000 0.000 peak 1230 weight 0.10000E+01 volume 0.17300E+00 ppm1 8.840 ppm2 5.884 ASSI { 1231} (segid " " and resid "41 " and name "HN ") (segid " " and resid "42 " and name "HN ") 7.000 7.000 0.000 peak 1231 weight 0.10000E+01 volume 0.18200E+00 ppm1 8.848 ppm2 9.844 ASSI { 1232} (segid " " and resid "41 " and name "HN ") (segid " " and resid "43 " and name "HN ") 5.000 5.000 0.000 peak 1232 weight 0.10000E+01 volume 0.35400E+00 ppm1 8.848 ppm2 7.931 ASSI { 1233} (segid " " and resid "41 " and name "HN ") (segid " " and resid "44 " and name "HN ") 5.000 5.000 0.000 peak 1233 weight 0.10000E+01 volume 0.45000E+00 ppm1 8.847 ppm2 8.487 ASSI { 1234} (segid " " and resid "41 " and name "HN ") (segid " " and resid "46 " and name "HN ") 7.000 7.000 0.000 peak 1234 weight 0.10000E+01 volume 0.11700E+00 ppm1 8.844 ppm2 9.219 ASSI { 1238} (segid " " and resid "42 " and name "HN ") (segid " " and resid "44 " and name "HN ") 5.000 5.000 0.000 peak 1238 weight 0.10000E+01 volume 0.45900E+00 ppm1 9.844 ppm2 8.487 ASSI { 1239} (segid " " and resid "42 " and name "HN ") (segid " " and resid "45 " and name "HN ") 7.000 7.000 0.000 peak 1239 weight 0.10000E+01 volume 0.15500E+00 ppm1 9.847 ppm2 7.451 ASSI { 1240} (segid " " and resid "43 " and name "HN ") (segid " " and resid "41 " and name "HD22") 7.000 7.000 0.000 peak 1240 weight 0.10000E+01 volume 0.88000E-01 ppm1 7.909 ppm2 5.884 ASSI { 1250} (segid " " and resid "45 " and name "HN ") (segid " " and resid "41 " and name "HD21") 7.000 7.000 0.000 peak 1250 weight 0.10000E+01 volume 0.96000E-01 ppm1 7.441 ppm2 7.932 ASSI { 1251} (segid " " and resid "45 " and name "HN ") (segid " " and resid "41 " and name "HD22") 7.000 7.000 0.000 peak 1251 weight 0.10000E+01 volume 0.99000E-01 ppm1 7.444 ppm2 5.884 ASSI { 1255} (segid " " and resid "45 " and name "HN ") (segid " " and resid "46 " and name "HN ") 7.000 7.000 0.000 peak 1255 weight 0.10000E+01 volume 0.12600E+00 ppm1 7.451 ppm2 9.206 ASSI { 1258} (segid " " and resid "46 " and name "HN ") (segid " " and resid "47 " and name "HN ") 7.000 7.000 0.000 peak 1258 weight 0.10000E+01 volume 0.86000E-01 ppm1 9.216 ppm2 10.254 ASSI { 1259} (segid " " and resid "46 " and name "HN ") (segid " " and resid "48 " and name "HN ") 7.000 7.000 0.000 peak 1259 weight 0.10000E+01 volume 0.12300E+00 ppm1 9.219 ppm2 8.373 ASSI { 1261} (segid " " and resid "46 " and name "HN ") (segid " " and resid "50 " and name "HN ") 7.000 7.000 0.000 peak 1261 weight 0.10000E+01 volume 0.45000E-01 ppm1 9.218 ppm2 7.156 ASSI { 1263} (segid " " and resid "47 " and name "HN ") (segid " " and resid "48 " and name "HN ") 5.000 5.000 0.000 peak 1263 weight 0.10000E+01 volume 0.67600E+00 ppm1 10.252 ppm2 8.373 ASSI { 1264} (segid " " and resid "47 " and name "HN ") (segid " " and resid "49 " and name "HN ") 7.000 7.000 0.000 peak 1264 weight 0.10000E+01 volume 0.13200E+00 ppm1 10.255 ppm2 7.377 ASSI { 1269} (segid " " and resid "48 " and name "HN ") (segid " " and resid "51 " and name "HN ") 7.000 7.000 0.000 peak 1269 weight 0.10000E+01 volume 0.10800E+00 ppm1 8.365 ppm2 6.843 ASSI { 1270} (segid " " and resid "49 " and name "HN ") (segid " " and resid "46 " and name "HN ") 5.000 5.000 0.000 peak 1270 weight 0.10000E+01 volume 0.33000E+00 ppm1 7.376 ppm2 9.220 ASSI { 1274} (segid " " and resid "49 " and name "HN ") (segid " " and resid "51 " and name "HN ") 5.000 5.000 0.000 peak 1274 weight 0.10000E+01 volume 0.61000E+00 ppm1 7.378 ppm2 6.843 ASSI { 1275} (segid " " and resid "49 " and name "HE21") (segid " " and resid "72 " and name "HN ") 7.000 7.000 0.000 peak 1275 weight 0.10000E+01 volume 0.98000E-01 ppm1 8.448 ppm2 8.198 ASSI { 1276} (segid " " and resid "49 " and name "HE22") (segid " " and resid "72 " and name "HN ") 7.000 7.000 0.000 peak 1276 weight 0.10000E+01 volume 0.84000E-01 ppm1 6.122 ppm2 8.198 ASSI { 1281} (segid " " and resid "50 " and name "HN ") (segid " " and resid "48 " and name "HN ") 5.000 5.000 0.000 peak 1281 weight 0.10000E+01 volume 0.37700E+00 ppm1 7.180 ppm2 8.366 ASSI { 1287} (segid " " and resid "51 " and name "HN ") (segid " " and resid "52 " and name "HN ") 7.000 7.000 0.000 peak 1287 weight 0.10000E+01 volume 0.15500E+00 ppm1 6.843 ppm2 7.139 ASSI { 1295} (segid " " and resid "52 " and name "HN ") (segid " " and resid "53 " and name "HN ") 7.000 7.000 0.000 peak 1295 weight 0.10000E+01 volume -0.29800E+00 ppm1 7.143 ppm2 8.284 ASSI { 1297} (segid " " and resid "53 " and name "HN ") (segid " " and resid "54 " and name "HN ") 5.000 5.000 0.000 peak 1297 weight 0.10000E+01 volume 0.33300E+00 ppm1 8.295 ppm2 7.871 ASSI { 1298} (segid " " and resid "53 " and name "HN ") (segid " " and resid "55 " and name "HN ") 7.000 7.000 0.000 peak 1298 weight 0.10000E+01 volume -0.13300E+00 ppm1 8.294 ppm2 7.488 ASSI { 1306} (segid " " and resid "57 " and name "HN ") (segid " " and resid "60 " and name "HN ") 7.000 7.000 0.000 peak 1306 weight 0.10000E+01 volume 0.53000E-01 ppm1 8.044 ppm2 8.401 ASSI { 1310} (segid " " and resid "58 " and name "HN ") (segid " " and resid "60 " and name "HN ") 5.000 5.000 0.000 peak 1310 weight 0.10000E+01 volume 0.39600E+00 ppm1 7.801 ppm2 8.382 ASSI { 1311} (segid " " and resid "58 " and name "HN ") (segid " " and resid "61 " and name "HN ") 7.000 7.000 0.000 peak 1311 weight 0.10000E+01 volume 0.73000E-01 ppm1 7.805 ppm2 7.634 ASSI { 1312} (segid " " and resid "59 " and name "HN ") (segid " " and resid "57 " and name "HN ") 5.000 5.000 0.000 peak 1312 weight 0.10000E+01 volume 0.52200E+00 ppm1 7.073 ppm2 8.037 ASSI { 1316} (segid " " and resid "59 " and name "HN ") (segid " " and resid "62 " and name "HN ") 7.000 7.000 0.000 peak 1316 weight 0.10000E+01 volume 0.76000E-01 ppm1 7.066 ppm2 7.493 ASSI { 1321} (segid " " and resid "60 " and name "HN ") (segid " " and resid "62 " and name "HN ") 5.000 5.000 0.000 peak 1321 weight 0.10000E+01 volume 0.81400E+00 ppm1 8.382 ppm2 7.512 ASSI { 1322} (segid " " and resid "60 " and name "HN ") (segid " " and resid "63 " and name "HN ") 5.000 5.000 0.000 peak 1322 weight 0.10000E+01 volume 0.56200E+00 ppm1 8.388 ppm2 8.587 ASSI { 1324} (segid " " and resid "61 " and name "HN ") (segid " " and resid "59 " and name "HN ") 5.000 5.000 0.000 peak 1324 weight 0.10000E+01 volume 0.31900E+00 ppm1 7.632 ppm2 7.062 ASSI { 1327} (segid " " and resid "61 " and name "HN ") (segid " " and resid "63 " and name "HN ") 5.000 5.000 0.000 peak 1327 weight 0.10000E+01 volume 0.33500E+00 ppm1 7.632 ppm2 8.586 ASSI { 1328} (segid " " and resid "61 " and name "HN ") (segid " " and resid "64 " and name "HN ") 7.000 7.000 0.000 peak 1328 weight 0.10000E+01 volume 0.11400E+00 ppm1 7.629 ppm2 8.951 ASSI { 1333} (segid " " and resid "62 " and name "HN ") (segid " " and resid "64 " and name "HN ") 5.000 5.000 0.000 peak 1333 weight 0.10000E+01 volume 0.31200E+00 ppm1 7.499 ppm2 8.951 ASSI { 1334} (segid " " and resid "62 " and name "HN ") (segid " " and resid "65 " and name "HN ") 7.000 7.000 0.000 peak 1334 weight 0.10000E+01 volume 0.10700E+00 ppm1 7.505 ppm2 6.995 ASSI { 1341} (segid " " and resid "63 " and name "HN ") (segid " " and resid "65 " and name "HN ") 5.000 5.000 0.000 peak 1341 weight 0.10000E+01 volume 0.40200E+00 ppm1 8.594 ppm2 6.995 ASSI { 1346} (segid " " and resid "64 " and name "HN ") (segid " " and resid "66 " and name "HN ") 5.000 5.000 0.000 peak 1346 weight 0.10000E+01 volume -0.46900E+00 ppm1 8.950 ppm2 7.597 ASSI { 1347} (segid " " and resid "64 " and name "HN ") (segid " " and resid "67 " and name "HN ") 7.000 7.000 0.000 peak 1347 weight 0.10000E+01 volume 0.28700E+00 ppm1 8.950 ppm2 8.019 ASSI { 1352} (segid " " and resid "65 " and name "HN ") (segid " " and resid "67 " and name "HN ") 5.000 5.000 0.000 peak 1352 weight 0.10000E+01 volume 0.10370E+01 ppm1 6.994 ppm2 8.019 ASSI { 1355} (segid " " and resid "66 " and name "HN ") (segid " " and resid "67 " and name "HN ") 3.000 3.000 0.000 peak 1355 weight 0.10000E+01 volume -0.32290E+01 ppm1 7.597 ppm2 8.021 ASSI { 1363} (segid " " and resid "70 " and name "HN ") (segid " " and resid "70 " and name "HD22") 7.000 7.000 0.000 peak 1363 weight 0.10000E+01 volume 0.24000E+00 ppm1 7.993 ppm2 6.886 ASSI { 1365} (segid " " and resid "70 " and name "HN ") (segid " " and resid "101 " and name "HN ") 7.000 7.000 0.000 peak 1365 weight 0.10000E+01 volume 0.78000E-01 ppm1 8.000 ppm2 8.969 ASSI { 1366} (segid " " and resid "70 " and name "HD22") (segid " " and resid "101 " and name "HN ") 5.000 5.000 0.000 peak 1366 weight 0.10000E+01 volume 0.49900E+00 ppm1 6.887 ppm2 8.963 ASSI { 1374} (segid " " and resid "72 " and name "HN ") (segid " " and resid "73 " and name "HN ") 7.000 7.000 0.000 peak 1374 weight 0.10000E+01 volume 0.26500E+00 ppm1 8.200 ppm2 7.980 ASSI { 1375} (segid " " and resid "72 " and name "HE21") (segid " " and resid "105 " and name "HN ") 7.000 7.000 0.000 peak 1375 weight 0.10000E+01 volume 0.15100E+00 ppm1 7.796 ppm2 8.193 ASSI { 1376} (segid " " and resid "72 " and name "HE22") (segid " " and resid "105 " and name "HN ") 7.000 7.000 0.000 peak 1376 weight 0.10000E+01 volume 0.95000E-01 ppm1 6.724 ppm2 8.193 ASSI { 1378} (segid " " and resid "73 " and name "HN ") (segid " " and resid "49 " and name "HE21") 5.000 5.000 0.000 peak 1378 weight 0.10000E+01 volume 0.37200E+00 ppm1 7.990 ppm2 8.456 ASSI { 1379} (segid " " and resid "73 " and name "HN ") (segid " " and resid "49 " and name "HE22") 5.000 5.000 0.000 peak 1379 weight 0.10000E+01 volume 0.32400E+00 ppm1 7.987 ppm2 6.117 ASSI { 1381} (segid " " and resid "73 " and name "HN ") (segid " " and resid "75 " and name "HN ") 7.000 7.000 0.000 peak 1381 weight 0.10000E+01 volume 0.21800E+00 ppm1 7.990 ppm2 8.355 ASSI { 1382} (segid " " and resid "73 " and name "HN ") (segid " " and resid "76 " and name "HN ") 5.000 5.000 0.000 peak 1382 weight 0.10000E+01 volume 0.60300E+00 ppm1 7.991 ppm2 8.361 ASSI { 1384} (segid " " and resid "73 " and name "HN ") (segid " " and resid "78 " and name "HN ") 7.000 7.000 0.000 peak 1384 weight 0.10000E+01 volume -0.52000E-01 ppm1 7.982 ppm2 10.181 ASSI { 1386} (segid " " and resid "75 " and name "HN ") (segid " " and resid "76 " and name "HN ") 5.000 5.000 0.000 peak 1386 weight 0.10000E+01 volume 0.15000E+01 ppm1 8.355 ppm2 8.363 ASSI { 1391} (segid " " and resid "77 " and name "HN ") (segid " " and resid "73 " and name "HN ") 3.000 3.000 0.000 peak 1391 weight 0.10000E+01 volume 0.31220E+01 ppm1 8.148 ppm2 7.992 ASSI { 1394} (segid " " and resid "77 " and name "HN ") (segid " " and resid "78 " and name "HN ") 7.000 7.000 0.000 peak 1394 weight 0.10000E+01 volume -0.10100E+00 ppm1 8.164 ppm2 10.194 ASSI { 1397} (segid " " and resid "78 " and name "HN ") (segid " " and resid "80 " and name "HN ") 7.000 7.000 0.000 peak 1397 weight 0.10000E+01 volume -0.14200E+00 ppm1 10.179 ppm2 8.470 ASSI { 1398} (segid " " and resid "78 " and name "HN ") (segid " " and resid "81 " and name "HN ") 5.000 5.000 0.000 peak 1398 weight 0.10000E+01 volume -0.37400E+00 ppm1 10.187 ppm2 7.711 ASSI { 1399} (segid " " and resid "78 " and name "HN ") (segid " " and resid "82 " and name "HN ") 7.000 7.000 0.000 peak 1399 weight 0.10000E+01 volume -0.12300E+00 ppm1 10.185 ppm2 7.359 ASSI { 1402} (segid " " and resid "80 " and name "HN ") (segid " " and resid "82 " and name "HN ") 5.000 5.000 0.000 peak 1402 weight 0.10000E+01 volume 0.34200E+00 ppm1 8.466 ppm2 7.377 ASSI { 1403} (segid " " and resid "80 " and name "HN ") (segid " " and resid "83 " and name "HN ") 7.000 7.000 0.000 peak 1403 weight 0.10000E+01 volume 0.38000E-01 ppm1 8.472 ppm2 8.758 ASSI { 1409} (segid " " and resid "81 " and name "HE2 ") (segid " " and resid "105 " and name "HN ") 7.000 7.000 0.000 peak 1409 weight 0.10000E+01 volume -0.11200E+00 ppm1 11.096 ppm2 8.218 ASSI { 1411} (segid " " and resid "81 " and name "HE2 ") (segid " " and resid "110 " and name "HN ") 7.000 7.000 0.000 peak 1411 weight 0.10000E+01 volume -0.12800E+00 ppm1 11.098 ppm2 7.998 ASSI { 1417} (segid " " and resid "82 " and name "HN ") (segid " " and resid "84 " and name "HN ") 5.000 5.000 0.000 peak 1417 weight 0.10000E+01 volume 0.31800E+00 ppm1 7.382 ppm2 7.848 ASSI { 1418} (segid " " and resid "82 " and name "HN ") (segid " " and resid "85 " and name "HN ") 7.000 7.000 0.000 peak 1418 weight 0.10000E+01 volume 0.10000E+00 ppm1 7.376 ppm2 8.632 ASSI { 1422} (segid " " and resid "83 " and name "HN ") (segid " " and resid "81 " and name "HN ") 5.000 5.000 0.000 peak 1422 weight 0.10000E+01 volume 0.42200E+00 ppm1 8.753 ppm2 7.722 ASSI { 1425} (segid " " and resid "83 " and name "HN ") (segid " " and resid "85 " and name "HN ") 5.000 5.000 0.000 peak 1425 weight 0.10000E+01 volume 0.38600E+00 ppm1 8.759 ppm2 8.637 ASSI { 1427} (segid " " and resid "84 " and name "HN ") (segid " " and resid "81 " and name "HN ") 5.000 5.000 0.000 peak 1427 weight 0.10000E+01 volume 0.44700E+00 ppm1 7.854 ppm2 7.726 ASSI { 1431} (segid " " and resid "84 " and name "HN ") (segid " " and resid "86 " and name "HN ") 5.000 5.000 0.000 peak 1431 weight 0.10000E+01 volume -0.38900E+00 ppm1 7.845 ppm2 7.652 ASSI { 1432} (segid " " and resid "84 " and name "HN ") (segid " " and resid "87 " and name "HN ") 7.000 7.000 0.000 peak 1432 weight 0.10000E+01 volume 0.11600E+00 ppm1 7.848 ppm2 7.093 ASSI { 1433} (segid " " and resid "84 " and name "HN ") (segid " " and resid "88 " and name "HN ") 7.000 7.000 0.000 peak 1433 weight 0.10000E+01 volume 0.10900E+00 ppm1 7.853 ppm2 7.593 ASSI { 1438} (segid " " and resid "85 " and name "HN ") (segid " " and resid "87 " and name "HN ") 5.000 5.000 0.000 peak 1438 weight 0.10000E+01 volume 0.43200E+00 ppm1 8.634 ppm2 7.085 ASSI { 1439} (segid " " and resid "85 " and name "HN ") (segid " " and resid "88 " and name "HN ") 7.000 7.000 0.000 peak 1439 weight 0.10000E+01 volume 0.10100E+00 ppm1 8.640 ppm2 7.592 ASSI { 1443} (segid " " and resid "86 " and name "HN ") (segid " " and resid "88 " and name "HN ") 5.000 5.000 0.000 peak 1443 weight 0.10000E+01 volume -0.32300E+00 ppm1 7.656 ppm2 7.595 ASSI { 1449} (segid " " and resid "87 " and name "HN ") (segid " " and resid "89 " and name "HN ") 7.000 7.000 0.000 peak 1449 weight 0.10000E+01 volume 0.10100E+00 ppm1 7.085 ppm2 7.694 ASSI { 1457} (segid " " and resid "89 " and name "HN ") (segid " " and resid "90 " and name "HN ") 5.000 5.000 0.000 peak 1457 weight 0.10000E+01 volume 0.92500E+00 ppm1 7.693 ppm2 8.684 ASSI { 1458} (segid " " and resid "89 " and name "HN ") (segid " " and resid "91 " and name "HN ") 7.000 7.000 0.000 peak 1458 weight 0.10000E+01 volume 0.18000E+00 ppm1 7.691 ppm2 7.937 ASSI { 1459} (segid " " and resid "89 " and name "HN ") (segid " " and resid "92 " and name "HN ") 7.000 7.000 0.000 peak 1459 weight 0.10000E+01 volume 0.10000E+00 ppm1 7.696 ppm2 8.039 ASSI { 1464} (segid " " and resid "91 " and name "HN ") (segid " " and resid "90 " and name "HN ") 3.000 3.000 0.000 peak 1464 weight 0.10000E+01 volume 0.35080E+01 ppm1 7.933 ppm2 8.687 ASSI { 1466} (segid " " and resid "91 " and name "HN ") (segid " " and resid "93 " and name "HN ") 5.000 5.000 0.000 peak 1466 weight 0.10000E+01 volume 0.72400E+00 ppm1 7.933 ppm2 8.563 ASSI { 1468} (segid " " and resid "92 " and name "HN ") (segid " " and resid "90 " and name "HN ") 5.000 5.000 0.000 peak 1468 weight 0.10000E+01 volume 0.62900E+00 ppm1 8.035 ppm2 8.686 ASSI { 1476} (segid " " and resid "93 " and name "HN ") (segid " " and resid "96 " and name "HN ") 7.000 7.000 0.000 peak 1476 weight 0.10000E+01 volume 0.43000E-01 ppm1 8.567 ppm2 8.461 ASSI { 1477} (segid " " and resid "94 " and name "HN ") (segid " " and resid "92 " and name "HN ") 5.000 5.000 0.000 peak 1477 weight 0.10000E+01 volume 0.38900E+00 ppm1 7.378 ppm2 8.046 ASSI { 1480} (segid " " and resid "94 " and name "HN ") (segid " " and resid "96 " and name "HN ") 7.000 7.000 0.000 peak 1480 weight 0.10000E+01 volume 0.22600E+00 ppm1 7.378 ppm2 8.452 ASSI { 1481} (segid " " and resid "94 " and name "HN ") (segid " " and resid "97 " and name "HN ") 7.000 7.000 0.000 peak 1481 weight 0.10000E+01 volume 0.48000E-01 ppm1 7.384 ppm2 8.813 ASSI { 1484} (segid " " and resid "95 " and name "HN ") (segid " " and resid "93 " and name "HN ") 5.000 5.000 0.000 peak 1484 weight 0.10000E+01 volume 0.34300E+00 ppm1 8.082 ppm2 8.572 ASSI { 1487} (segid " " and resid "95 " and name "HN ") (segid " " and resid "97 " and name "HN ") 7.000 7.000 0.000 peak 1487 weight 0.10000E+01 volume 0.28200E+00 ppm1 8.073 ppm2 8.802 ASSI { 1493} (segid " " and resid "96 " and name "HN ") (segid " " and resid "98 " and name "HN ") 5.000 5.000 0.000 peak 1493 weight 0.10000E+01 volume 0.33400E+00 ppm1 8.457 ppm2 7.461 ASSI { 1494} (segid " " and resid "96 " and name "HN ") (segid " " and resid "99 " and name "HN ") 7.000 7.000 0.000 peak 1494 weight 0.10000E+01 volume -0.12700E+00 ppm1 8.451 ppm2 7.646 ASSI { 1499} (segid " " and resid "97 " and name "HN ") (segid " " and resid "99 " and name "HN ") 7.000 7.000 0.000 peak 1499 weight 0.10000E+01 volume -0.27700E+00 ppm1 8.804 ppm2 7.636 ASSI { 1500} (segid " " and resid "97 " and name "HN ") (segid " " and resid "100 " and name "HN ") 7.000 7.000 0.000 peak 1500 weight 0.10000E+01 volume 0.13200E+00 ppm1 8.827 ppm2 8.258 ASSI { 1504} (segid " " and resid "98 " and name "HN ") (segid " " and resid "100 " and name "HN ") 5.000 5.000 0.000 peak 1504 weight 0.10000E+01 volume 0.40300E+00 ppm1 7.462 ppm2 8.258 ASSI { 1513} (segid " " and resid "101 " and name "HN ") (segid " " and resid "70 " and name "HD21") 5.000 5.000 0.000 peak 1513 weight 0.10000E+01 volume 0.42300E+00 ppm1 8.958 ppm2 7.857 ASSI { 1519} (segid " " and resid "102 " and name "HN ") (segid " " and resid "101 " and name "HN ") 5.000 5.000 0.000 peak 1519 weight 0.10000E+01 volume 0.32900E+00 ppm1 8.506 ppm2 8.967 ASSI { 1520} (segid " " and resid "102 " and name "HN ") (segid " " and resid "103 " and name "HN ") 5.000 5.000 0.000 peak 1520 weight 0.10000E+01 volume 0.20640E+01 ppm1 8.517 ppm2 8.544 ASSI { 1521} (segid " " and resid "102 " and name "HN ") (segid " " and resid "104 " and name "HN ") 5.000 5.000 0.000 peak 1521 weight 0.10000E+01 volume 0.50300E+00 ppm1 8.523 ppm2 6.325 ASSI { 1533} (segid " " and resid "105 " and name "HN ") (segid " " and resid "106 " and name "HN ") 5.000 5.000 0.000 peak 1533 weight 0.10000E+01 volume 0.34100E+00 ppm1 8.236 ppm2 7.655 ASSI { 1536} (segid " " and resid "106 " and name "HN ") (segid " " and resid "107 " and name "HN ") 5.000 5.000 0.000 peak 1536 weight 0.10000E+01 volume 0.97600E+00 ppm1 7.658 ppm2 8.188 ASSI { 1537} (segid " " and resid "106 " and name "HN ") (segid " " and resid "108 " and name "HN ") 5.000 5.000 0.000 peak 1537 weight 0.10000E+01 volume 0.38500E+00 ppm1 7.651 ppm2 8.469 ASSI { 1538} (segid " " and resid "106 " and name "HN ") (segid " " and resid "109 " and name "HN ") 5.000 5.000 0.000 peak 1538 weight 0.10000E+01 volume 0.76700E+00 ppm1 7.649 ppm2 8.503 ASSI { 1543} (segid " " and resid "107 " and name "HN ") (segid " " and resid "109 " and name "HN ") 5.000 5.000 0.000 peak 1543 weight 0.10000E+01 volume 0.47000E+00 ppm1 8.192 ppm2 8.503 ASSI { 1544} (segid " " and resid "107 " and name "HN ") (segid " " and resid "110 " and name "HN ") 7.000 7.000 0.000 peak 1544 weight 0.10000E+01 volume 0.25000E+00 ppm1 8.183 ppm2 7.999 ASSI { 1547} (segid " " and resid "108 " and name "HN ") (segid " " and resid "109 " and name "HN ") 5.000 5.000 0.000 peak 1547 weight 0.10000E+01 volume 0.19390E+01 ppm1 8.469 ppm2 8.503 ASSI { 1561} (segid " " and resid "111 " and name "HN ") (segid " " and resid "114 " and name "HN ") 5.000 5.000 0.000 peak 1561 weight 0.10000E+01 volume 0.44100E+00 ppm1 9.449 ppm2 7.664 ASSI { 1562} (segid " " and resid "111 " and name "HN ") (segid " " and resid "115 " and name "HN ") 7.000 7.000 0.000 peak 1562 weight 0.10000E+01 volume 0.10600E+00 ppm1 9.446 ppm2 7.287 ASSI { 1565} (segid " " and resid "113 " and name "HN ") (segid " " and resid "116 " and name "HN ") 7.000 7.000 0.000 peak 1565 weight 0.10000E+01 volume 0.43000E-01 ppm1 8.287 ppm2 7.884 ASSI { 1571} (segid " " and resid "114 " and name "HE2 ") (segid " " and resid "138 " and name "HN ") 5.000 5.000 0.000 peak 1571 weight 0.10000E+01 volume 0.95700E+00 ppm1 11.346 ppm2 7.712 ASSI { 1572} (segid " " and resid "114 " and name "HE2 ") (segid " " and resid "142 " and name "HN ") 7.000 7.000 0.000 peak 1572 weight 0.10000E+01 volume 0.16500E+00 ppm1 11.347 ppm2 8.185 ASSI { 1573} (segid " " and resid "114 " and name "HE2 ") (segid " " and resid "143 " and name "HN ") 7.000 7.000 0.000 peak 1573 weight 0.10000E+01 volume 0.10600E+00 ppm1 11.357 ppm2 8.576 ASSI { 1575} (segid " " and resid "115 " and name "HN ") (segid " " and resid "113 " and name "HN ") 5.000 5.000 0.000 peak 1575 weight 0.10000E+01 volume 0.48800E+00 ppm1 7.295 ppm2 8.284 ASSI { 1579} (segid " " and resid "115 " and name "HN ") (segid " " and resid "118 " and name "HN ") 7.000 7.000 0.000 peak 1579 weight 0.10000E+01 volume 0.88000E-01 ppm1 7.301 ppm2 8.114 ASSI { 1581} (segid " " and resid "116 " and name "HN ") (segid " " and resid "114 " and name "HN ") 5.000 5.000 0.000 peak 1581 weight 0.10000E+01 volume 0.45700E+00 ppm1 7.892 ppm2 7.668 ASSI { 1584} (segid " " and resid "116 " and name "HN ") (segid " " and resid "118 " and name "HN ") 5.000 5.000 0.000 peak 1584 weight 0.10000E+01 volume 0.32100E+00 ppm1 7.887 ppm2 8.109 ASSI { 1585} (segid " " and resid "116 " and name "HN ") (segid " " and resid "119 " and name "HN ") 5.000 5.000 0.000 peak 1585 weight 0.10000E+01 volume 0.42400E+00 ppm1 7.895 ppm2 7.323 ASSI { 1586} (segid " " and resid "117 " and name "HN ") (segid " " and resid "115 " and name "HN ") 5.000 5.000 0.000 peak 1586 weight 0.10000E+01 volume 0.38900E+00 ppm1 7.938 ppm2 7.300 ASSI { 1587} (segid " " and resid "117 " and name "HN ") (segid " " and resid "116 " and name "HN ") 3.000 3.000 0.000 peak 1587 weight 0.10000E+01 volume 0.51660E+01 ppm1 7.944 ppm2 7.900 ASSI { 1589} (segid " " and resid "117 " and name "HN ") (segid " " and resid "119 " and name "HN ") 7.000 7.000 0.000 peak 1589 weight 0.10000E+01 volume 0.24300E+00 ppm1 7.939 ppm2 7.323 ASSI { 1590} (segid " " and resid "117 " and name "HN ") (segid " " and resid "120 " and name "HN ") 7.000 7.000 0.000 peak 1590 weight 0.10000E+01 volume -0.43000E-01 ppm1 7.940 ppm2 7.488 ASSI { 1595} (segid " " and resid "118 " and name "HN ") (segid " " and resid "120 " and name "HN ") 5.000 5.000 0.000 peak 1595 weight 0.10000E+01 volume -0.35100E+00 ppm1 8.115 ppm2 7.478 ASSI { 1600} (segid " " and resid "119 " and name "HN ") (segid " " and resid "121 " and name "HN ") 5.000 5.000 0.000 peak 1600 weight 0.10000E+01 volume 0.45400E+00 ppm1 7.318 ppm2 7.857 ASSI { 1604} (segid " " and resid "120 " and name "HN ") (segid " " and resid "125 " and name "HN ") 5.000 5.000 0.000 peak 1604 weight 0.10000E+01 volume -0.30400E+00 ppm1 7.478 ppm2 8.102 ASSI { 1610} (segid " " and resid "124 " and name "HN ") (segid " " and resid "126 " and name "HN ") 5.000 5.000 0.000 peak 1610 weight 0.10000E+01 volume 0.55200E+00 ppm1 7.133 ppm2 8.488 ASSI { 1612} (segid " " and resid "124 " and name "HN ") (segid " " and resid "127 " and name "HN ") 7.000 7.000 0.000 peak 1612 weight 0.10000E+01 volume 0.91000E-01 ppm1 7.138 ppm2 7.411 ASSI { 1615} (segid " " and resid "125 " and name "HN ") (segid " " and resid "121 " and name "HN ") 5.000 5.000 0.000 peak 1615 weight 0.10000E+01 volume 0.31400E+00 ppm1 8.122 ppm2 7.871 ASSI { 1616} (segid " " and resid "125 " and name "HN ") (segid " " and resid "124 " and name "HN ") 3.000 3.000 0.000 peak 1616 weight 0.10000E+01 volume 0.34680E+01 ppm1 8.121 ppm2 7.125 ASSI { 1620} (segid " " and resid "125 " and name "HN ") (segid " " and resid "127 " and name "HN ") 5.000 5.000 0.000 peak 1620 weight 0.10000E+01 volume 0.34000E+00 ppm1 8.124 ppm2 7.428 ASSI { 1621} (segid " " and resid "125 " and name "HN ") (segid " " and resid "128 " and name "HN ") 7.000 7.000 0.000 peak 1621 weight 0.10000E+01 volume 0.10500E+00 ppm1 8.126 ppm2 8.222 ASSI { 1630} (segid " " and resid "126 " and name "HN ") (segid " " and resid "129 " and name "HN ") 7.000 7.000 0.000 peak 1630 weight 0.10000E+01 volume 0.66000E-01 ppm1 8.500 ppm2 8.287 ASSI { 1639} (segid " " and resid "128 " and name "HN ") (segid " " and resid "124 " and name "HN ") 7.000 7.000 0.000 peak 1639 weight 0.10000E+01 volume 0.88000E-01 ppm1 8.225 ppm2 7.144 ASSI { 1641} (segid " " and resid "128 " and name "HN ") (segid " " and resid "126 " and name "HN ") 5.000 5.000 0.000 peak 1641 weight 0.10000E+01 volume 0.45900E+00 ppm1 8.226 ppm2 8.497 ASSI { 1644} (segid " " and resid "128 " and name "HN ") (segid " " and resid "129 " and name "HN ") 5.000 5.000 0.000 peak 1644 weight 0.10000E+01 volume 0.16110E+01 ppm1 8.223 ppm2 8.287 ASSI { 1645} (segid " " and resid "129 " and name "HN ") (segid " " and resid "125 " and name "HN ") 7.000 7.000 0.000 peak 1645 weight 0.10000E+01 volume 0.66000E-01 ppm1 8.285 ppm2 8.089 ASSI { 1650} (segid " " and resid "129 " and name "HN ") (segid " " and resid "131 " and name "HN ") 7.000 7.000 0.000 peak 1650 weight 0.10000E+01 volume 0.92000E-01 ppm1 8.286 ppm2 6.843 ASSI { 1651} (segid " " and resid "129 " and name "HN ") (segid " " and resid "132 " and name "HN ") 7.000 7.000 0.000 peak 1651 weight 0.10000E+01 volume 0.98000E-01 ppm1 8.284 ppm2 7.016 ASSI { 1654} (segid " " and resid "131 " and name "HN ") (segid " " and resid "132 " and name "HN ") 3.000 3.000 0.000 peak 1654 weight 0.10000E+01 volume 0.38470E+01 ppm1 6.835 ppm2 7.016 ASSI { 1657} (segid " " and resid "132 " and name "HN ") (segid " " and resid "134 " and name "HN ") 7.000 7.000 0.000 peak 1657 weight 0.10000E+01 volume 0.64000E-01 ppm1 7.032 ppm2 7.962 ASSI { 1659} (segid " " and resid "133 " and name "HN ") (segid " " and resid "131 " and name "HN ") 7.000 7.000 0.000 peak 1659 weight 0.10000E+01 volume 0.12700E+00 ppm1 8.742 ppm2 6.782 ASSI { 1664} (segid " " and resid "134 " and name "HN ") (segid " " and resid "135 " and name "HN ") 5.000 5.000 0.000 peak 1664 weight 0.10000E+01 volume 0.19740E+01 ppm1 7.964 ppm2 8.042 ASSI { 1666} (segid " " and resid "134 " and name "HN ") (segid " " and resid "136 " and name "HN ") 5.000 5.000 0.000 peak 1666 weight 0.10000E+01 volume 0.71800E+00 ppm1 7.966 ppm2 7.553 ASSI { 1670} (segid " " and resid "135 " and name "HN ") (segid " " and resid "136 " and name "HN ") 3.000 3.000 0.000 peak 1670 weight 0.10000E+01 volume 0.30700E+01 ppm1 8.055 ppm2 7.553 ASSI { 1674} (segid " " and resid "136 " and name "HN ") (segid " " and resid "137 " and name "HN ") 7.000 7.000 0.000 peak 1674 weight 0.10000E+01 volume 0.15100E+00 ppm1 7.568 ppm2 7.445 ASSI { 1680} (segid " " and resid "138 " and name "HN ") (segid " " and resid "140 " and name "HN ") 5.000 5.000 0.000 peak 1680 weight 0.10000E+01 volume 0.36800E+00 ppm1 7.720 ppm2 8.137 ASSI { 1681} (segid " " and resid "138 " and name "HN ") (segid " " and resid "141 " and name "HN ") 5.000 5.000 0.000 peak 1681 weight 0.10000E+01 volume 0.54300E+00 ppm1 7.709 ppm2 8.447 ASSI { 1683} (segid " " and resid "138 " and name "HN ") (segid " " and resid "143 " and name "HN ") 7.000 7.000 0.000 peak 1683 weight 0.10000E+01 volume 0.18900E+00 ppm1 7.704 ppm2 8.580 ASSI { 1686} (segid " " and resid "139 " and name "HN ") (segid " " and resid "141 " and name "HN ") 5.000 5.000 0.000 peak 1686 weight 0.10000E+01 volume 0.58600E+00 ppm1 8.297 ppm2 8.447 ASSI { 1695} (segid " " and resid "142 " and name "HN ") (segid " " and resid "139 " and name "HN ") 7.000 7.000 0.000 peak 1695 weight 0.10000E+01 volume 0.20900E+00 ppm1 8.197 ppm2 8.294 ASSI { 1696} (segid " " and resid "142 " and name "HN ") (segid " " and resid "140 " and name "HN ") 5.000 5.000 0.000 peak 1696 weight 0.10000E+01 volume 0.12780E+01 ppm1 8.187 ppm2 8.137 ASSI { 1701} (segid " " and resid "143 " and name "HN ") (segid " " and resid "145 " and name "HN ") 7.000 7.000 0.000 peak 1701 weight 0.10000E+01 volume 0.23900E+00 ppm1 8.562 ppm2 8.795 ASSI { 1702} (segid " " and resid "143 " and name "HN ") (segid " " and resid "146 " and name "HN ") 5.000 5.000 0.000 peak 1702 weight 0.10000E+01 volume 0.63800E+00 ppm1 8.575 ppm2 7.642 ASSI { 1706} (segid " " and resid "145 " and name "HN ") (segid " " and resid "147 " and name "HN ") 5.000 5.000 0.000 peak 1706 weight 0.10000E+01 volume 0.37700E+00 ppm1 8.794 ppm2 8.753 ASSI { 1707} (segid " " and resid "145 " and name "HN ") (segid " " and resid "148 " and name "HN ") 7.000 7.000 0.000 peak 1707 weight 0.10000E+01 volume 0.84000E-01 ppm1 8.793 ppm2 8.274 ASSI { 1713} (segid " " and resid "147 " and name "HN ") (segid " " and resid "143 " and name "HN ") 5.000 5.000 0.000 peak 1713 weight 0.10000E+01 volume 0.50100E+00 ppm1 8.754 ppm2 8.573 ASSI { 1717} (segid " " and resid "147 " and name "HN ") (segid " " and resid "149 " and name "HN ") 5.000 5.000 0.000 peak 1717 weight 0.10000E+01 volume 0.41400E+00 ppm1 8.758 ppm2 8.552 ASSI { 1718} (segid " " and resid "147 " and name "HN ") (segid " " and resid "150 " and name "HN ") 7.000 7.000 0.000 peak 1718 weight 0.10000E+01 volume 0.11500E+00 ppm1 8.745 ppm2 8.416 ASSI { 1720} (segid " " and resid "148 " and name "HN ") (segid " " and resid "146 " and name "HN ") 5.000 5.000 0.000 peak 1720 weight 0.10000E+01 volume 0.66300E+00 ppm1 8.280 ppm2 7.644 ASSI { 1723} (segid " " and resid "148 " and name "HN ") (segid " " and resid "150 " and name "HN ") 5.000 5.000 0.000 peak 1723 weight 0.10000E+01 volume 0.14270E+01 ppm1 8.282 ppm2 8.403 ASSI { 1724} (segid " " and resid "148 " and name "HN ") (segid " " and resid "151 " and name "HN ") 7.000 7.000 0.000 peak 1724 weight 0.10000E+01 volume 0.11400E+00 ppm1 8.271 ppm2 7.795 ASSI { 1726} (segid " " and resid "149 " and name "HN ") (segid " " and resid "146 " and name "HN ") 5.000 5.000 0.000 peak 1726 weight 0.10000E+01 volume 0.36900E+00 ppm1 8.552 ppm2 7.643 ASSI { 1730} (segid " " and resid "149 " and name "HN ") (segid " " and resid "151 " and name "HN ") 5.000 5.000 0.000 peak 1730 weight 0.10000E+01 volume 0.33400E+00 ppm1 8.552 ppm2 7.795 ASSI { 1731} (segid " " and resid "149 " and name "HN ") (segid " " and resid "152 " and name "HN ") 7.000 7.000 0.000 peak 1731 weight 0.10000E+01 volume 0.12500E+00 ppm1 8.553 ppm2 7.987 ASSI { 1737} (segid " " and resid "150 " and name "HN ") (segid " " and resid "152 " and name "HN ") 5.000 5.000 0.000 peak 1737 weight 0.10000E+01 volume 0.64000E+00 ppm1 8.416 ppm2 7.987 ASSI { 1738} (segid " " and resid "150 " and name "HN ") (segid " " and resid "153 " and name "HN ") 7.000 7.000 0.000 peak 1738 weight 0.10000E+01 volume 0.26800E+00 ppm1 8.424 ppm2 7.839 ASSI { 1743} (segid " " and resid "151 " and name "HN ") (segid " " and resid "153 " and name "HN ") 5.000 5.000 0.000 peak 1743 weight 0.10000E+01 volume 0.86400E+00 ppm1 7.796 ppm2 7.839 ASSI { 1752} (segid " " and resid "153 " and name "HN ") (segid " " and resid "156 " and name "HN ") 7.000 7.000 0.000 peak 1752 weight 0.10000E+01 volume 0.85000E-01 ppm1 7.860 ppm2 7.104 ASSI { 1753} (segid " " and resid "154 " and name "HE21") (segid " " and resid "158 " and name "HN ") 7.000 7.000 0.000 peak 1753 weight 0.10000E+01 volume 0.11400E+00 ppm1 7.834 ppm2 8.298 ASSI { 1754} (segid " " and resid "154 " and name "HE22") (segid " " and resid "158 " and name "HN ") 7.000 7.000 0.000 peak 1754 weight 0.10000E+01 volume 0.63000E-01 ppm1 6.808 ppm2 8.298 ASSI { 1756} (segid " " and resid "156 " and name "HN ") (segid " " and resid "157 " and name "HN ") 3.000 3.000 0.000 peak 1756 weight 0.10000E+01 volume 0.36450E+01 ppm1 7.128 ppm2 8.153 ASSI { 1757} (segid " " and resid "156 " and name "HN ") (segid " " and resid "158 " and name "HN ") 5.000 5.000 0.000 peak 1757 weight 0.10000E+01 volume 0.74400E+00 ppm1 7.126 ppm2 8.298 ASSI { 1758} (segid " " and resid "156 " and name "HN ") (segid " " and resid "159 " and name "HN ") 7.000 7.000 0.000 peak 1758 weight 0.10000E+01 volume 0.61000E-01 ppm1 7.134 ppm2 7.383 ASSI { 1761} (segid " " and resid "157 " and name "HN ") (segid " " and resid "159 " and name "HN ") 5.000 5.000 0.000 peak 1761 weight 0.10000E+01 volume 0.34000E+00 ppm1 8.164 ppm2 7.386 ASSI { 1766} (segid " " and resid "158 " and name "HN ") (segid " " and resid "157 " and name "HN ") 3.000 3.000 0.000 peak 1766 weight 0.10000E+01 volume 0.55200E+01 ppm1 8.298 ppm2 8.153 ASSI { 1768} (segid " " and resid "158 " and name "HN ") (segid " " and resid "160 " and name "HN ") 5.000 5.000 0.000 peak 1768 weight 0.10000E+01 volume 0.33400E+00 ppm1 8.299 ppm2 7.926 ASSI { 1769} (segid " " and resid "158 " and name "HN ") (segid " " and resid "161 " and name "HN ") 7.000 7.000 0.000 peak 1769 weight 0.10000E+01 volume 0.13700E+00 ppm1 8.299 ppm2 8.741 ASSI { 1774} (segid " " and resid "159 " and name "HN ") (segid " " and resid "161 " and name "HN ") 5.000 5.000 0.000 peak 1774 weight 0.10000E+01 volume 0.59300E+00 ppm1 7.374 ppm2 8.742 ASSI { 1775} (segid " " and resid "159 " and name "HN ") (segid " " and resid "162 " and name "HN ") 7.000 7.000 0.000 peak 1775 weight 0.10000E+01 volume -0.15700E+00 ppm1 7.374 ppm2 7.593 ASSI { 1779} (segid " " and resid "160 " and name "HN ") (segid " " and resid "161 " and name "HN ") 3.000 3.000 0.000 peak 1779 weight 0.10000E+01 volume 0.36160E+01 ppm1 7.945 ppm2 8.746 ASSI { 1780} (segid " " and resid "160 " and name "HN ") (segid " " and resid "162 " and name "HN ") 5.000 5.000 0.000 peak 1780 weight 0.10000E+01 volume -0.76700E+00 ppm1 7.930 ppm2 7.579 ASSI { 1785} (segid " " and resid "161 " and name "HN ") (segid " " and resid "163 " and name "HN ") 7.000 7.000 0.000 peak 1785 weight 0.10000E+01 volume 0.29100E+00 ppm1 8.753 ppm2 7.485 ASSI { 1790} (segid " " and resid "162 " and name "HN ") (segid " " and resid "164 " and name "HN ") 5.000 5.000 0.000 peak 1790 weight 0.10000E+01 volume -0.32800E+00 ppm1 7.586 ppm2 7.616 ASSI ( (segid " " and resid "136 " and name "HD2 ") )( (segid " " and resid "114 " and name "HE1 ") ) 5.000 5.000 0.000 peak 5544 weight 0.10000E+01 volume 0.30700E+00 ppm1 6.748 ppm2 7.841 ASSI ( (segid " " and resid "166 " and name "HD13") OR (segid " " and resid "166 " and name "HD12") OR (segid " " and resid "166 " and name "HD11") )( (segid " " and resid "164 " and name "HE3 ") OR (segid " " and resid "164 " and name "HE2 ") OR (segid " " and resid "164 " and name "HE1 ") ) 6.000 6.000 0.000 peak 12859 weight 0.10000E+01 volume 0.24400E+00 ppm1 0.913 ppm2 1.989 ASSI ( (segid " " and resid "53 " and name "HD2 ") OR (segid " " and resid "53 " and name "HD1 ") )( (segid " " and resid "83 " and name "HB3 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "83 " and name "HB1 ") ) 5.000 5.000 0.000 peak 5435 weight 0.10000E+01 volume 0.38000E+00 ppm1 7.201 ppm2 1.332 ASSI ( (segid " " and resid "114 " and name "HE1 ") )( (segid " " and resid "136 " and name "HD2 ") ) 6.000 6.000 0.000 peak 5437 weight 0.10000E+01 volume 0.27800E+00 ppm1 7.837 ppm2 6.750 ASSI ( (segid " " and resid "157 " and name "HE3 ") OR (segid " " and resid "157 " and name "HE2 ") OR (segid " " and resid "157 " and name "HE1 ") )( (segid " " and resid "149 " and name "HD2 ") OR (segid " " and resid "149 " and name "HD1 ") ) 5.000 5.000 0.000 peak 5439 weight 0.10000E+01 volume -0.30800E+00 ppm1 2.052 ppm2 3.269 ASSI ( (segid " " and resid "157 " and name "HE3 ") OR (segid " " and resid "157 " and name "HE1 ") )( (segid " " and resid "149 " and name "HA ") ) 6.000 6.000 0.000 peak 5440 weight 0.10000E+01 volume 0.29100E+00 ppm1 2.052 ppm2 4.340 ASSI ( (segid " " and resid "164 " and name "HE3 ") OR (segid " " and resid "164 " and name "HE2 ") )( (segid " " and resid "164 " and name "HA ") ) 6.000 6.000 0.000 peak 5441 weight 0.10000E+01 volume -0.27100E+00 ppm1 1.981 ppm2 4.521 ASSI ( (segid " " and resid "164 " and name "HE3 ") OR (segid " " and resid "164 " and name "HE2 ") OR (segid " " and resid "164 " and name "HE1 ") )( (segid " " and resid "145 " and name "HD13") OR (segid " " and resid "145 " and name "HD12") OR (segid " " and resid "145 " and name "HD11") OR (segid " " and resid "134 " and name "HD11") ) 5.000 5.000 0.000 peak 5442 weight 0.10000E+01 volume 0.19920E+01 ppm1 1.973 ppm2 0.947 ASSI ( (segid " " and resid "166 " and name "HG23") OR (segid " " and resid "166 " and name "HG22") OR (segid " " and resid "166 " and name "HG21") )( (segid " " and resid "167 " and name "HD2 ") ) 5.000 5.000 0.000 peak 12855 weight 0.10000E+01 volume -0.34800E+00 ppm1 0.996 ppm2 3.740 ASSI ( (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "159 " and name "HG21") )( (segid " " and resid "126 " and name "HA ") ) 3.300 3.300 0.000 peak 5444 weight 0.10000E+01 volume 0.27090E+01 ppm1 0.904 ppm2 4.004 ASSI ( (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "159 " and name "HG21") OR (segid " " and resid "117 " and name "HD13") OR (segid " " and resid "117 " and name "HD12") OR (segid " " and resid "117 " and name "HD11") )( (segid " " and resid "159 " and name "HG12") OR (segid " 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"HG11") ) 6.000 6.000 0.000 peak 12969 weight 0.10000E+01 volume 0.20800E+00 ppm1 2.041 ppm2 1.193 ASSI ( (segid " " and resid "145 " and name "HG ") )( (segid " " and resid "145 " and name "HB1 ") ) 5.000 5.000 0.000 peak 12839 weight 0.10000E+01 volume -0.12140E+01 ppm1 1.529 ppm2 1.762 ASSI ( (segid " " and resid "30 " and name "HD13") OR (segid " " and resid "30 " and name "HD12") OR (segid " " and resid "30 " and name "HD11") )( (segid " " and resid "65 " and name "HB2 ") OR (segid " " and resid "61 " and name "HB1 ") ) 6.000 6.000 0.000 peak 12932 weight 0.10000E+01 volume 0.25900E+00 ppm1 0.666 ppm2 1.987 ASSI ( (segid " " and resid "29 " and name "HG ") )( (segid " " and resid "29 " and name "HD23") OR (segid " " and resid "29 " and name "HD22") OR (segid " " and resid "29 " and name "HD21") ) 5.000 5.000 0.000 peak 5481 weight 0.10000E+01 volume 0.19120E+01 ppm1 1.831 ppm2 0.783 ASSI ( (segid " " and resid "115 " and name "HD13") OR (segid " " and resid "115 " and name "HD12") OR (segid " " and resid "115 " and name "HD11") )( (segid " " and resid "85 " and name "HB2 ") OR (segid " " and resid "85 " and name "HB1 ") ) 6.000 6.000 0.000 peak 12962 weight 0.10000E+01 volume 0.16300E+00 ppm1 1.220 ppm2 2.026 ASSI ( (segid " " and resid "48 " and name "HD13") OR (segid " " and resid "48 " and name "HD12") OR (segid " " and resid "48 " and name "HD11") )( (segid " " and resid "69 " and name "HA ") ) 5.000 5.000 0.000 peak 12999 weight 0.10000E+01 volume 0.81900E+00 ppm1 0.825 ppm2 4.414 ASSI ( (segid " " and resid "156 " and name "HD13") OR (segid " " and resid "156 " and name "HD12") OR (segid " " and resid "156 " and name "HD11") )( (segid " " and resid "120 " and name "HA2 ") ) 6.000 6.000 0.000 peak 5483 weight 0.10000E+01 volume -0.25000E+00 ppm1 1.004 ppm2 3.540 ASSI ( (segid " " and resid "156 " and name "HD13") OR (segid " " and resid "156 " and name "HD12") OR (segid " " and resid "156 " and name "HD11") )( (segid " " and resid "120 " and name "HA2 ") ) 6.000 6.000 0.000 peak 12869 weight 0.10000E+01 volume -0.18900E+00 ppm1 0.996 ppm2 3.528 ASSI ( (segid " " and resid "156 " and name "HD13") OR (segid " " and resid "156 " and name "HD12") OR (segid " " and resid "156 " and name "HD11") )( (segid " " and resid "152 " and name "HA1 ") OR (segid " " and resid "120 " and name "HA1 ") ) 6.000 6.000 0.000 peak 5484 weight 0.10000E+01 volume -0.19600E+00 ppm1 0.996 ppm2 4.041 ASSI ( (segid " " and resid "147 " and name "HD13") OR (segid " " and resid "147 " and name "HD12") OR (segid " " and resid "147 " and name "HD11") )( (segid " " and resid "117 " and name "HG23") OR (segid " " and resid "117 " and name "HG22") OR (segid " " and resid "117 " and name "HG21") ) 5.000 5.000 0.000 peak 5485 weight 0.10000E+01 volume 0.16760E+01 ppm1 1.182 ppm2 0.795 ASSI ( (segid " " and resid "137 " and name "HG1 ") )( (segid " " and resid "143 " and name "HG23") OR (segid " " and resid "143 " and name "HG22") OR (segid " " and resid "143 " and name "HG21") ) 5.000 5.000 0.000 peak 13024 weight 0.10000E+01 volume 0.41800E+00 ppm1 1.682 ppm2 1.257 ASSI ( (segid " " and resid "65 " and name "HB2 ") OR (segid " " and resid "61 " and name "HB1 ") )( (segid " " and resid "30 " and name "HD13") OR (segid " " and resid "30 " and name "HD12") OR (segid " " and resid "30 " and name "HD11") ) 5.000 5.000 0.000 peak 12931 weight 0.10000E+01 volume 0.31600E+00 ppm1 2.014 ppm2 0.663 ASSI ( (segid " " and resid "64 " and name "HD2 ") OR (segid " " and resid "64 " and name "HD1 ") )( (segid " " and resid "64 " and name "HE2 ") OR (segid " " and resid "64 " and name "HE1 ") ) 3.300 3.300 0.000 peak 12843 weight 0.10000E+01 volume -0.24730E+01 ppm1 1.690 ppm2 2.985 ASSI ( (segid " " and resid "64 " and name "HD2 ") OR (segid " " and resid "64 " and name "HD1 ") )( (segid " " and resid "64 " and name "HB2 ") ) 5.000 5.000 0.000 peak 12842 weight 0.10000E+01 volume 0.11950E+01 ppm1 1.700 ppm2 1.937 ASSI ( (segid " " and resid "93 " and name "HD2 ") OR (segid " " and resid "93 " and name "HD1 ") )( (segid " " and resid "90 " and name "HA ") ) 6.000 6.000 0.000 peak 5487 weight 0.10000E+01 volume -0.24900E+00 ppm1 1.435 ppm2 4.232 ASSI ( (segid " " and resid "28 " and name "HB2 ") OR (segid " " and resid "28 " and name "HB1 ") )( (segid " " and resid "25 " and name "HA ") ) 6.000 6.000 0.000 peak 5488 weight 0.10000E+01 volume -0.52000E-01 ppm1 1.970 ppm2 4.633 ASSI ( (segid " " and resid "56 " and name "HB2 ") )( (segid " " and resid "94 " and name "HG13") OR (segid " " and resid "94 " and name "HG12") OR (segid " " and resid "94 " and name "HG11") ) 5.000 5.000 0.000 peak 12965 weight 0.10000E+01 volume 0.39200E+00 ppm1 1.966 ppm2 1.207 ASSI ( (segid " " and resid "56 " and name "HB1 ") )( (segid " " and resid "94 " and name "HG13") OR (segid " " and resid "94 " and name "HG12") OR (segid " " and resid "94 " and name "HG11") ) 5.000 5.000 0.000 peak 12964 weight 0.10000E+01 volume 0.45600E+00 ppm1 2.042 ppm2 1.207 ASSI ( (segid " " and resid "102 " and name "HB ") )( (segid " " and resid "102 " and name "HA ") ) 5.000 5.000 0.000 peak 5489 weight 0.10000E+01 volume 0.91100E+00 ppm1 2.238 ppm2 3.878 ASSI ( (segid " " and resid "80 " and name "HB ") )( (segid " " and resid "80 " and name "HG13") OR (segid " " and resid "80 " and name "HG12") OR (segid " " and resid "80 " and name "HG11") ) 3.300 3.300 0.000 peak 5490 weight 0.10000E+01 volume 0.25250E+01 ppm1 1.915 ppm2 0.904 ASSI ( (segid " " and resid "157 " and name "HG2 ") OR (segid " " and resid "157 " and name "HG1 ") )( (segid " " and resid "148 " and name "HB3 ") OR (segid " " and resid "148 " and name "HB2 ") OR (segid " " and resid "148 " and name "HB1 ") ) 5.000 5.000 0.000 peak 5567 weight 0.10000E+01 volume 0.12880E+01 ppm1 2.331 ppm2 1.422 ASSI ( (segid " " and resid "79 " and name "HB2 ") OR (segid " " and resid "69 " and name "HB1 ") OR (segid " " and resid "37 " and name "HB1 ") )( (segid " " and resid "100 " and name "HB3 ") OR (segid " " and resid "100 " and name "HB2 ") OR (segid " " and resid "100 " and name "HB1 ") OR (segid " " and resid "67 " and name "HB3 ") OR (segid " " and resid "67 " and name "HB2 ") ) 5.000 5.000 0.000 peak 12875 weight 0.10000E+01 volume 0.86800E+00 ppm1 1.941 ppm2 1.116 ASSI ( (segid " " and resid "69 " and name "HB2 ") OR (segid " " and resid "37 " and name "HB2 ") )( (segid " " and resid "100 " and name "HB3 ") OR (segid " " and resid "100 " and name "HB1 ") OR (segid " " and resid "67 " and name "HB3 ") OR (segid " " and resid "67 " and name "HB2 ") ) 5.000 5.000 0.000 peak 13014 weight 0.10000E+01 volume 0.98400E+00 ppm1 1.685 ppm2 1.132 ASSI ( (segid " " and resid "64 " and name "HB1 ") OR (segid " " and resid "23 " and name "HB ") )( (segid " " and resid "60 " and name "HD23") OR (segid " " and resid "60 " and name "HD22") OR (segid " " and resid "58 " and name "HG23") OR (segid " " and resid "58 " and name "HG22") ) 3.300 3.300 0.000 peak 5491 weight 0.10000E+01 volume 0.24030E+01 ppm1 1.959 ppm2 0.980 ASSI ( (segid " " and resid "72 " and name "HB1 ") )( (segid " " and resid "72 " and name "HA ") ) 6.000 6.000 0.000 peak 13055 weight 0.10000E+01 volume 0.12800E+00 ppm1 1.975 ppm2 5.017 ASSI ( (segid " " and resid "161 " and name "HG2 ") )( (segid " " and resid "145 " and name "HD13") OR (segid " " and resid "145 " and name "HD12") OR (segid " " and resid "145 " and name "HD11") ) 5.000 5.000 0.000 peak 12906 weight 0.10000E+01 volume -0.32400E+00 ppm1 2.370 ppm2 0.958 ASSI ( (segid " " and resid "7 " and name "HG1 ") OR (segid " " and resid "6 " and name "HG1 ") )( (segid " " and resid "7 " and name "HA ") OR (segid " " and resid "6 " and name "HA ") ) 5.000 5.000 0.000 peak 5492 weight 0.10000E+01 volume 0.14650E+01 ppm1 2.295 ppm2 4.320 ASSI ( (segid " " and resid "6 " and name "HG2 ") OR (segid " " and resid "6 " and name "HG1 ") )( (segid " " and resid "8 " and name "HG13") OR (segid " " and resid "8 " and name "HG11") ) 5.000 5.000 0.000 peak 5493 weight 0.10000E+01 volume -0.38600E+00 ppm1 2.241 ppm2 0.964 ASSI ( (segid " " and resid "33 " and name "HG2 ") )( (segid " " and resid "29 " and name "HA ") ) 6.000 6.000 0.000 peak 13064 weight 0.10000E+01 volume 0.25400E+00 ppm1 2.205 ppm2 3.913 ASSI ( (segid " " and resid "33 " and name "HG1 ") )( (segid " " and resid "29 " and name "HD23") OR (segid " " and resid "29 " and name "HD22") OR (segid " " and resid "29 " and name "HD21") ) 5.000 5.000 0.000 peak 5494 weight 0.10000E+01 volume -0.74000E+00 ppm1 2.293 ppm2 0.791 ASSI ( (segid " " and resid "33 " and name "HG2 ") )( (segid " " and resid "29 " and name "HD23") OR (segid " " and resid "29 " and name "HD22") OR (segid " " and resid "29 " and name "HD21") ) 5.000 5.000 0.000 peak 5495 weight 0.10000E+01 volume -0.42700E+00 ppm1 2.192 ppm2 0.786 ASSI ( (segid " " and resid "33 " and name "HG2 ") )( (segid " " and resid "35 " and name "HG13") OR (segid " " and resid "35 " and name "HG12") OR (segid " " and resid "35 " and name "HG11") ) 5.000 5.000 0.000 peak 5496 weight 0.10000E+01 volume -0.35600E+00 ppm1 2.192 ppm2 0.935 ASSI ( (segid " " and resid "33 " and name "HG1 ") )( (segid " " and resid "29 " and name "HA ") ) 5.000 5.000 0.000 peak 13065 weight 0.10000E+01 volume 0.34700E+00 ppm1 2.298 ppm2 3.913 ASSI ( (segid " " and resid "127 " and name "HB1 ") )( (segid " " and resid "127 " and name "HA ") ) 6.000 6.000 0.000 peak 5497 weight 0.10000E+01 volume -0.23900E+00 ppm1 3.419 ppm2 4.300 ASSI ( (segid " " and resid "127 " and name "HB2 ") )( (segid " " and resid "127 " and name "HA ") ) 6.000 6.000 0.000 peak 5498 weight 0.10000E+01 volume -0.10700E+00 ppm1 2.959 ppm2 4.300 ASSI ( (segid " " and resid "145 " and name "HB2 ") )( (segid " " and resid "145 " and name "HA ") ) 5.000 5.000 0.000 peak 13067 weight 0.10000E+01 volume 0.47000E+00 ppm1 1.405 ppm2 3.941 ASSI ( (segid " " and resid "60 " and name "HB1 ") )( (segid " " and resid "60 " and name "HG ") ) 5.000 5.000 0.000 peak 5499 weight 0.10000E+01 volume -0.10160E+01 ppm1 1.798 ppm2 1.545 ASSI ( (segid " " and resid "157 " and name "HE3 ") OR (segid " " and resid "157 " and name "HE2 ") OR (segid " " and resid "157 " and name "HE1 ") )( (segid " " and resid "149 " and name "HB2 ") ) 5.000 5.000 0.000 peak 12975 weight 0.10000E+01 volume 0.43700E+00 ppm1 2.056 ppm2 1.904 ASSI ( (segid " " and resid "151 " and name "HD2 ") )( (segid " " and resid "118 " and name "HA ") ) 6.000 6.000 0.000 peak 5500 weight 0.10000E+01 volume -0.96000E-01 ppm1 2.991 ppm2 3.675 ASSI ( (segid " " and resid "157 " and name "HE3 ") OR (segid " " and resid "157 " and name "HE2 ") OR (segid " " and resid "157 " and name "HE1 ") )( (segid " " and resid "145 " and name "HD23") OR (segid " " and resid "145 " and name "HD22") OR (segid " " and resid "145 " and name "HD21") ) 5.000 5.000 0.000 peak 5501 weight 0.10000E+01 volume 0.79500E+00 ppm1 2.056 ppm2 1.001 ASSI ( (segid " " and resid "151 " and name "HD1 ") )( (segid " " and resid "118 " and name "HA ") ) 6.000 6.000 0.000 peak 5502 weight 0.10000E+01 volume -0.28400E+00 ppm1 3.287 ppm2 3.691 ASSI ( (segid " " and resid "118 " and name "HD2 ") OR (segid " " and resid "118 " and name "HD1 ") )( (segid " " and resid "115 " and name "HD23") OR (segid " " and resid "115 " and name "HD22") OR (segid " " and resid "115 " and name "HD21") ) 5.000 5.000 0.000 peak 12889 weight 0.10000E+01 volume -0.30000E+00 ppm1 3.244 ppm2 0.961 ASSI ( (segid " " and resid "137 " and name "HD2 ") OR (segid " " and resid "137 " and name "HD1 ") )( (segid " " and resid "137 " and name "HG1 ") ) 5.000 5.000 0.000 peak 5503 weight 0.10000E+01 volume -0.14360E+01 ppm1 3.162 ppm2 1.701 ASSI ( (segid " " and resid "137 " and name "HD2 ") OR (segid " " and resid "137 " and name "HD1 ") )( (segid " " and resid "143 " and name "HG23") OR (segid " " and resid "143 " and name "HG22") OR (segid " " and resid "143 " and name "HG21") ) 6.000 6.000 0.000 peak 5504 weight 0.10000E+01 volume -0.20600E+00 ppm1 3.158 ppm2 1.261 ASSI ( (segid " " and resid "44 " and name "HA1 ") )( (segid " " and resid "40 " and name "HD13") OR (segid " " and resid "40 " and name "HD12") ) 6.000 6.000 0.000 peak 13028 weight 0.10000E+01 volume -0.15100E+00 ppm1 4.212 ppm2 0.899 ASSI ( (segid " " and resid "120 " and name "HA2 ") )( (segid " " and resid "156 " and name "HD13") OR (segid " " and resid "156 " and name "HD12") OR (segid " " and resid "156 " and name "HD11") ) 6.000 6.000 0.000 peak 12870 weight 0.10000E+01 volume -0.16600E+00 ppm1 3.528 ppm2 1.005 ASSI ( (segid " " and resid "152 " and name "HA1 ") OR (segid " " and resid "120 " and name "HA1 ") )( (segid " " and resid "156 " and name "HD13") OR (segid " " and resid "156 " and name "HD12") OR (segid " " and resid "156 " and name "HD11") ) 6.000 6.000 0.000 peak 12871 weight 0.10000E+01 volume -0.23600E+00 ppm1 4.029 ppm2 1.005 ASSI ( (segid " " and resid "21 " and name "HA2 ") )( (segid " " and resid "58 " and name "HG23") OR (segid " " and resid "58 " and name "HG22") OR (segid " " and resid "58 " and name "HG21") ) 6.000 6.000 0.000 peak 10150 weight 0.10000E+01 volume -0.22000E+00 ppm1 3.554 ppm2 0.989 ASSI ( (segid " " and resid "21 " and name "HA1 ") )( (segid " " and resid "52 " and name "HE3 ") OR (segid " " and resid "52 " and name "HE2 ") ) 6.000 6.000 0.000 peak 10243 weight 0.10000E+01 volume -0.78000E-01 ppm1 4.288 ppm2 2.066 ASSI ( (segid " " and resid "21 " and name "HA1 ") )( (segid " " and resid "58 " and name "HG23") OR (segid " " and resid "58 " and name "HG22") OR (segid " " and resid "58 " and name "HG21") ) 6.000 6.000 0.000 peak 10237 weight 0.10000E+01 volume -0.20800E+00 ppm1 4.288 ppm2 0.986 ASSI ( (segid " " and resid "30 " and name "HD23") OR (segid " " and resid "30 " and name "HD22") OR (segid " " and resid "30 " and name "HD21") )( (segid " " and resid "30 " and name "HA ") ) 3.300 3.300 0.000 peak 12924 weight 0.10000E+01 volume -0.24830E+01 ppm1 0.761 ppm2 4.222 ASSI ( (segid " " and resid "89 " and name "HD13") OR (segid " " and resid "89 " and name "HD12") OR (segid " " and resid "89 " and name "HD11") )( (segid " " and resid "93 " and name "HE1 ") ) 6.000 6.000 0.000 peak 5506 weight 0.10000E+01 volume -0.55000E-01 ppm1 0.834 ppm2 2.739 ASSI ( (segid " " and resid "103 " and name "HA ") )( (segid " " and resid "111 " and name "HD23") OR (segid " " and resid "111 " and name "HD22") OR (segid " " and resid "111 " and name "HD21") ) 5.000 5.000 0.000 peak 5507 weight 0.10000E+01 volume -0.19480E+01 ppm1 5.347 ppm2 0.963 ASSI ( (segid " " and resid "38 " and name "HA ") )( (segid " " and resid "46 " and name "HB ") ) 6.000 6.000 0.000 peak 12916 weight 0.10000E+01 volume -0.17200E+00 ppm1 5.164 ppm2 4.942 ASSI ( (segid " " and resid "72 " and name "HA ") )( (segid " " and resid "72 " and name "HB2 ") ) 5.000 5.000 0.000 peak 13056 weight 0.10000E+01 volume 0.35200E+00 ppm1 5.017 ppm2 1.854 ASSI ( (segid " " and resid "55 " and name "HA ") )( (segid " " and resid "56 " and name "HD2 ") ) 5.000 5.000 0.000 peak 13071 weight 0.10000E+01 volume 0.31100E+00 ppm1 5.062 ppm2 3.379 ASSI ( (segid " " and resid "55 " and name "HA ") )( (segid " " and resid "56 " and name "HD1 ") ) 5.000 5.000 0.000 peak 13072 weight 0.10000E+01 volume 0.76900E+00 ppm1 5.062 ppm2 4.005 ASSI ( (segid " " and resid "145 " and name "HG ") )( (segid " " and resid "145 " and name "HB2 ") ) 5.000 5.000 0.000 peak 12838 weight 0.10000E+01 volume -0.18870E+01 ppm1 1.530 ppm2 1.410 ASSI ( (segid " " and resid "72 " and name "HA ") )( (segid " " and resid "72 " and name "HB1 ") ) 5.000 5.000 0.000 peak 13054 weight 0.10000E+01 volume 0.44400E+00 ppm1 4.998 ppm2 1.974 ASSI ( (segid " " and resid "145 " and name "HG ") )( (segid " " and resid "145 " and name "HB2 ") ) 5.000 5.000 0.000 peak 12840 weight 0.10000E+01 volume -0.14130E+01 ppm1 1.526 ppm2 1.410 ASSI ( (segid " " and resid "40 " and name "HA ") )( (segid " " and resid "46 " and name "HG23") OR (segid " " and resid "46 " and name "HG22") OR (segid 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-0.59600E+00 ppm1 4.373 ppm2 0.930 ASSI ( (segid " " and resid "57 " and name "HA ") )( (segid " " and resid "60 " and name "HD13") OR (segid " " and resid "60 " and name "HD12") OR (segid " " and resid "60 " and name "HD11") ) 5.000 5.000 0.000 peak 13029 weight 0.10000E+01 volume -0.70600E+00 ppm1 4.098 ppm2 0.965 ASSI ( (segid " " and resid "57 " and name "HA ") )( (segid " " and resid "60 " and name "HB1 ") ) 5.000 5.000 0.000 peak 13030 weight 0.10000E+01 volume 0.43400E+00 ppm1 4.103 ppm2 1.789 ASSI ( (segid " " and resid "57 " and name "HA ") )( (segid " " and resid "60 " and name "HB2 ") ) 6.000 6.000 0.000 peak 13031 weight 0.10000E+01 volume 0.28800E+00 ppm1 4.103 ppm2 1.612 ASSI ( (segid " " and resid "119 " and name "HA ") )( (segid " " and resid "119 " and name "HB1 ") OR (segid " " and resid "118 " and name "HB2 ") ) 5.000 5.000 0.000 peak 5509 weight 0.10000E+01 volume -0.68000E+00 ppm1 4.255 ppm2 2.053 ASSI ( (segid " " and resid "164 " and name "HA ") )( (segid " " and resid "164 " and name "HE3 ") OR (segid " " and resid "164 " and name "HE2 ") ) 5.000 5.000 0.000 peak 5510 weight 0.10000E+01 volume -0.34800E+00 ppm1 4.507 ppm2 1.983 ASSI ( (segid " " and resid "20 " and name "HA ") )( (segid " " and resid "52 " and name "HE3 ") OR (segid " " and resid "52 " and name "HE2 ") OR (segid " " and resid "52 " and name "HE1 ") ) 5.000 5.000 0.000 peak 5511 weight 0.10000E+01 volume -0.68700E+00 ppm1 4.510 ppm2 2.093 ASSI ( (segid " " and resid "89 " and name "HA ") )( (segid " " and resid "92 " and name "HB2 ") ) 6.000 6.000 0.000 peak 13001 weight 0.10000E+01 volume 0.22300E+00 ppm1 3.720 ppm2 1.348 ASSI ( (segid " " and resid "31 " and name "HA ") )( (segid " " and resid "34 " and name "HD23") OR (segid " " and resid "34 " and name "HD22") OR (segid " " and resid "34 " and name "HD21") ) 5.000 5.000 0.000 peak 5512 weight 0.10000E+01 volume -0.60900E+00 ppm1 4.639 ppm2 0.830 ASSI ( (segid " " and resid "147 " and name "HA ") )( (segid " " and resid "142 " and name "HD13") OR (segid " " and resid "142 " and name "HD12") OR (segid " " and resid "142 " and name "HD11") ) 5.000 5.000 0.000 peak 5513 weight 0.10000E+01 volume -0.66100E+00 ppm1 4.208 ppm2 0.900 ASSI ( (segid " " and resid "90 " and name "HA ") )( (segid " " and resid "93 " and name "HB2 ") ) 5.000 5.000 0.000 peak 13003 weight 0.10000E+01 volume -0.33600E+00 ppm1 4.260 ppm2 1.656 ASSI ( (segid " " and resid "63 " and name "HA ") )( (segid " " and resid "67 " and name "HB3 ") OR (segid " " and resid "67 " and name "HB2 ") OR (segid " " and resid "67 " and name "HB1 ") ) 5.000 5.000 0.000 peak 5514 weight 0.10000E+01 volume -0.51300E+00 ppm1 3.901 ppm2 1.122 ASSI ( (segid " " and resid "29 " and name "HA ") )( (segid " " and resid "33 " and name "HG1 ") ) 5.000 5.000 0.000 peak 13063 weight 0.10000E+01 volume 0.33300E+00 ppm1 3.905 ppm2 2.294 ASSI ( (segid " " and resid "29 " and name "HA ") )( (segid " " and resid "33 " and name "HG2 ") ) 5.000 5.000 0.000 peak 13066 weight 0.10000E+01 volume 0.33200E+00 ppm1 3.905 ppm2 2.205 ASSI ( (segid " " and resid "145 " and name "HA ") )( (segid " " and resid "145 " and name "HB1 ") ) 6.000 6.000 0.000 peak 13008 weight 0.10000E+01 volume 0.25500E+00 ppm1 3.922 ppm2 1.729 ASSI ( (segid " " and resid "92 " and name "HA ") )( (segid " " and resid "92 " and name "HB1 ") ) 6.000 6.000 0.000 peak 13010 weight 0.10000E+01 volume 0.15900E+00 ppm1 3.891 ppm2 2.055 ASSI ( (segid " " and resid "166 " and name "HA ") )( (segid " " and resid "167 " and name "HD1 ") ) 3.300 3.300 0.000 peak 12941 weight 0.10000E+01 volume 0.28590E+01 ppm1 4.525 ppm2 3.919 ASSI ( (segid " " and resid "92 " and name "HA ") )( (segid " " and resid "95 " and name "HD13") OR (segid " " and resid "95 " and name "HD12") OR (segid " " and resid "95 " and name "HD11") ) 5.000 5.000 0.000 peak 5516 weight 0.10000E+01 volume -0.18060E+01 ppm1 3.895 ppm2 0.738 ASSI ( (segid " " and resid "23 " and name "HB ") )( (segid " " and resid "57 " and name "HB3 ") OR (segid " " and resid "57 " and name "HB2 ") OR (segid " " and resid "57 " and name "HB1 ") ) 5.000 5.000 0.000 peak 12874 weight 0.10000E+01 volume 0.30800E+00 ppm1 1.968 ppm2 1.446 ASSI ( (segid " " and resid "161 " and name "HA ") )( (segid " " and resid "161 " and name "HB2 ") OR (segid " " and resid "161 " and name "HB1 ") ) 2.700 2.700 0.000 peak 13074 weight 0.10000E+01 volume -0.74130E+01 ppm1 4.013 ppm2 2.167 ASSI ( (segid " " and resid "61 " and name "HA ") )( (segid " " and resid "61 " and name "HB1 ") ) 5.000 5.000 0.000 peak 5517 weight 0.10000E+01 volume -0.44000E+00 ppm1 3.878 ppm2 1.966 ASSI ( (segid " " and resid "146 " and name "HA ") )( (segid " " and resid "149 " and name "HB1 ") ) 5.000 5.000 0.000 peak 5518 weight 0.10000E+01 volume -0.84900E+00 ppm1 3.999 ppm2 1.938 ASSI ( (segid " " and resid "150 " and name "HA ") )( (segid " " and resid "150 " and name "HG2 ") ) 3.300 3.300 0.000 peak 5519 weight 0.10000E+01 volume 0.20540E+01 ppm1 4.033 ppm2 2.353 ASSI ( (segid " " and resid "150 " and name "HA ") OR (segid " " and resid "24 " and name "HA ") )( (segid " " and resid "150 " and name "HG1 ") OR (segid " " and resid "24 " and name "HG1 ") ) 5.000 5.000 0.000 peak 5520 weight 0.10000E+01 volume 0.19160E+01 ppm1 4.033 ppm2 2.525 ASSI ( (segid " " and resid "157 " and name "HA ") )( (segid " " and resid "145 " and name "HD23") OR (segid " " and resid "145 " and name "HD22") OR (segid " " and resid "145 " and name "HD21") ) 5.000 5.000 0.000 peak 5521 weight 0.10000E+01 volume 0.11190E+01 ppm1 3.714 ppm2 0.998 ASSI ( (segid " " and resid "93 " and name "HA ") )( (segid " " and resid "96 " and name "HB ") ) 5.000 5.000 0.000 peak 13011 weight 0.10000E+01 volume 0.35700E+00 ppm1 3.709 ppm2 2.329 ASSI ( (segid " " and resid "127 " and name "HA ") )( (segid " " and resid "89 " and name "HD23") OR (segid " " and resid "89 " and name "HD22") OR (segid " " and resid "89 " and name "HD21") ) 6.000 6.000 0.000 peak 5522 weight 0.10000E+01 volume 0.14400E+00 ppm1 4.312 ppm2 0.584 ASSI ( (segid " " and resid "53 " and name "HA ") )( (segid " " and resid "91 " and name "HG23") OR (segid " " and resid "91 " and name "HG22") OR (segid " " and resid "91 " and name "HG21") ) 5.000 5.000 0.000 peak 12985 weight 0.10000E+01 volume 0.40700E+00 ppm1 3.914 ppm2 1.140 ASSI ( (segid " " and resid "123 " and name "HB2 ") OR (segid " " and resid "123 " and name "HB1 ") )( (segid " " and resid "89 " and name "HD22") OR (segid " " and resid "89 " and name "HD21") ) 6.000 6.000 0.000 peak 5523 weight 0.10000E+01 volume 0.75000E-01 ppm1 3.996 ppm2 0.624 ASSI ( (segid " " and resid "126 " and name "HA ") )( (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "159 " and name "HG21") ) 3.300 3.300 0.000 peak 5525 weight 0.10000E+01 volume 0.25520E+01 ppm1 4.010 ppm2 0.903 ASSI ( (segid " " and resid "35 " and name "HA ") )( (segid " " and resid "30 " and name "HD23") OR (segid " " and resid "30 " and name "HD22") OR (segid " " and resid "30 " and name "HD21") ) 5.000 5.000 0.000 peak 5651 weight 0.10000E+01 volume 0.17500E+01 ppm1 3.789 ppm2 0.729 ASSI ( (segid " " and resid "35 " and name "HA ") )( (segid " " and resid "10 " and name "HB ") ) 6.000 6.000 0.000 peak 5526 weight 0.10000E+01 volume 0.22700E+00 ppm1 3.794 ppm2 2.251 ASSI ( (segid " " and resid "55 " and name "HB2 ") )( (segid " " and resid "58 " and name "HG23") OR (segid " " and resid "58 " and name "HG22") OR (segid " " and resid "58 " and name "HG21") ) 5.000 5.000 0.000 peak 12927 weight 0.10000E+01 volume 0.36300E+00 ppm1 3.694 ppm2 0.988 ASSI ( (segid " " and resid "68 " and name "HB2 ") OR (segid " " and resid "68 " and name "HB1 ") )( (segid " " and resid "71 " and name "HG23") OR (segid " " and resid "71 " and name "HG22") OR (segid " " and resid "71 " and name "HG21") ) 5.000 5.000 0.000 peak 8051 weight 0.10000E+01 volume 0.19110E+01 ppm1 3.977 ppm2 0.924 ASSI ( (segid " " and resid "69 " and name "HA ") )( (segid " " and resid "63 " and name "HD23") OR (segid " " and resid "63 " and name "HD22") OR (segid " " and resid "63 " and name "HD21") ) 6.000 6.000 0.000 peak 5527 weight 0.10000E+01 volume 0.27200E+00 ppm1 4.419 ppm2 0.843 ASSI ( (segid " " and resid "15 " and name "HB2 ") OR (segid " " and resid "15 " and name "HB1 ") OR (segid " " and resid "15 " and name "HA ") )( (segid " " and resid "47 " and name "HA ") ) 5.000 5.000 0.000 peak 3947 weight 0.10000E+01 volume -0.57100E+00 ppm1 3.967 ppm2 4.031 ASSI ( (segid " " and resid "114 " and name "HA ") )( (segid " " and resid "114 " and name "HB1 ") ) 6.000 6.000 0.000 peak 5529 weight 0.10000E+01 volume 0.23200E+00 ppm1 3.975 ppm2 3.646 ASSI ( (segid " " and resid "37 " and name "HA ") )( (segid " " and resid "62 " and name "HD23") OR (segid " " and resid "62 " and name "HD22") OR (segid " " and resid "62 " and name "HD21") ) 5.000 5.000 0.000 peak 5655 weight 0.10000E+01 volume 0.42000E+00 ppm1 4.101 ppm2 0.903 ASSI ( (segid " " and resid "56 " and name "HA ") )( (segid " " and resid "94 " and name "HG13") OR (segid " " and resid "94 " and name "HG12") OR (segid " " and resid "94 " and name "HG11") ) 6.000 6.000 0.000 peak 13068 weight 0.10000E+01 volume 0.26000E+00 ppm1 4.308 ppm2 1.215 ASSI ( (segid " " and resid "91 " and name "HA ") )( (segid " " and resid "94 " and name "HG13") OR (segid " " and resid "94 " and name "HG12") OR (segid " " and resid "94 " and name "HG11") ) 5.000 5.000 0.000 peak 13019 weight 0.10000E+01 volume 0.56100E+00 ppm1 3.768 ppm2 1.195 ASSI ( (segid " " and resid "46 " and name "HB ") )( (segid " " and resid "38 " and name "HA ") ) 5.000 5.000 0.000 peak 12915 weight 0.10000E+01 volume -0.41500E+00 ppm1 4.936 ppm2 5.149 ASSI ( (segid " " and resid "17 " and name "HB3 ") OR (segid " " and resid "17 " and name "HB2 ") OR (segid " " and resid "17 " and name "HB1 ") )( (segid " " and resid "14 " and name "HA ") ) 6.000 6.000 0.000 peak 5600 weight 0.10000E+01 volume -0.28000E+00 ppm1 1.510 ppm2 4.075 ASSI ( (segid " " and resid "25 " and name "HG1 ") )( (segid " " and resid "17 " and name "HB3 ") OR (segid " " and resid "17 " and name "HB2 ") OR (segid " " and resid "17 " and name "HB1 ") ) 6.000 6.000 0.000 peak 12907 weight 0.10000E+01 volume -0.26700E+00 ppm1 2.351 ppm2 1.499 ASSI ( (segid " " and resid "58 " and name "HG13") OR (segid " " and resid "58 " and name "HG11") )( (segid " " and resid "21 " and name "HA2 ") ) 6.000 6.000 0.000 peak 5533 weight 0.10000E+01 volume -0.12400E+00 ppm1 0.951 ppm2 3.551 ASSI ( (segid " " and resid "58 " and name "HG23") OR (segid " " and resid "58 " and name "HG22") OR (segid " " and resid "58 " and name "HG21") )( (segid " " and resid "21 " and name "HA2 ") ) 6.000 6.000 0.000 peak 5534 weight 0.10000E+01 volume -0.25100E+00 ppm1 1.005 ppm2 3.576 ASSI ( (segid " " and resid "17 " and name "HB3 ") OR (segid " " and resid "17 " and name "HB2 ") OR (segid " " and resid "17 " and name "HB1 ") )( (segid " " and resid "25 " and name "HB2 ") ) 6.000 6.000 0.000 peak 5449 weight 0.10000E+01 volume 0.28100E+00 ppm1 1.517 ppm2 1.610 ASSI ( (segid " " and resid "65 " and name "HG2 ") )( (segid " " and resid "30 " and name "HD13") OR (segid " " and resid "30 " and name "HD12") ) 6.000 6.000 0.000 peak 5535 weight 0.10000E+01 volume -0.10100E+00 ppm1 2.454 ppm2 0.698 ASSI ( (segid " " and resid "65 " and name "HG2 ") )( (segid " " and resid "30 " and name "HD23") OR (segid " " and resid "30 " and name "HD22") OR (segid " " and resid "30 " and name "HD21") ) 6.000 6.000 0.000 peak 5536 weight 0.10000E+01 volume -0.11000E+00 ppm1 2.454 ppm2 0.778 ASSI ( (segid " " and resid "46 " and name "HG23") OR (segid " " and resid "46 " and name "HG22") OR (segid " " and resid "46 " and name "HG21") )( (segid " " and resid "38 " and name "HB1 ") ) 6.000 6.000 0.000 peak 5537 weight 0.10000E+01 volume -0.78000E-01 ppm1 1.198 ppm2 3.223 ASSI ( (segid " " and resid "46 " and name "HG23") OR (segid " " and resid "46 " and name "HG22") OR (segid " " and resid "46 " and name "HG21") )( (segid " " and resid "40 " and name "HD23") OR (segid " " and resid "40 " and name "HD22") OR (segid " " and resid "40 " and name "HD21") ) 3.300 3.300 0.000 peak 5538 weight 0.10000E+01 volume 0.22590E+01 ppm1 1.195 ppm2 0.681 ASSI ( (segid " " and resid "50 " and name "HG13") OR (segid " " and resid "50 " and name "HG12") OR (segid " " and resid "50 " and name "HG11") )( (segid " " and resid "45 " and name "HE2 ") OR (segid " " and resid "45 " and name "HE1 ") ) 6.000 6.000 0.000 peak 13037 weight 0.10000E+01 volume -0.11500E+00 ppm1 0.850 ppm2 2.953 ASSI ( (segid " " and resid "67 " and name "HB3 ") OR (segid " " and resid "67 " and name "HB2 ") OR (segid " " and resid "67 " and name "HB1 ") )( (segid " " and resid "48 " and name "HD13") OR (segid " " and resid "48 " and name "HD12") OR (segid " " and resid "48 " and name "HD11") ) 5.000 5.000 0.000 peak 5539 weight 0.10000E+01 volume 0.99200E+00 ppm1 1.129 ppm2 0.817 ASSI ( (segid " " and resid "79 " and name "HB2 ") OR (segid " " and resid "69 " and name "HB1 ") )( (segid " " and resid "48 " and name "HD13") OR (segid " " and resid "48 " and name "HD12") OR (segid " " and resid "48 " and name "HD11") ) 6.000 6.000 0.000 peak 5540 weight 0.10000E+01 volume 0.29500E+00 ppm1 1.938 ppm2 0.837 ASSI ( (segid " " and resid "91 " and name "HG23") OR (segid " " and resid "91 " and name "HG22") OR (segid " " and resid "91 " and name "HG21") )( (segid " " and resid "51 " and name "HE3 ") OR (segid " " and resid "51 " and name "HE2 ") OR (segid " " and resid "51 " and name "HE1 ") ) 5.000 5.000 0.000 peak 5542 weight 0.10000E+01 volume 0.13130E+01 ppm1 1.136 ppm2 1.687 ASSI ( (segid " " and resid "91 " and name "HG23") OR (segid " " and resid "91 " and name "HG22") OR (segid " " and resid "91 " and name "HG21") )( (segid " " and resid "53 " and name "HA ") ) 6.000 6.000 0.000 peak 12986 weight 0.10000E+01 volume 0.29100E+00 ppm1 1.140 ppm2 3.910 ASSI ( (segid " " and resid "83 " and name "HB3 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "83 " and name "HB1 ") )( (segid " " and resid "53 " and name "HD2 ") OR (segid " " and resid "53 " and name "HD1 ") ) 6.000 6.000 0.000 peak 5543 weight 0.10000E+01 volume 0.17700E+00 ppm1 1.328 ppm2 7.200 ASSI ( (segid " " and resid "83 " and name "HA ") )( (segid " " and resid "53 " and name "HD2 ") OR (segid " " and resid "53 " and name "HD1 ") ) 6.000 6.000 0.000 peak 5545 weight 0.10000E+01 volume -0.87000E-01 ppm1 3.805 ppm2 7.200 ASSI ( (segid " " and resid "83 " and name "HB3 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "83 " and name "HB1 ") )( (segid " " and resid "53 " and name "HE2 ") OR (segid " " and resid "53 " and name "HE1 ") ) 6.000 6.000 0.000 peak 5546 weight 0.10000E+01 volume 0.14200E+00 ppm1 1.328 ppm2 7.343 ASSI ( (segid " " and resid "94 " and name "HG13") OR (segid " " and resid "94 " and name "HG12") OR (segid " " and resid "94 " and name "HG11") )( (segid " " and resid "56 " and name "HA ") ) 6.000 6.000 0.000 peak 13069 weight 0.10000E+01 volume 0.14700E+00 ppm1 1.210 ppm2 4.304 ASSI ( (segid " " and resid "91 " and name "HG23") OR (segid " " and resid "91 " and name "HG22") OR (segid " " and resid "91 " and name "HG21") )( (segid " " and resid "56 " and name "HA ") ) 5.000 5.000 0.000 peak 5547 weight 0.10000E+01 volume 0.30800E+00 ppm1 1.130 ppm2 4.299 ASSI ( (segid " " and resid "94 " and name "HG23") OR (segid " " and resid "94 " and name "HG22") OR (segid " " and resid "94 " and name "HG21") )( (segid " " and resid "60 " and name "HA ") ) 5.000 5.000 0.000 peak 12892 weight 0.10000E+01 volume -0.52200E+00 ppm1 0.974 ppm2 3.648 ASSI ( (segid " " and resid "60 " and name "HD23") OR (segid " " and resid "60 " and name "HD22") OR (segid " " and resid "60 " and name "HD21") )( (segid " " and resid "64 " and name "HE2 ") OR (segid " " and resid "64 " and name "HE1 ") ) 5.000 5.000 0.000 peak 5549 weight 0.10000E+01 volume -0.30600E+00 ppm1 0.959 ppm2 2.987 ASSI ( (segid " " and resid "68 " and name "HB2 ") OR (segid " " and resid "68 " and name "HB1 ") )( (segid " " and resid "68 " and name "HA ") ) 5.000 5.000 0.000 peak 12998 weight 0.10000E+01 volume -0.36300E+00 ppm1 3.971 ppm2 4.768 ASSI ( (segid " " and resid "46 " and name "HG23") OR (segid " " and resid "46 " and name "HG22") OR (segid " " and resid "46 " and name "HG21") )( (segid " " and resid "71 " and name "HG23") OR (segid " " and resid "71 " and name "HG22") OR (segid " " and resid "71 " and name "HG21") ) 5.000 5.000 0.000 peak 5552 weight 0.10000E+01 volume 0.68300E+00 ppm1 1.195 ppm2 0.840 ASSI ( (segid " " and resid "115 " and name "HD13") OR (segid " " and resid "115 " and name "HD12") OR (segid " " and resid "115 " and name "HD11") )( (segid " " and resid "81 " and name "HD2 ") ) 6.000 6.000 0.000 peak 5553 weight 0.10000E+01 volume 0.26600E+00 ppm1 1.224 ppm2 6.523 ASSI ( (segid " " and resid "124 " and name "HA ") )( (segid " " and resid "89 " and name "HD23") OR (segid " " and resid "89 " and name "HD22") OR (segid " " and resid "89 " and name "HD21") ) 5.000 5.000 0.000 peak 5554 weight 0.10000E+01 volume 0.76500E+00 ppm1 3.748 ppm2 0.615 ASSI ( (segid " " and resid "83 " and name "HB3 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "83 " and name "HB1 ") )( (segid " " and resid "91 " and name "HB ") ) 6.000 6.000 0.000 peak 5555 weight 0.10000E+01 volume 0.16000E+00 ppm1 1.323 ppm2 4.214 ASSI ( (segid " " and resid "124 " and name "HA ") OR (segid " " and resid "80 " and name "HA ") )( (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") OR (segid " " and resid "92 " and name "HD11") ) 6.000 6.000 0.000 peak 5557 weight 0.10000E+01 volume 0.25000E+00 ppm1 3.734 ppm2 0.958 ASSI ( (segid " " and resid "96 " and name "HG22") OR (segid " " and resid "96 " and name "HG21") )( (segid " " and resid "93 " and name "HA ") ) 6.000 6.000 0.000 peak 12987 weight 0.10000E+01 volume 0.20400E+00 ppm1 1.130 ppm2 3.720 ASSI ( (segid " " and resid "69 " and name "HB2 ") )( (segid " " and resid "100 " and name "HA ") ) 6.000 6.000 0.000 peak 5558 weight 0.10000E+01 volume -0.16500E+00 ppm1 1.701 ppm2 4.224 ASSI ( (segid " " and resid "111 " and name "HD23") OR (segid " " and resid "111 " and name "HD22") OR (segid " " and resid "111 " and name "HD21") )( (segid " " and resid "103 " and name "HA ") ) 5.000 5.000 0.000 peak 5559 weight 0.10000E+01 volume -0.16330E+01 ppm1 0.963 ppm2 5.336 ASSI ( (segid " " and resid "84 " and name "HB3 ") OR (segid " " and resid "84 " and name "HB2 ") OR (segid " " and resid "84 " and name "HB1 ") )( (segid " " and resid "112 " and name "HA ") ) 6.000 6.000 0.000 peak 5560 weight 0.10000E+01 volume 0.25200E+00 ppm1 1.454 ppm2 4.157 ASSI ( (segid " " and resid "115 " and name "HD13") OR (segid " " and resid "115 " and name "HD12") OR (segid " " and resid "115 " and name "HD11") )( (segid " " and resid "112 " and name "HA ") ) 6.000 6.000 0.000 peak 5561 weight 0.10000E+01 volume 0.19700E+00 ppm1 1.223 ppm2 4.140 ASSI ( (segid " " and resid "129 " and name "HA ") )( (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD12") OR (segid " " and resid "113 " and name "HD11") ) 5.000 5.000 0.000 peak 5562 weight 0.10000E+01 volume -0.81400E+00 ppm1 3.763 ppm2 0.743 ASSI ( (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") )( (segid " " and resid "113 " and name "HG23") OR (segid " " and resid "113 " and name "HG22") OR (segid " " and resid "113 " and name "HG21") ) 5.000 5.000 0.000 peak 12972 weight 0.10000E+01 volume 0.84600E+00 ppm1 1.190 ppm2 0.756 ASSI ( (segid " " and resid "118 " and name "HB2 ") OR (segid " " and resid "118 " and name "HB1 ") )( (segid " " and resid "115 " and name "HA ") ) 5.000 5.000 0.000 peak 12896 weight 0.10000E+01 volume -0.37900E+00 ppm1 2.056 ppm2 4.068 ASSI ( (segid " " and resid "125 " and name "HG13") OR (segid " " and resid "125 " and name "HG12") OR (segid " " and resid "125 " and name "HG11") )( (segid " " and resid "117 " and name "HA ") ) 5.000 5.000 0.000 peak 12988 weight 0.10000E+01 volume 0.38500E+00 ppm1 0.991 ppm2 3.521 ASSI ( (segid " " and resid "147 " and name "HG ") )( (segid " " and resid "117 " and name "HG23") OR (segid " " and resid "117 " and name "HG22") OR (segid " " and resid "117 " and name "HG21") ) 5.000 5.000 0.000 peak 5482 weight 0.10000E+01 volume 0.51700E+00 ppm1 1.492 ppm2 0.791 ASSI ( (segid " " and resid "128 " and name "HD23") OR (segid " " and resid "128 " and name "HD22") OR (segid " " and resid "128 " and name "HD21") )( (segid " " and resid "127 " and name "HD2 ") OR (segid " " and resid "127 " and name "HD1 ") ) 5.000 5.000 0.000 peak 5563 weight 0.10000E+01 volume 0.36100E+00 ppm1 0.902 ppm2 7.134 ASSI ( (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "84 " and name "HB3 ") OR (segid " " and resid "84 " and name "HB2 ") OR (segid " " and resid "84 " and name "HB1 ") )( (segid " " and resid "128 " and name "HD13") OR (segid " " and resid "128 " and name "HD12") OR (segid " " and resid "128 " and name "HD11") ) 5.000 5.000 0.000 peak 5564 weight 0.10000E+01 volume 0.13440E+01 ppm1 1.466 ppm2 0.720 ASSI ( (segid " " and resid "114 " and name "HD2 ") )( (segid " " and resid "147 " and name "HD13") OR (segid " " and resid "147 " and name "HD12") OR (segid " " and resid "147 " and name "HD11") ) 5.000 5.000 0.000 peak 5565 weight 0.10000E+01 volume 0.53200E+00 ppm1 6.965 ppm2 1.193 ASSI ( (segid " " and resid "114 " and name "HA ") )( (segid " " and resid "147 " and name "HD13") OR (segid " " and resid "147 " and name "HD12") OR (segid " " and resid "147 " and name "HD11") ) 5.000 5.000 0.000 peak 5566 weight 0.10000E+01 volume 0.32900E+00 ppm1 3.983 ppm2 1.193 ASSI ( (segid " " and resid "157 " and name "HA ") )( (segid " " and resid "148 " and name "HB3 ") OR (segid " " and resid "148 " and name "HB2 ") OR (segid " " and resid "148 " and name "HB1 ") ) 5.000 5.000 0.000 peak 5568 weight 0.10000E+01 volume 0.36600E+00 ppm1 3.719 ppm2 1.424 ASSI ( (segid " " and resid "126 " and name "HA ") )( (segid " " and resid "159 " and name "HD13") OR (segid " " and resid "159 " and name "HD12") OR (segid " " and resid "159 " and name "HD11") ) 5.000 5.000 0.000 peak 5569 weight 0.10000E+01 volume 0.77800E+00 ppm1 4.009 ppm2 0.921 ASSI ( (segid " " and resid "117 " and name "HD13") OR (segid " " and resid "117 " and name "HD12") OR (segid " " and resid "117 " and name "HD11") )( (segid " " and resid "160 " and name "HD13") OR (segid " " and resid "160 " and name "HD12") OR (segid " " and resid "160 " and name "HD11") ) 5.000 5.000 0.000 peak 5570 weight 0.10000E+01 volume 0.13680E+01 ppm1 0.894 ppm2 0.629 ASSI ( (segid " " and resid "166 " and name "HG12") )( (segid " " and resid "166 " and name "HG22") OR (segid " " and resid "166 " and name "HG21") ) 5.000 5.000 0.000 peak 12973 weight 0.10000E+01 volume 0.45500E+00 ppm1 1.222 ppm2 0.975 ASSI ( (segid " " and resid "2 " and name "HB2 ") OR (segid " " and resid "2 " and name "HB1 ") )( (segid " " and resid "2 " and name "HA ") ) 5.000 5.000 0.000 peak 5571 weight 0.10000E+01 volume -0.15170E+01 ppm1 3.890 ppm2 4.477 ASSI ( (segid " " and resid "5 " and name "HD13") OR (segid " " and resid "5 " and name "HD11") )( (segid " " and resid "5 " and name "HA ") ) 5.000 5.000 0.000 peak 12850 weight 0.10000E+01 volume -0.49600E+00 ppm1 0.947 ppm2 4.376 ASSI ( (segid " " and resid "5 " and name "HD23") OR (segid " " and resid "5 " and name "HD22") OR (segid " " and resid "5 " and name "HD21") )( (segid " " and resid "5 " and name "HA ") ) 2.700 2.700 0.000 peak 12849 weight 0.10000E+01 volume -0.41790E+01 ppm1 0.896 ppm2 4.370 ASSI ( (segid " " and resid "7 " and name "HB2 ") OR (segid " " and resid "7 " and name "HB1 ") OR (segid " " and resid "6 " and name "HB2 ") )( (segid " " and resid "7 " and name "HA ") OR (segid " " and resid "6 " and name "HA ") ) 3.300 3.300 0.000 peak 12898 weight 0.10000E+01 volume -0.24560E+01 ppm1 1.953 ppm2 4.300 ASSI ( (segid " " and resid "6 " and name "HB1 ") )( (segid " " and resid "6 " and name "HA ") ) 3.300 3.300 0.000 peak 12897 weight 0.10000E+01 volume -0.24310E+01 ppm1 2.045 ppm2 4.300 ASSI ( (segid " " and resid "7 " and name "HG2 ") OR (segid " " and resid "6 " and name "HG2 ") OR (segid " " and resid "6 " and name "HG1 ") )( (segid " " and resid "7 " and name "HA ") OR (segid " " and resid "6 " and name "HA ") ) 5.000 5.000 0.000 peak 5578 weight 0.10000E+01 volume 0.17630E+01 ppm1 2.236 ppm2 4.314 ASSI ( (segid " " and resid "7 " and name "HB2 ") OR (segid " " and resid "7 " and name "HB1 ") )( (segid " " and resid "7 " and name "HA ") ) 3.300 3.300 0.000 peak 12899 weight 0.10000E+01 volume -0.20900E+01 ppm1 1.995 ppm2 4.300 ASSI ( (segid " " and resid "7 " and name "HG1 ") OR (segid " " and resid "6 " and name "HG1 ") )( (segid " " and resid "7 " and name "HA ") OR (segid " " and resid "6 " and name "HA ") ) 5.000 5.000 0.000 peak 5579 weight 0.10000E+01 volume 0.19550E+01 ppm1 2.273 ppm2 4.320 ASSI ( (segid " " and resid "7 " and name "HG2 ") OR (segid " " and resid "6 " and name "HG2 ") )( (segid " " and resid "7 " and name "HA ") OR (segid " " and resid "6 " and name "HA ") ) 5.000 5.000 0.000 peak 5580 weight 0.10000E+01 volume 0.16410E+01 ppm1 2.200 ppm2 4.320 ASSI ( (segid " " and resid "10 " and name "HA ") )( (segid " " and resid "13 " and name "HD2 ") OR (segid " " and resid "13 " and name "HD1 ") ) 6.000 6.000 0.000 peak 5586 weight 0.10000E+01 volume -0.23400E+00 ppm1 3.900 ppm2 3.178 ASSI ( (segid " " and resid "13 " and name "HD1 ") )( (segid " " and resid "13 " and name "HA ") ) 6.000 6.000 0.000 peak 5587 weight 0.10000E+01 volume -0.12200E+00 ppm1 3.171 ppm2 4.120 ASSI ( (segid " " and resid "13 " and name "HD2 ") OR (segid " " and resid "13 " and name "HD1 ") )( (segid " " and resid "13 " and name "HB2 ") OR (segid " " and resid "13 " and name "HB1 ") ) 3.300 3.300 0.000 peak 5588 weight 0.10000E+01 volume -0.21630E+01 ppm1 3.180 ppm2 1.945 ASSI ( (segid " " and resid "13 " and name "HD2 ") OR (segid " " and resid "13 " and name "HD1 ") )( (segid " " and resid "29 " and name "HD23") OR (segid " " and resid "29 " and name "HD22") OR (segid " " and resid "29 " and name "HD21") ) 6.000 6.000 0.000 peak 5589 weight 0.10000E+01 volume -0.14900E+00 ppm1 3.173 ppm2 0.775 ASSI ( (segid " " and resid "13 " and name "HD2 ") OR (segid " " and resid "13 " and name "HD1 ") )( (segid " " and resid "10 " and name "HG13") OR (segid " " and resid "10 " and name "HG12") OR (segid " " and resid "10 " and name "HG11") ) 6.000 6.000 0.000 peak 5590 weight 0.10000E+01 volume -0.17300E+00 ppm1 3.175 ppm2 1.128 ASSI ( (segid " " and resid "14 " and name "HA ") )( (segid " " and resid "14 " and name "HD13") OR (segid " " and resid "14 " and name "HD12") OR (segid " " and resid "14 " and name "HD11") ) 5.000 5.000 0.000 peak 5593 weight 0.10000E+01 volume -0.41300E+00 ppm1 4.085 ppm2 0.973 ASSI ( (segid " " and resid "14 " and name "HA ") )( (segid " " and resid "14 " and name "HD23") OR (segid " " and resid "14 " and name "HD22") OR (segid " " and resid "14 " and name "HD21") ) 5.000 5.000 0.000 peak 5595 weight 0.10000E+01 volume -0.13140E+01 ppm1 4.085 ppm2 0.942 ASSI ( (segid " " and resid "15 " and name "HA ") )( (segid " " and resid "47 " and name "HB3 ") OR (segid " " and resid "47 " and name "HB2 ") OR (segid " " and resid "47 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10003 weight 0.10000E+01 volume 0.10700E+01 ppm1 3.944 ppm2 1.257 ASSI ( (segid " " and resid "15 " and name "HB2 ") OR (segid " " and resid "15 " and name "HB1 ") )( (segid " " and resid "18 " and name "HB3 ") OR (segid " " and resid "18 " and name "HB2 ") OR (segid " " and resid "18 " and name "HB1 ") ) 5.000 5.000 0.000 peak 5528 weight 0.10000E+01 volume 0.10240E+01 ppm1 3.973 ppm2 1.311 ASSI ( (segid " " and resid "17 " and name "HB3 ") OR (segid " " and resid "17 " and name "HB2 ") OR (segid " " and resid "17 " and name "HB1 ") )( (segid " " and resid "17 " and name "HA ") ) 2.700 2.700 0.000 peak 5599 weight 0.10000E+01 volume -0.54980E+01 ppm1 1.508 ppm2 4.152 ASSI ( (segid " " and resid "18 " and name "HB3 ") OR (segid " " and resid "18 " and name "HB2 ") OR (segid " " and resid "18 " and name "HB1 ") )( (segid " " and resid "18 " and name "HA ") ) 2.700 2.700 0.000 peak 5601 weight 0.10000E+01 volume -0.58520E+01 ppm1 1.314 ppm2 3.824 ASSI ( (segid " " and resid "74 " and name "HB3 ") OR (segid " " and resid "74 " and name "HB2 ") OR (segid " " and resid "74 " and name "HB1 ") OR (segid " " and resid "19 " and name "HB3 ") OR (segid " " and resid "19 " and name "HB2 ") OR (segid " " and resid "19 " and name "HB1 ") )( (segid " " and resid "74 " and name "HA ") OR (segid " " and resid "19 " and name "HA ") ) 2.700 2.700 0.000 peak 5606 weight 0.10000E+01 volume -0.88810E+01 ppm1 1.557 ppm2 4.274 ASSI ( (segid " " and resid "19 " and name "HA ") )( (segid " " and resid "19 " and name "HB3 ") OR (segid " " and resid "19 " and name "HB2 ") OR (segid " " and resid "19 " and name "HB1 ") ) 2.700 2.700 0.000 peak 5607 weight 0.10000E+01 volume -0.74510E+01 ppm1 4.304 ppm2 1.560 ASSI ( (segid " " and resid "23 " and name "HA ") )( (segid " " and resid "23 " and name "HG23") OR (segid " " and resid "23 " and name "HG22") OR (segid " " and resid "23 " and name "HG21") ) 5.000 5.000 0.000 peak 5615 weight 0.10000E+01 volume 0.68900E+00 ppm1 3.376 ppm2 0.927 ASSI ( (segid " " and resid "23 " and name "HG23") OR (segid " " and resid "23 " and name "HG22") OR (segid " " and resid "23 " and name "HG21") )( (segid " " and resid "23 " and name "HA ") ) 5.000 5.000 0.000 peak 12848 weight 0.10000E+01 volume 0.51600E+00 ppm1 0.928 ppm2 3.380 ASSI ( (segid " " and resid "23 " and name "HB ") )( (segid " " and resid "23 " and name "HA ") ) 5.000 5.000 0.000 peak 5613 weight 0.10000E+01 volume 0.43600E+00 ppm1 1.965 ppm2 3.372 ASSI ( (segid " " and resid "23 " and name "HB ") )( (segid " " and resid "23 " and name "HG23") OR (segid " " and resid "23 " and name "HG22") OR (segid " " and resid "23 " and name "HG21") ) 3.300 3.300 0.000 peak 5612 weight 0.10000E+01 volume 0.23770E+01 ppm1 1.955 ppm2 0.921 ASSI ( (segid " " and resid "23 " and name "HA ") )( (segid " " and resid "23 " and name "HB ") ) 5.000 5.000 0.000 peak 5614 weight 0.10000E+01 volume 0.61900E+00 ppm1 3.373 ppm2 1.965 ASSI ( (segid " " and resid "23 " and name "HA ") )( (segid " " and resid "26 " and name "HG13") OR (segid " " and resid "26 " and name "HG12") OR (segid " " and resid "23 " and name "HG13") OR (segid " " and resid "23 " and name "HG11") ) 3.300 3.300 0.000 peak 5530 weight 0.10000E+01 volume 0.32360E+01 ppm1 3.376 ppm2 0.948 ASSI ( (segid " " and resid "23 " and name "HG23") OR (segid " " and resid "23 " and name "HG22") OR (segid " " and resid "23 " and name "HG21") )( (segid " " and resid "23 " and name "HB ") ) 3.300 3.300 0.000 peak 5611 weight 0.10000E+01 volume 0.30520E+01 ppm1 0.915 ppm2 1.960 ASSI ( (segid " " and resid "24 " and name "HG2 ") OR (segid " " and resid "24 " and name "HG1 ") )( (segid " " and resid "23 " and name "HG23") OR (segid " " and resid "23 " and name "HG22") OR (segid " " and resid "23 " and name "HG21") ) 5.000 5.000 0.000 peak 5619 weight 0.10000E+01 volume -0.36800E+00 ppm1 2.483 ppm2 0.924 ASSI ( (segid " " and resid "25 " and name "HB1 ") )( (segid " " and resid "25 " and name "HA ") ) 6.000 6.000 0.000 peak 5620 weight 0.10000E+01 volume -0.71000E-01 ppm1 1.972 ppm2 4.629 ASSI ( (segid " " and resid "124 " and name "HG13") OR (segid " " and resid "124 " and name "HG11") OR (segid " " and resid "26 " and name "HG13") OR (segid " " and resid "26 " and name "HG12") OR (segid " " and resid "26 " and name "HG11") )( (segid " " and resid "125 " and name "HA ") OR (segid " " and resid "26 " and name "HA ") ) 3.300 3.300 0.000 peak 5623 weight 0.10000E+01 volume 0.28760E+01 ppm1 0.930 ppm2 3.389 ASSI ( (segid " " and resid "26 " and name "HB ") )( (segid " " and resid "26 " and name "HA ") ) 6.000 6.000 0.000 peak 5625 weight 0.10000E+01 volume 0.18300E+00 ppm1 2.176 ppm2 3.389 ASSI ( (segid " " and resid "26 " and name "HB ") )( (segid " " and resid "26 " and name "HG23") OR (segid " " and resid "26 " and name "HG22") OR (segid " " and resid "26 " and name "HG21") ) 3.300 3.300 0.000 peak 5624 weight 0.10000E+01 volume 0.24760E+01 ppm1 2.206 ppm2 0.861 ASSI ( (segid " " and resid "26 " and name "HG23") OR (segid " " and resid "26 " and name "HG22") OR (segid " " and resid "26 " and name "HG21") )( (segid " " and resid "26 " and name "HB ") ) 3.300 3.300 0.000 peak 5621 weight 0.10000E+01 volume 0.25140E+01 ppm1 0.830 ppm2 2.170 ASSI ( (segid " " and resid "26 " and name "HG23") OR (segid " " and resid "26 " and name "HG22") OR (segid " " and resid "26 " and name "HG21") )( (segid " " and resid "26 " and name "HA ") ) 3.300 3.300 0.000 peak 5622 weight 0.10000E+01 volume 0.20830E+01 ppm1 0.830 ppm2 3.389 ASSI ( (segid " " and resid "27 " and name "HD2 ") OR (segid " " and resid "27 " and name "HD1 ") )( (segid " " and resid "27 " and name "HB2 ") OR (segid " " and resid "27 " and name "HB1 ") ) 3.300 3.300 0.000 peak 5629 weight 0.10000E+01 volume -0.20220E+01 ppm1 3.110 ppm2 1.883 ASSI ( (segid " " and resid "29 " and name "HD23") OR (segid " " and resid "29 " and name "HD22") OR (segid " " and resid "29 " and name "HD21") )( (segid " " and resid "29 " and name "HG ") ) 3.300 3.300 0.000 peak 5467 weight 0.10000E+01 volume 0.24090E+01 ppm1 0.767 ppm2 1.799 ASSI ( (segid " " and resid "29 " and name "HG ") )( (segid " " and resid "29 " and name "HD13") OR (segid " " and resid "29 " and name "HD12") OR (segid " " and resid "29 " and name "HD11") ) 5.000 5.000 0.000 peak 5630 weight 0.10000E+01 volume 0.14080E+01 ppm1 1.831 ppm2 0.782 ASSI ( (segid " " and resid "30 " and name "HD23") OR (segid " " and resid "30 " and name "HD22") OR (segid " " and resid "30 " and name "HD21") )( (segid " " and resid "30 " and name "HG ") ) 3.300 3.300 0.000 peak 5632 weight 0.10000E+01 volume 0.20350E+01 ppm1 0.757 ppm2 1.949 ASSI ( (segid " " and resid "30 " and name "HA ") )( (segid " " and resid "30 " and name "HD23") OR (segid " " and resid "30 " and name "HD22") OR (segid " " and resid "30 " and name "HD21") ) 3.300 3.300 0.000 peak 5634 weight 0.10000E+01 volume -0.21360E+01 ppm1 4.228 ppm2 0.758 ASSI ( (segid " " and resid "31 " and name "HB2 ") OR (segid " " and resid "31 " and name "HB1 ") )( (segid " " and resid "31 " and name "HA ") ) 6.000 6.000 0.000 peak 5639 weight 0.10000E+01 volume -0.13700E+00 ppm1 3.117 ppm2 4.650 ASSI ( (segid " " and resid "31 " and name "HA ") )( (segid " " and resid "31 " and name "HB2 ") OR (segid " " and resid "31 " and name "HB1 ") ) 5.000 5.000 0.000 peak 5640 weight 0.10000E+01 volume -0.79800E+00 ppm1 4.639 ppm2 3.111 ASSI ( (segid " " and resid "33 " and name "HG1 ") )( (segid " " and resid "33 " and name "HA ") ) 5.000 5.000 0.000 peak 5641 weight 0.10000E+01 volume 0.98900E+00 ppm1 2.300 ppm2 4.437 ASSI ( (segid " " and resid "33 " and name "HG2 ") )( (segid " " and resid "33 " and name "HA ") ) 5.000 5.000 0.000 peak 5642 weight 0.10000E+01 volume 0.60200E+00 ppm1 2.198 ppm2 4.437 ASSI ( (segid " " and resid "33 " and name "HA ") )( (segid " " and resid "33 " and name "HG2 ") ) 5.000 5.000 0.000 peak 13062 weight 0.10000E+01 volume 0.75100E+00 ppm1 4.470 ppm2 2.229 ASSI ( (segid " " and resid "34 " and name "HA ") )( (segid " " and resid "34 " and name "HD13") OR (segid " " and resid "34 " and name "HD12") OR (segid " " and resid "34 " and name "HD11") ) 5.000 5.000 0.000 peak 10249 weight 0.10000E+01 volume -0.58800E+00 ppm1 4.017 ppm2 0.939 ASSI ( (segid " " and resid "34 " and name "HD23") OR (segid " " and resid "34 " and name "HD22") OR (segid " " and resid "34 " and name "HD21") )( (segid " " and resid "34 " and name "HG ") ) 5.000 5.000 0.000 peak 5644 weight 0.10000E+01 volume 0.15280E+01 ppm1 0.848 ppm2 1.384 ASSI ( (segid " " and resid "34 " and name "HB1 ") )( (segid " " and resid "34 " and name "HD13") OR (segid " " and resid "34 " and name "HD12") OR (segid " " and resid "34 " and name "HD11") ) 5.000 5.000 0.000 peak 5645 weight 0.10000E+01 volume -0.95900E+00 ppm1 1.985 ppm2 0.928 ASSI ( (segid " " and resid "34 " and name "HB1 ") )( (segid " " and resid "34 " and name "HD23") OR (segid " " and resid "34 " and name "HD22") OR (segid " " and resid "34 " and name "HD21") ) 5.000 5.000 0.000 peak 12862 weight 0.10000E+01 volume -0.55600E+00 ppm1 1.979 ppm2 0.857 ASSI ( (segid " " and resid "34 " and name "HB2 ") )( (segid " " and resid "34 " and name "HD13") OR (segid " " and resid "34 " and name "HD12") OR (segid " " and resid "34 " and name "HD11") ) 5.000 5.000 0.000 peak 5646 weight 0.10000E+01 volume -0.86300E+00 ppm1 1.631 ppm2 0.928 ASSI ( (segid " " and resid "34 " and name "HB2 ") )( (segid " " and resid "34 " and name "HD23") OR (segid " " and resid "34 " and name "HD22") OR (segid " " and resid "34 " and name "HD21") ) 5.000 5.000 0.000 peak 5647 weight 0.10000E+01 volume -0.82700E+00 ppm1 1.631 ppm2 0.865 ASSI ( (segid " " and resid "34 " and name "HG ") )( (segid " " and resid "34 " and name "HD23") OR (segid " " and resid "34 " and name "HD22") OR (segid " " and resid "34 " and name "HD21") ) 5.000 5.000 0.000 peak 13035 weight 0.10000E+01 volume 0.16230E+01 ppm1 1.384 ppm2 0.849 ASSI ( (segid " " and resid "35 " and name "HA ") )( (segid " " and resid "35 " and name "HG23") OR (segid " " and resid "35 " and name "HG22") OR (segid " " and resid "35 " and name "HG21") ) 5.000 5.000 0.000 peak 5649 weight 0.10000E+01 volume 0.11960E+01 ppm1 3.794 ppm2 0.927 ASSI ( (segid " " and resid "35 " and name "HA ") )( (segid " " and resid "35 " and name "HG13") OR (segid " " and resid "35 " and name "HG12") ) 5.000 5.000 0.000 peak 5650 weight 0.10000E+01 volume 0.17390E+01 ppm1 3.794 ppm2 0.970 ASSI ( (segid " " and resid "37 " and name "HA ") )( (segid " " and resid "37 " and name "HB2 ") ) 6.000 6.000 0.000 peak 5652 weight 0.10000E+01 volume 0.15000E+00 ppm1 4.104 ppm2 1.691 ASSI ( (segid " " and resid "37 " and name "HA ") )( (segid " " and resid "37 " and name "HB1 ") ) 5.000 5.000 0.000 peak 5653 weight 0.10000E+01 volume 0.49800E+00 ppm1 4.099 ppm2 1.952 ASSI ( (segid " " and resid "37 " and name "HA ") )( (segid " " and resid "30 " and name "HD23") OR (segid " " and resid "30 " and name "HD21") ) 5.000 5.000 0.000 peak 5654 weight 0.10000E+01 volume 0.63700E+00 ppm1 4.101 ppm2 0.767 ASSI ( (segid " " and resid "38 " and name "HA ") )( (segid " " and resid "46 " and name "HG23") OR (segid " " and resid "46 " and name "HG22") OR (segid " " and resid "46 " and name "HG21") ) 5.000 5.000 0.000 peak 5659 weight 0.10000E+01 volume -0.79300E+00 ppm1 5.154 ppm2 1.204 ASSI ( (segid " " and resid "39 " and name "HA ") )( (segid " " and resid "39 " and name "HB3 ") OR (segid " " and resid "39 " and name "HB2 ") OR (segid " " and resid "39 " and name "HB1 ") ) 3.300 3.300 0.000 peak 10248 weight 0.10000E+01 volume -0.39910E+01 ppm1 4.049 ppm2 1.404 ASSI ( (segid " " and resid "40 " and name "HD23") OR (segid " " and resid "40 " and name "HD22") OR (segid " " and resid "40 " and name "HD21") )( (segid " " and resid "40 " and name "HG ") ) 3.300 3.300 0.000 peak 5661 weight 0.10000E+01 volume 0.20530E+01 ppm1 0.673 ppm2 1.780 ASSI ( (segid " " and resid "40 " and name "HA ") )( (segid " " and resid "40 " and name "HD12") OR (segid " " and resid "40 " and name "HD11") ) 5.000 5.000 0.000 peak 12911 weight 0.10000E+01 volume -0.64700E+00 ppm1 4.372 ppm2 0.898 ASSI ( (segid " " and resid "42 " and name "HD2 ") OR (segid " " and resid "42 " and name "HD1 ") )( (segid " " and resid "42 " and name "HG2 ") ) 5.000 5.000 0.000 peak 5665 weight 0.10000E+01 volume -0.67300E+00 ppm1 2.939 ppm2 0.267 ASSI ( (segid " " and resid "42 " and name "HA ") )( (segid " " and resid "42 " and name "HB2 ") ) 5.000 5.000 0.000 peak 5669 weight 0.10000E+01 volume -0.54400E+00 ppm1 4.162 ppm2 1.754 ASSI ( (segid " " and resid "42 " and name "HD2 ") OR (segid " " and resid "42 " and name "HD1 ") )( (segid " " and resid "42 " and name "HB1 ") ) 6.000 6.000 0.000 peak 5667 weight 0.10000E+01 volume -0.20600E+00 ppm1 2.935 ppm2 1.952 ASSI ( (segid " " and resid "45 " and name "HD1 ") )( (segid " " and resid "45 " and name "HE2 ") OR (segid " " and resid "45 " and name "HE1 ") ) 5.000 5.000 0.000 peak 13041 weight 0.10000E+01 volume -0.31300E+00 ppm1 1.577 ppm2 2.954 ASSI ( (segid " " and resid "45 " and name "HE2 ") OR (segid " " and resid "45 " and name "HE1 ") )( (segid " " and resid "50 " and name "HG13") OR (segid " " and resid "50 " and name "HG12") OR (segid " " and resid "50 " and name "HG11") ) 6.000 6.000 0.000 peak 13038 weight 0.10000E+01 volume -0.86000E-01 ppm1 2.960 ppm2 0.872 ASSI ( (segid " " and resid "45 " and name "HE2 ") OR (segid " " and resid "45 " and name "HE1 ") )( (segid " " and resid "45 " and name "HD1 ") ) 5.000 5.000 0.000 peak 13039 weight 0.10000E+01 volume -0.11860E+01 ppm1 2.960 ppm2 1.577 ASSI ( (segid " " and resid "46 " and name "HG23") OR (segid " " and resid "46 " and name "HG22") OR (segid " " and resid "46 " and name "HG21") )( (segid " " and resid "46 " and name "HB ") ) 5.000 5.000 0.000 peak 12914 weight 0.10000E+01 volume 0.74700E+00 ppm1 1.204 ppm2 4.938 ASSI ( (segid " " and resid "46 " and name "HB ") )( (segid " " and resid "46 " and name "HG23") OR (segid " " and resid "46 " and name "HG22") OR (segid " " and resid "46 " and name "HG21") ) 5.000 5.000 0.000 peak 5672 weight 0.10000E+01 volume 0.19360E+01 ppm1 4.937 ppm2 1.198 ASSI ( (segid " " and resid "47 " and name "HA ") )( (segid " " and resid "47 " and name "HB3 ") OR (segid " " and resid "47 " and name "HB2 ") OR (segid " " and resid "47 " and name "HB1 ") ) 3.300 3.300 0.000 peak 5673 weight 0.10000E+01 volume -0.23940E+01 ppm1 4.026 ppm2 1.264 ASSI ( (segid " " and resid "47 " and name "HB3 ") OR (segid " " and resid "47 " and name "HB2 ") OR (segid " " and resid "47 " and name "HB1 ") )( (segid " " and resid "62 " and name "HD13") OR (segid " " and resid "62 " and name "HD12") OR (segid " " and resid "62 " and name "HD11") ) 5.000 5.000 0.000 peak 5675 weight 0.10000E+01 volume 0.68700E+00 ppm1 1.251 ppm2 0.696 ASSI ( (segid " " and resid "48 " and name "HG ") )( (segid " " and resid "48 " and name "HD13") OR (segid " " and resid "48 " and name "HD12") OR (segid " " and resid "48 " and name "HD11") ) 5.000 5.000 0.000 peak 5678 weight 0.10000E+01 volume 0.75900E+00 ppm1 1.751 ppm2 0.845 ASSI ( (segid " " and resid "48 " and name "HB2 ") )( (segid " " and resid "48 " and name "HD23") OR (segid " " and resid "48 " and name "HD22") OR (segid " " and resid "48 " and name "HD21") ) 5.000 5.000 0.000 peak 5679 weight 0.10000E+01 volume -0.48700E+00 ppm1 1.399 ppm2 0.807 ASSI ( (segid " " and resid "50 " and name "HB ") )( (segid " " and resid "50 " and name "HG13") OR (segid " " and resid "50 " and name "HG12") OR (segid " " and resid "50 " and name "HG11") ) 5.000 5.000 0.000 peak 5687 weight 0.10000E+01 volume 0.16370E+01 ppm1 2.510 ppm2 0.858 ASSI ( (segid " " and resid "50 " and name "HG23") OR (segid " " and resid "50 " and name "HG22") OR (segid " " and resid "50 " and name "HG21") )( (segid " " and resid "19 " and name "HB3 ") OR (segid " " and resid "19 " and name "HB2 ") OR (segid " " and resid "19 " and name "HB1 ") ) 5.000 5.000 0.000 peak 5688 weight 0.10000E+01 volume 0.75800E+00 ppm1 0.926 ppm2 1.571 ASSI ( (segid " " and resid "51 " and name "HE3 ") OR (segid " " and resid "51 " and name "HE2 ") OR (segid " " and resid "51 " and name "HE1 ") )( (segid " " and resid "91 " and name "HG23") OR (segid " " and resid "91 " and name "HG22") OR (segid " " and resid "91 " and name "HG21") ) 5.000 5.000 0.000 peak 5692 weight 0.10000E+01 volume 0.18700E+01 ppm1 1.692 ppm2 1.126 ASSI ( (segid " " and resid "51 " and name "HE3 ") OR (segid " " and resid "51 " and name "HE2 ") OR (segid " " and resid "51 " and name "HE1 ") )( (segid " " and resid "58 " and name "HG13") OR (segid " " and resid "58 " and name "HG12") OR (segid " " and resid "58 " and name "HG11") ) 5.000 5.000 0.000 peak 5693 weight 0.10000E+01 volume 0.85000E+00 ppm1 1.690 ppm2 0.937 ASSI ( (segid " " and resid "52 " and name "HB1 ") )( (segid " " and resid "52 " and name "HA ") OR (segid " " and resid "19 " and name "HA ") ) 5.000 5.000 0.000 peak 5700 weight 0.10000E+01 volume -0.77000E+00 ppm1 2.126 ppm2 4.261 ASSI ( (segid " " and resid "52 " and name "HG2 ") OR (segid " " and resid "52 " and name "HG1 ") )( (segid " " and resid "52 " and name "HA ") OR (segid " " and resid "19 " and name "HA ") ) 6.000 6.000 0.000 peak 5701 weight 0.10000E+01 volume -0.25400E+00 ppm1 2.559 ppm2 4.248 ASSI ( (segid " " and resid "52 " and name "HA ") OR (segid " " and resid "19 " and name "HA ") )( (segid " " and resid "52 " and name "HB2 ") ) 6.000 6.000 0.000 peak 5702 weight 0.10000E+01 volume -0.26400E+00 ppm1 4.255 ppm2 1.875 ASSI ( (segid " " and resid "52 " and name "HA ") OR (segid " " and resid "19 " and name "HA ") )( (segid " " and resid "52 " and name "HB1 ") ) 5.000 5.000 0.000 peak 5703 weight 0.10000E+01 volume -0.96200E+00 ppm1 4.255 ppm2 2.128 ASSI ( (segid " " and resid "52 " and name "HA ") OR (segid " " and resid "19 " and name "HA ") )( (segid " " and resid "52 " and name "HG2 ") OR (segid " " and resid "52 " and name "HG1 ") ) 5.000 5.000 0.000 peak 5704 weight 0.10000E+01 volume -0.30200E+00 ppm1 4.255 ppm2 2.561 ASSI ( (segid " " and resid "53 " and name "HE2 ") OR (segid " " and resid "53 " and name "HE1 ") )( (segid " " and resid "83 " and name "HB3 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "83 " and name "HB1 ") ) 6.000 6.000 0.000 peak 5706 weight 0.10000E+01 volume 0.12500E+00 ppm1 7.318 ppm2 1.339 ASSI ( (segid " " and resid "55 " and name "HA ") )( (segid " " and resid "56 " and name "HG2 ") OR (segid " " and resid "56 " and name "HG1 ") ) 6.000 6.000 0.000 peak 13073 weight 0.10000E+01 volume -0.90000E-01 ppm1 5.062 ppm2 2.055 ASSI ( (segid " " and resid "55 " and name "HA ") )( (segid " " and resid "55 " and name "HB1 ") ) 5.000 5.000 0.000 peak 5708 weight 0.10000E+01 volume -0.40500E+00 ppm1 5.061 ppm2 3.994 ASSI ( (segid " " and resid "56 " and name "HB2 ") )( (segid " " and resid "56 " and name "HA ") ) 5.000 5.000 0.000 peak 5710 weight 0.10000E+01 volume 0.66800E+00 ppm1 1.972 ppm2 4.308 ASSI ( (segid " " and resid "56 " and name "HB1 ") )( (segid " " and resid "56 " and name "HA ") ) 5.000 5.000 0.000 peak 5711 weight 0.10000E+01 volume 0.90300E+00 ppm1 2.042 ppm2 4.308 ASSI ( (segid " " and resid "56 " and name "HG2 ") OR (segid " " and resid "56 " and name "HG1 ") )( (segid " " and resid "90 " and name "HB2 ") ) 5.000 5.000 0.000 peak 5712 weight 0.10000E+01 volume -0.32800E+00 ppm1 2.054 ppm2 2.558 ASSI ( (segid " " and resid "56 " and name "HG2 ") OR (segid " " and resid "56 " and name "HG1 ") )( (segid " " and resid "90 " and name "HB1 ") ) 6.000 6.000 0.000 peak 5713 weight 0.10000E+01 volume -0.24600E+00 ppm1 2.054 ppm2 2.760 ASSI ( (segid " " and resid "56 " and name "HA ") )( (segid " " and resid "91 " and name "HA ") ) 5.000 5.000 0.000 peak 5714 weight 0.10000E+01 volume 0.34300E+00 ppm1 4.320 ppm2 3.768 ASSI ( (segid " " and resid "56 " and name "HA ") )( (segid " " and resid "59 " and name "HB3 ") OR (segid " " and resid "59 " and name "HB2 ") OR (segid " " and resid "59 " and name "HB1 ") ) 5.000 5.000 0.000 peak 5715 weight 0.10000E+01 volume 0.68400E+00 ppm1 4.315 ppm2 1.325 ASSI ( (segid " " and resid "57 " and name "HB3 ") OR (segid " " and resid "57 " and name "HB2 ") OR (segid " " and resid "57 " and name "HB1 ") )( (segid " " and resid "57 " and name "HA ") ) 2.700 2.700 0.000 peak 5716 weight 0.10000E+01 volume -0.61080E+01 ppm1 1.445 ppm2 4.102 ASSI ( (segid " " and resid "58 " and name "HG13") OR (segid " " and resid "58 " and name "HG12") OR (segid " " and resid "58 " and name "HG11") )( (segid " " and resid "58 " and name "HA ") ) 5.000 5.000 0.000 peak 5717 weight 0.10000E+01 volume 0.17440E+01 ppm1 0.964 ppm2 3.442 ASSI ( (segid " " and resid "58 " and name "HG23") OR (segid " " and resid "58 " and name "HG22") OR (segid " " and resid "58 " and name "HG21") )( (segid " " and resid "58 " and name "HA ") ) 5.000 5.000 0.000 peak 5718 weight 0.10000E+01 volume 0.17720E+01 ppm1 1.006 ppm2 3.432 ASSI ( (segid " " and resid "83 " and name "HA ") OR (segid " " and resid "59 " and name "HA ") )( (segid " " and resid "83 " and name "HB3 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "83 " and name "HB1 ") OR (segid " " and resid "59 " and name "HB3 ") OR (segid " " and resid "59 " and name "HB2 ") OR (segid " " and resid "59 " and name "HB1 ") ) 2.700 2.700 0.000 peak 5719 weight 0.10000E+01 volume -0.64470E+01 ppm1 3.763 ppm2 1.344 ASSI ( (segid " " and resid "60 " and name "HB1 ") )( (segid " " and resid "57 " and name "HA ") ) 6.000 6.000 0.000 peak 5721 weight 0.10000E+01 volume 0.22500E+00 ppm1 1.800 ppm2 4.118 ASSI ( (segid " " and resid "60 " and name "HA ") )( (segid " " and resid "94 " and name "HG23") OR (segid " " and resid "94 " and name "HG22") OR (segid " " and resid "94 " and name "HG21") ) 5.000 5.000 0.000 peak 12893 weight 0.10000E+01 volume -0.58200E+00 ppm1 3.628 ppm2 0.968 ASSI ( (segid " " and resid "62 " and name "HD23") OR (segid " " and resid "62 " and name "HD22") OR (segid " " and resid "62 " and name "HD21") )( (segid " " and resid "62 " and name "HB1 ") ) 5.000 5.000 0.000 peak 12900 weight 0.10000E+01 volume -0.86900E+00 ppm1 0.907 ppm2 1.863 ASSI ( (segid " " and resid "62 " and name "HB1 ") )( (segid " " and resid "62 " and name "HD23") OR (segid " " and resid "62 " and name "HD22") OR (segid " " and resid "62 " and name "HD21") ) 5.000 5.000 0.000 peak 12901 weight 0.10000E+01 volume -0.41300E+00 ppm1 1.862 ppm2 0.912 ASSI ( (segid " " and resid "62 " and name "HB2 ") )( (segid " " and resid "62 " and name "HD23") OR (segid " " and resid "62 " and name "HD22") OR (segid " " and resid "62 " and name "HD21") ) 5.000 5.000 0.000 peak 12902 weight 0.10000E+01 volume -0.65400E+00 ppm1 1.182 ppm2 0.912 ASSI ( (segid " " and resid "64 " and name "HE2 ") OR (segid " " and resid "64 " and name "HE1 ") )( (segid " " and resid "60 " and name "HD23") OR (segid " " and resid "60 " and name "HD22") OR (segid " " and resid "60 " and name "HD21") ) 6.000 6.000 0.000 peak 5723 weight 0.10000E+01 volume -0.18400E+00 ppm1 2.982 ppm2 0.966 ASSI ( (segid " " and resid "64 " and name "HE2 ") OR (segid " " and resid "64 " and name "HE1 ") )( (segid " " and resid "60 " and name "HD13") OR (segid " " and resid "60 " and name "HD12") OR (segid " " and resid "60 " and name "HD11") ) 6.000 6.000 0.000 peak 5726 weight 0.10000E+01 volume -0.20900E+00 ppm1 2.982 ppm2 0.966 ASSI ( (segid " " and resid "64 " and name "HE2 ") OR (segid " " and resid "64 " and name "HE1 ") )( (segid " " and resid "64 " and name "HD2 ") OR (segid " " and resid "64 " and name "HD1 ") ) 3.300 3.300 0.000 peak 5724 weight 0.10000E+01 volume -0.21650E+01 ppm1 2.991 ppm2 1.701 ASSI ( (segid " " and resid "65 " and name "HB2 ") )( (segid " " and resid "65 " and name "HA ") ) 6.000 6.000 0.000 peak 5727 weight 0.10000E+01 volume -0.27600E+00 ppm1 2.040 ppm2 4.519 ASSI ( (segid " " and resid "65 " and name "HB1 ") )( (segid " " and resid "65 " and name "HA ") ) 6.000 6.000 0.000 peak 5728 weight 0.10000E+01 volume -0.20900E+00 ppm1 2.171 ppm2 4.519 ASSI ( (segid " " and resid "65 " and name "HA ") )( (segid " " and resid "65 " and name "HB2 ") ) 5.000 5.000 0.000 peak 5729 weight 0.10000E+01 volume -0.10560E+01 ppm1 4.510 ppm2 2.046 ASSI ( (segid " " and resid "65 " and name "HA ") )( (segid " " and resid "65 " and name "HB1 ") ) 5.000 5.000 0.000 peak 5730 weight 0.10000E+01 volume -0.11350E+01 ppm1 4.510 ppm2 2.171 ASSI ( (segid " " and resid "67 " and name "HB3 ") OR (segid " " and resid "67 " and name "HB2 ") OR (segid " " and resid "67 " and name "HB1 ") )( (segid " " and resid "67 " and name "HA ") ) 5.000 5.000 0.000 peak 5732 weight 0.10000E+01 volume -0.19580E+01 ppm1 1.128 ppm2 3.999 ASSI ( (segid " " and resid "69 " and name "HA ") )( (segid " " and resid "69 " and name "HB2 ") ) 6.000 6.000 0.000 peak 5733 weight 0.10000E+01 volume 0.21800E+00 ppm1 4.408 ppm2 1.717 ASSI ( (segid " " and resid "71 " and name "HG13") OR (segid " " and resid "71 " and name "HG12") OR (segid " " and resid "71 " and name "HG11") )( (segid " " and resid "71 " and name "HB ") ) 5.000 5.000 0.000 peak 5737 weight 0.10000E+01 volume -0.13250E+01 ppm1 0.848 ppm2 2.058 ASSI ( (segid " " and resid "71 " and name "HB ") )( (segid " " and resid "71 " and name "HG23") OR (segid " " and resid "71 " and name "HG22") OR (segid " " and resid "71 " and name "HG21") ) 2.700 2.700 0.000 peak 5739 weight 0.10000E+01 volume -0.43920E+01 ppm1 2.053 ppm2 0.925 ASSI ( (segid " " and resid "71 " and name "HB ") )( (segid " " and resid "71 " and name "HG13") OR (segid " " and resid "71 " and name "HG12") OR (segid " " and resid "71 " and name "HG11") ) 5.000 5.000 0.000 peak 5740 weight 0.10000E+01 volume -0.15790E+01 ppm1 2.049 ppm2 0.850 ASSI ( (segid " " and resid "71 " and name "HA ") )( (segid " " and resid "71 " and name "HG23") OR (segid " " and resid "71 " and name "HG22") OR (segid " " and resid "71 " and name "HG21") ) 3.300 3.300 0.000 peak 12844 weight 0.10000E+01 volume 0.21100E+01 ppm1 4.340 ppm2 0.911 ASSI ( (segid " " and resid "71 " and name "HG23") OR (segid " " and resid "71 " and name "HG22") OR (segid " " and resid "71 " and name "HG21") )( (segid " " and resid "46 " and name "HG23") OR (segid " " and resid "46 " and name "HG22") OR (segid " " and resid "46 " and name "HG21") ) 5.000 5.000 0.000 peak 5742 weight 0.10000E+01 volume 0.60100E+00 ppm1 0.848 ppm2 1.210 ASSI ( (segid " " and resid "72 " and name "HA ") )( (segid " " and resid "72 " and name "HG2 ") OR (segid " " and resid "72 " and name "HG1 ") ) 5.000 5.000 0.000 peak 13057 weight 0.10000E+01 volume 0.89100E+00 ppm1 4.998 ppm2 2.252 ASSI ( (segid " " and resid "75 " and name "HB1 ") )( (segid " " and resid "75 " and name "HA ") ) 5.000 5.000 0.000 peak 5748 weight 0.10000E+01 volume -0.49800E+00 ppm1 4.102 ppm2 4.665 ASSI ( (segid " " and resid "75 " and name "HA ") )( (segid " " and resid "75 " and name "HB2 ") ) 3.300 3.300 0.000 peak 5746 weight 0.10000E+01 volume -0.25700E+01 ppm1 4.662 ppm2 4.053 ASSI ( (segid " " and resid "75 " and name "HB2 ") )( (segid " " and resid "75 " and name "HA ") ) 6.000 6.000 0.000 peak 5747 weight 0.10000E+01 volume -0.29800E+00 ppm1 4.026 ppm2 4.665 ASSI ( (segid " " and resid "77 " and name "HG23") OR (segid " " and resid "77 " and name "HG22") OR (segid " " and resid "77 " and name "HG21") )( (segid " " and resid "77 " and name "HA ") ) 5.000 5.000 0.000 peak 5749 weight 0.10000E+01 volume 0.99400E+00 ppm1 1.239 ppm2 3.789 ASSI ( (segid " " and resid "77 " and name "HG23") OR (segid " " and resid "77 " and name "HG22") OR (segid " " and resid "77 " and name "HG21") )( (segid " " and resid "77 " and name "HB ") ) 3.300 3.300 0.000 peak 13015 weight 0.10000E+01 volume 0.20120E+01 ppm1 1.239 ppm2 4.255 ASSI ( (segid " " and resid "77 " and name "HA ") )( (segid " " and resid "77 " and name "HG23") OR (segid " " and resid "77 " and name "HG22") OR (segid " " and resid "77 " and name "HG21") ) 5.000 5.000 0.000 peak 5750 weight 0.10000E+01 volume 0.14200E+01 ppm1 3.776 ppm2 1.231 ASSI ( (segid " " and resid "77 " and name "HB ") )( (segid " " and resid "77 " and name "HG23") OR (segid " " and resid "77 " and name "HG22") OR (segid " " and resid "77 " and name "HG21") ) 3.300 3.300 0.000 peak 5751 weight 0.10000E+01 volume 0.24500E+01 ppm1 4.252 ppm2 1.231 ASSI ( (segid " " and resid "78 " and name "HB2 ") )( (segid " " and resid "79 " and name "HD2 ") OR (segid " " and resid "79 " and name "HD1 ") ) 5.000 5.000 0.000 peak 12946 weight 0.10000E+01 volume -0.52200E+00 ppm1 4.297 ppm2 4.299 ASSI ( (segid " " and resid "79 " and name "HG2 ") OR (segid " " and resid "79 " and name "HG1 ") )( (segid " " and resid "79 " and name "HD2 ") OR (segid " " and resid "79 " and name "HD1 ") ) 6.000 6.000 0.000 peak 12953 weight 0.10000E+01 volume -0.12900E+00 ppm1 2.012 ppm2 4.338 ASSI ( (segid " " and resid "80 " and name "HB ") )( (segid " " and resid "80 " and name "HG23") OR (segid " " and resid "80 " and name "HG22") OR (segid " " and resid "80 " and name "HG21") ) 3.300 3.300 0.000 peak 5753 weight 0.10000E+01 volume 0.24490E+01 ppm1 1.915 ppm2 0.835 ASSI ( (segid " " and resid "80 " and name "HA ") )( (segid " " and resid "80 " and name "HB ") ) 5.000 5.000 0.000 peak 5755 weight 0.10000E+01 volume 0.10910E+01 ppm1 3.691 ppm2 1.925 ASSI ( (segid " " and resid "80 " and name "HB ") )( (segid " " and resid "80 " and name "HA ") ) 5.000 5.000 0.000 peak 5754 weight 0.10000E+01 volume 0.62500E+00 ppm1 1.918 ppm2 3.692 ASSI ( (segid " " and resid "80 " and name "HA ") )( (segid " " and resid "83 " and name "HB3 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "83 " and name "HB1 ") ) 5.000 5.000 0.000 peak 5756 weight 0.10000E+01 volume 0.63700E+00 ppm1 3.694 ppm2 1.316 ASSI ( (segid " " and resid "82 " and name "HA ") )( (segid " " and resid "82 " and name "HB1 ") ) 6.000 6.000 0.000 peak 12939 weight 0.10000E+01 volume 0.26500E+00 ppm1 4.452 ppm2 2.275 ASSI ( (segid " " and resid "82 " and name "HA ") )( (segid " " and resid "82 " and name "HB2 ") ) 5.000 5.000 0.000 peak 12938 weight 0.10000E+01 volume 0.35600E+00 ppm1 4.452 ppm2 1.950 ASSI ( (segid " " and resid "83 " and name "HA ") )( (segid " " and resid "83 " and name "HB3 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "83 " and name "HB1 ") ) 2.700 2.700 0.000 peak 5758 weight 0.10000E+01 volume -0.56820E+01 ppm1 3.834 ppm2 1.332 ASSI ( (segid " " and resid "84 " and name "HA ") )( (segid " " and resid "84 " and name "HB3 ") OR (segid " " and resid "84 " and name "HB2 ") OR (segid " " and resid "84 " and name "HB1 ") ) 3.300 3.300 0.000 peak 5760 weight 0.10000E+01 volume -0.24330E+01 ppm1 3.991 ppm2 1.455 ASSI ( (segid " " and resid "89 " and name "HD23") OR (segid " " and resid "89 " and name "HD22") OR (segid " " and resid "89 " and name "HD21") )( (segid " " and resid "89 " and name "HG ") ) 5.000 5.000 0.000 peak 5766 weight 0.10000E+01 volume 0.76100E+00 ppm1 0.608 ppm2 1.301 ASSI ( (segid " " and resid "89 " and name "HD23") OR (segid " " and resid "89 " and name "HD22") OR (segid " " and resid "89 " and name "HD21") )( (segid " " and resid "89 " and name "HB2 ") ) 5.000 5.000 0.000 peak 5767 weight 0.10000E+01 volume -0.31300E+00 ppm1 0.609 ppm2 1.265 ASSI ( (segid " " and resid "89 " and name "HB1 ") )( (segid " " and resid "89 " and name "HB2 ") ) 5.000 5.000 0.000 peak 5769 weight 0.10000E+01 volume 0.63700E+00 ppm1 1.827 ppm2 1.229 ASSI ( (segid " " and resid "89 " and name "HD13") OR (segid " " and resid "89 " and name "HD12") OR (segid " " and resid "89 " and name "HD11") )( (segid " " and resid "89 " and name "HG ") ) 5.000 5.000 0.000 peak 5768 weight 0.10000E+01 volume 0.98500E+00 ppm1 0.826 ppm2 1.301 ASSI ( (segid " " and resid "89 " and name "HA ") )( (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") OR (segid " " and resid "92 " and name "HD11") ) 6.000 6.000 0.000 peak 5771 weight 0.10000E+01 volume -0.19700E+00 ppm1 3.727 ppm2 0.964 ASSI ( (segid " " and resid "89 " and name "HD13") OR (segid " " and resid "89 " and name "HD12") OR (segid " " and resid "89 " and name "HD11") )( (segid " " and resid "93 " and name "HE2 ") ) 5.000 5.000 0.000 peak 5772 weight 0.10000E+01 volume -0.31700E+00 ppm1 0.833 ppm2 2.585 ASSI ( (segid " " and resid "89 " and name "HD23") OR (segid " " and resid "89 " and name "HD22") OR (segid " " and resid "89 " and name "HD21") )( (segid " " and resid "124 " and name "HA ") ) 5.000 5.000 0.000 peak 5773 weight 0.10000E+01 volume 0.75300E+00 ppm1 0.605 ppm2 3.747 ASSI ( (segid " " and resid "91 " and name "HA ") )( (segid " " and resid "91 " and name "HG23") OR (segid " " and resid "91 " and name "HG22") OR (segid " " and resid "91 " and name "HG21") ) 3.300 3.300 0.000 peak 5531 weight 0.10000E+01 volume 0.26260E+01 ppm1 3.764 ppm2 1.134 ASSI ( (segid " " and resid "91 " and name "HG23") OR (segid " " and resid "91 " and name "HG22") OR (segid " " and resid "91 " and name "HG21") )( (segid " " and resid "91 " and name "HA ") ) 3.300 3.300 0.000 peak 5775 weight 0.10000E+01 volume 0.21920E+01 ppm1 1.132 ppm2 3.761 ASSI ( (segid " " and resid "91 " and name "HG23") OR (segid " " and resid "91 " and name "HG22") OR (segid " " and resid "91 " and name "HG21") )( (segid " " and resid "91 " and name "HB ") ) 5.000 5.000 0.000 peak 5776 weight 0.10000E+01 volume 0.14220E+01 ppm1 1.135 ppm2 4.215 ASSI ( (segid " " and resid "91 " and name "HB ") )( (segid " " and resid "91 " and name "HG23") OR (segid " " and resid "91 " and name "HG22") OR (segid " " and resid "91 " and name "HG21") ) 5.000 5.000 0.000 peak 5777 weight 0.10000E+01 volume 0.19680E+01 ppm1 4.209 ppm2 1.140 ASSI ( (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") OR (segid " " and resid "92 " and name "HD11") )( (segid " " and resid "92 " and name "HG ") ) 5.000 5.000 0.000 peak 5779 weight 0.10000E+01 volume 0.82400E+00 ppm1 0.955 ppm2 1.635 ASSI ( (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") OR (segid " " and resid "92 " and name "HD11") )( (segid " " and resid "92 " and name "HB2 ") ) 5.000 5.000 0.000 peak 5780 weight 0.10000E+01 volume -0.60200E+00 ppm1 0.955 ppm2 1.372 ASSI ( (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") OR (segid " " and resid "92 " and name "HD11") )( (segid " " and resid "92 " and name "HB1 ") ) 5.000 5.000 0.000 peak 5781 weight 0.10000E+01 volume -0.84100E+00 ppm1 0.959 ppm2 2.100 ASSI ( (segid " " and resid "92 " and name "HA ") )( (segid " " and resid "92 " and name "HB2 ") ) 6.000 6.000 0.000 peak 13009 weight 0.10000E+01 volume 0.28800E+00 ppm1 3.890 ppm2 1.367 ASSI ( (segid " " and resid "92 " and name "HG ") )( (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") OR (segid " " and resid "92 " and name "HD11") ) 5.000 5.000 0.000 peak 5778 weight 0.10000E+01 volume 0.11830E+01 ppm1 1.635 ppm2 0.952 ASSI ( (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") OR (segid " " and resid "92 " and name "HD11") )( (segid " " and resid "124 " and name "HA ") ) 5.000 5.000 0.000 peak 5783 weight 0.10000E+01 volume 0.34000E+00 ppm1 0.955 ppm2 3.762 ASSI ( (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") )( (segid " " and resid "92 " and name "HA ") ) 5.000 5.000 0.000 peak 5782 weight 0.10000E+01 volume -0.39000E+00 ppm1 0.937 ppm2 3.907 ASSI ( (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") OR (segid " " and resid "92 " and name "HD11") )( (segid " " and resid "127 " and name "HE2 ") OR (segid " " and resid "127 " and name "HE1 ") ) 6.000 6.000 0.000 peak 5787 weight 0.10000E+01 volume 0.18200E+00 ppm1 0.958 ppm2 7.211 ASSI ( (segid " " and resid "93 " and name "HG1 ") )( (segid " " and resid "93 " and name "HE1 ") ) 6.000 6.000 0.000 peak 13050 weight 0.10000E+01 volume -0.92000E-01 ppm1 1.089 ppm2 2.704 ASSI ( (segid " " and resid "93 " and name "HA ") )( (segid " " and resid "93 " and name "HG2 ") ) 5.000 5.000 0.000 peak 5793 weight 0.10000E+01 volume 0.37900E+00 ppm1 3.714 ppm2 0.637 ASSI ( (segid " " and resid "93 " and name "HA ") )( (segid " " and resid "93 " and name "HG1 ") ) 6.000 6.000 0.000 peak 5794 weight 0.10000E+01 volume 0.29600E+00 ppm1 3.714 ppm2 1.077 ASSI ( (segid " " and resid "93 " and name "HD2 ") OR (segid " " and resid "93 " and name "HD1 ") )( (segid " " and resid "93 " and name "HE1 ") ) 5.000 5.000 0.000 peak 13043 weight 0.10000E+01 volume -0.91800E+00 ppm1 1.453 ppm2 2.760 ASSI ( (segid " " and resid "93 " and name "HD2 ") OR (segid " " and resid "93 " and name "HD1 ") )( (segid " " and resid "93 " and name "HE2 ") ) 5.000 5.000 0.000 peak 13044 weight 0.10000E+01 volume -0.12240E+01 ppm1 1.453 ppm2 2.577 ASSI ( (segid " " and resid "93 " and name "HD2 ") OR (segid " " and resid "93 " and name "HD1 ") )( (segid " " and resid "93 " and name "HG1 ") ) 5.000 5.000 0.000 peak 5791 weight 0.10000E+01 volume 0.78400E+00 ppm1 1.446 ppm2 1.080 ASSI ( (segid " " and resid "93 " and name "HD2 ") OR (segid " " and resid "93 " and name "HD1 ") )( (segid " " and resid "93 " and name "HG2 ") ) 5.000 5.000 0.000 peak 5792 weight 0.10000E+01 volume 0.65600E+00 ppm1 1.454 ppm2 0.655 ASSI ( (segid " " and resid "93 " and name "HE2 ") OR (segid " " and resid "93 " and name "HE1 ") )( (segid " " and resid "93 " and name "HD2 ") OR (segid " " and resid "93 " and name "HD1 ") ) 5.000 5.000 0.000 peak 13045 weight 0.10000E+01 volume -0.62700E+00 ppm1 2.739 ppm2 1.461 ASSI ( (segid " " and resid "93 " and name "HE2 ") )( (segid " " and resid "93 " and name "HD2 ") OR (segid " " and resid "93 " and name "HD1 ") ) 5.000 5.000 0.000 peak 13046 weight 0.10000E+01 volume -0.12190E+01 ppm1 2.591 ppm2 1.461 ASSI ( (segid " " and resid "93 " and name "HG1 ") )( (segid " " and resid "93 " and name "HD2 ") OR (segid " " and resid "93 " and name "HD1 ") ) 5.000 5.000 0.000 peak 13052 weight 0.10000E+01 volume 0.63500E+00 ppm1 1.085 ppm2 1.455 ASSI ( (segid " " and resid "93 " and name "HG2 ") )( (segid " " and resid "93 " and name "HD2 ") OR (segid " " and resid "93 " and name "HD1 ") ) 5.000 5.000 0.000 peak 13051 weight 0.10000E+01 volume 0.35700E+00 ppm1 0.631 ppm2 1.455 ASSI ( (segid " " and resid "94 " and name "HG13") OR (segid " " and resid "94 " and name "HG12") OR (segid " " and resid "94 " and name "HG11") )( (segid " " and resid "94 " and name "HB ") ) 5.000 5.000 0.000 peak 5801 weight 0.10000E+01 volume 0.13300E+01 ppm1 1.194 ppm2 2.271 ASSI ( (segid " " and resid "94 " and name "HB ") )( (segid " " and resid "94 " and name "HG13") OR (segid " " and resid "94 " and name "HG12") OR (segid " " and resid "94 " and name "HG11") ) 3.300 3.300 0.000 peak 13025 weight 0.10000E+01 volume 0.23220E+01 ppm1 2.271 ppm2 1.193 ASSI ( (segid " " and resid "94 " and name "HA ") )( (segid " " and resid "94 " and name "HB ") ) 5.000 5.000 0.000 peak 5804 weight 0.10000E+01 volume 0.65500E+00 ppm1 4.043 ppm2 2.274 ASSI ( (segid " " and resid "94 " and name "HA ") )( (segid " " and resid "94 " and name "HG23") OR (segid " " and resid "94 " and name "HG22") OR (segid " " and resid "94 " and name "HG21") ) 5.000 5.000 0.000 peak 12928 weight 0.10000E+01 volume 0.14870E+01 ppm1 4.046 ppm2 0.964 ASSI ( (segid " " and resid "94 " and name "HA ") )( (segid " " and resid "94 " and name "HG13") OR (segid " " and resid "94 " and name "HG12") OR (segid " " and resid "94 " and name "HG11") ) 5.000 5.000 0.000 peak 5805 weight 0.10000E+01 volume 0.18890E+01 ppm1 4.040 ppm2 1.195 ASSI ( (segid " " and resid "94 " and name "HG23") OR (segid " " and resid "94 " and name "HG22") OR (segid " " and resid "94 " and name "HG21") )( (segid " " and resid "94 " and name "HA ") ) 5.000 5.000 0.000 peak 5800 weight 0.10000E+01 volume 0.13430E+01 ppm1 0.974 ppm2 4.048 ASSI ( (segid " " and resid "94 " and name "HG13") OR (segid " " and resid "94 " and name "HG12") OR (segid " " and resid "94 " and name "HG11") )( (segid " " and resid "94 " and name "HA ") ) 5.000 5.000 0.000 peak 5802 weight 0.10000E+01 volume 0.15790E+01 ppm1 1.199 ppm2 4.043 ASSI ( (segid " " and resid "94 " and name "HB ") )( (segid " " and resid "94 " and name "HA ") ) 5.000 5.000 0.000 peak 5803 weight 0.10000E+01 volume 0.52900E+00 ppm1 2.271 ppm2 4.048 ASSI ( (segid " " and resid "94 " and name "HA ") )( (segid " " and resid "97 " and name "HB2 ") ) 5.000 5.000 0.000 peak 12930 weight 0.10000E+01 volume 0.41400E+00 ppm1 4.046 ppm2 2.028 ASSI ( (segid " " and resid "96 " and name "HG23") OR (segid " " and resid "96 " and name "HG22") OR (segid " " and resid "96 " and name "HG21") )( (segid " " and resid "96 " and name "HB ") ) 5.000 5.000 0.000 peak 5810 weight 0.10000E+01 volume 0.16100E+01 ppm1 1.128 ppm2 2.326 ASSI ( (segid " " and resid "96 " and name "HG13") OR (segid " " and resid "96 " and name "HG12") OR (segid " " and resid "96 " and name "HG11") )( (segid " " and resid "96 " and name "HA ") ) 3.300 3.300 0.000 peak 5807 weight 0.10000E+01 volume 0.23840E+01 ppm1 1.124 ppm2 3.764 ASSI ( (segid " " and resid "96 " and name "HG23") OR (segid " " and resid "96 " and name "HG22") OR (segid " " and resid "96 " and name "HG21") )( (segid " " and resid "96 " and name "HA ") ) 3.300 3.300 0.000 peak 5809 weight 0.10000E+01 volume 0.25010E+01 ppm1 1.130 ppm2 3.761 ASSI ( (segid " " and resid "96 " and name "HB ") )( (segid " " and resid "96 " and name "HA ") ) 6.000 6.000 0.000 peak 5811 weight 0.10000E+01 volume 0.26200E+00 ppm1 2.323 ppm2 3.772 ASSI ( (segid " " and resid "96 " and name "HA ") )( (segid " " and resid "96 " and name "HG23") OR (segid " " and resid "96 " and name "HG22") OR (segid " " and resid "96 " and name "HG21") ) 3.300 3.300 0.000 peak 12984 weight 0.10000E+01 volume 0.28840E+01 ppm1 3.765 ppm2 1.129 ASSI ( (segid " " and resid "96 " and name "HG23") OR (segid " " and resid "96 " and name "HG22") OR (segid " " and resid "96 " and name "HG21") )( (segid " " and resid "96 " and name "HB ") ) 5.000 5.000 0.000 peak 5808 weight 0.10000E+01 volume 0.19520E+01 ppm1 1.124 ppm2 2.332 ASSI ( (segid " " and resid "97 " and name "HB2 ") )( (segid " " and resid "97 " and name "HA ") ) 5.000 5.000 0.000 peak 5813 weight 0.10000E+01 volume -0.74500E+00 ppm1 2.021 ppm2 4.099 ASSI ( (segid " " and resid "100 " and name "HB3 ") OR (segid " " and resid "100 " and name "HB2 ") OR (segid " " and resid "100 " and name "HB1 ") )( (segid " " and resid "100 " and name "HA ") ) 5.000 5.000 0.000 peak 5818 weight 0.10000E+01 volume -0.17290E+01 ppm1 1.133 ppm2 4.224 ASSI ( (segid " " and resid "100 " and name "HA ") )( (segid " " and resid "100 " and name "HB3 ") OR (segid " " and resid "100 " and name "HB2 ") OR (segid " " and resid "100 " and name "HB1 ") ) 3.300 3.300 0.000 peak 5819 weight 0.10000E+01 volume -0.25030E+01 ppm1 4.232 ppm2 1.119 ASSI ( (segid " " and resid "102 " and name "HB ") )( (segid " " and resid "102 " and name "HG23") OR (segid " " and resid "102 " and name "HG22") OR (segid " " and resid "102 " and name "HG21") ) 5.000 5.000 0.000 peak 5822 weight 0.10000E+01 volume 0.15660E+01 ppm1 2.211 ppm2 0.861 ASSI ( (segid " " and resid "102 " and name "HG13") OR (segid " " and resid "102 " and name "HG12") OR (segid " " and resid "102 " and name "HG11") )( (segid " " and resid "131 " and name "HB2 ") ) 5.000 5.000 0.000 peak 5825 weight 0.10000E+01 volume 0.61200E+00 ppm1 0.864 ppm2 1.490 ASSI ( (segid " " and resid "102 " and name "HA ") )( (segid " " and resid "102 " and name "HB ") ) 5.000 5.000 0.000 peak 5823 weight 0.10000E+01 volume 0.10810E+01 ppm1 3.895 ppm2 2.203 ASSI ( (segid " " and resid "105 " and name "HA ") )( (segid " " and resid "111 " and name "HD23") OR (segid " " and resid "111 " and name "HD22") OR (segid " " and resid "111 " and name "HD21") ) 6.000 6.000 0.000 peak 5838 weight 0.10000E+01 volume -0.10300E+00 ppm1 4.929 ppm2 0.974 ASSI ( (segid " " and resid "105 " and name "HA ") )( (segid " " and resid "105 " and name "HD13") OR (segid " " and resid "105 " and name "HD12") OR (segid " " and resid "105 " and name "HD11") ) 6.000 6.000 0.000 peak 5834 weight 0.10000E+01 volume -0.19700E+00 ppm1 4.931 ppm2 0.848 ASSI ( (segid " " and resid "105 " and name "HB1 ") )( (segid " " and resid "105 " and name "HD13") OR (segid " " and resid "105 " and name "HD12") OR (segid " " and resid "105 " and name "HD11") ) 5.000 5.000 0.000 peak 5832 weight 0.10000E+01 volume -0.84600E+00 ppm1 1.822 ppm2 0.851 ASSI ( (segid " " and resid "105 " and name "HD23") OR (segid " " and resid "105 " and name "HD22") OR (segid " " and resid "105 " and name "HD21") )( (segid " " and resid "105 " and name "HD13") OR (segid " " and resid "105 " and name "HD12") OR (segid " " and resid "105 " and name "HD11") ) 3.300 3.300 0.000 peak 5830 weight 0.10000E+01 volume 0.26090E+01 ppm1 0.399 ppm2 0.836 ASSI ( (segid " " and resid "108 " and name "HG23") OR (segid " " and resid "108 " and name "HG22") OR (segid " " and resid "108 " and name "HG21") )( (segid " " and resid "108 " and name "HA ") ) 5.000 5.000 0.000 peak 5842 weight 0.10000E+01 volume 0.55100E+00 ppm1 1.153 ppm2 4.627 ASSI ( (segid " " and resid "108 " and name "HG23") OR (segid " " and resid "108 " and name "HG22") OR (segid " " and resid "108 " and name "HG21") )( (segid " " and resid "108 " and name "HB ") ) 5.000 5.000 0.000 peak 5841 weight 0.10000E+01 volume 0.17700E+01 ppm1 1.153 ppm2 4.559 ASSI ( (segid " " and resid "108 " and name "HA ") )( (segid " " and resid "139 " and name "HB3 ") OR (segid " " and resid "139 " and name "HB2 ") OR (segid " " and resid "139 " and name "HB1 ") ) 5.000 5.000 0.000 peak 5845 weight 0.10000E+01 volume 0.11350E+01 ppm1 4.619 ppm2 1.404 ASSI ( (segid " " and resid "108 " and name "HA ") )( (segid " " and resid "108 " and name "HG23") OR (segid " " and resid "108 " and name "HG22") OR (segid " " and resid "108 " and name "HG21") ) 3.300 3.300 0.000 peak 5844 weight 0.10000E+01 volume 0.22320E+01 ppm1 4.617 ppm2 1.154 ASSI ( (segid " " and resid "112 " and name "HG1 ") )( (segid " " and resid "112 " and name "HD2 ") ) 6.000 6.000 0.000 peak 12976 weight 0.10000E+01 volume -0.60000E-01 ppm1 1.811 ppm2 3.924 ASSI ( (segid " " and resid "112 " and name "HA ") )( (segid " " and resid "84 " and name "HB3 ") OR (segid " " and resid "84 " and name "HB2 ") OR (segid " " and resid "84 " and name "HB1 ") ) 5.000 5.000 0.000 peak 12958 weight 0.10000E+01 volume 0.36300E+00 ppm1 4.143 ppm2 1.461 ASSI ( (segid " " and resid "112 " and name "HA ") )( (segid " " and resid "115 " and name "HD13") OR (segid " " and resid "115 " and name "HD12") OR (segid " " and resid "115 " and name "HD11") ) 6.000 6.000 0.000 peak 12960 weight 0.10000E+01 volume 0.25800E+00 ppm1 4.143 ppm2 1.216 ASSI ( (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD12") OR (segid " " and resid "113 " and name "HD11") )( (segid " " and resid "128 " and name "HD13") OR (segid " " and resid "128 " and name "HD12") OR (segid " " and resid "128 " and name "HD11") ) 5.000 5.000 0.000 peak 5848 weight 0.10000E+01 volume 0.70900E+00 ppm1 0.738 ppm2 0.699 ASSI ( (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD12") OR (segid " " and resid "113 " and name "HD11") )( (segid " " and resid "113 " and name "HB ") ) 5.000 5.000 0.000 peak 5851 weight 0.10000E+01 volume -0.43200E+00 ppm1 0.742 ppm2 1.747 ASSI ( (segid " " and resid "113 " and name "HG11") )( (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD12") OR (segid " " and resid "113 " and name "HD11") ) 6.000 6.000 0.000 peak 5853 weight 0.10000E+01 volume 0.27000E+00 ppm1 1.459 ppm2 0.749 ASSI ( (segid " " and resid "113 " and name "HA ") )( (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB1 ") OR (segid " " and resid "84 " and name "HB1 ") ) 5.000 5.000 0.000 peak 12957 weight 0.10000E+01 volume 0.50100E+00 ppm1 3.813 ppm2 1.481 ASSI ( (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD12") OR (segid " " and resid "113 " and name "HD11") )( (segid " " and resid "134 " and name "HA ") OR (segid " " and resid "128 " and name "HA ") ) 6.000 6.000 0.000 peak 5859 weight 0.10000E+01 volume -0.16100E+00 ppm1 0.742 ppm2 3.845 ASSI ( (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD12") OR (segid " " and resid "113 " and name "HD11") )( (segid " " and resid "129 " and name "HA ") ) 5.000 5.000 0.000 peak 5860 weight 0.10000E+01 volume -0.93500E+00 ppm1 0.742 ppm2 3.777 ASSI ( (segid " " and resid "113 " and name "HG23") OR (segid " " and resid "113 " and name "HG22") OR (segid " " and resid "113 " and name "HG21") )( (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") ) 5.000 5.000 0.000 peak 12974 weight 0.10000E+01 volume 0.70900E+00 ppm1 0.749 ppm2 1.190 ASSI ( (segid " " and resid "114 " and name "HA ") )( (segid " " and resid "117 " and name "HD13") OR (segid " " and resid "117 " and name "HD12") OR (segid " " and resid "117 " and name "HD11") ) 5.000 5.000 0.000 peak 5863 weight 0.10000E+01 volume 0.10290E+01 ppm1 3.983 ppm2 0.891 ASSI ( (segid " " and resid "115 " and name "HD23") OR (segid " " and resid "115 " and name "HD22") OR (segid " " and resid "115 " and name "HD21") )( (segid " " and resid "115 " and name "HG ") ) 5.000 5.000 0.000 peak 13021 weight 0.10000E+01 volume 0.15860E+01 ppm1 0.961 ppm2 2.022 ASSI ( (segid " " and resid "115 " and name "HD13") OR (segid " " and resid "115 " and name "HD12") OR (segid " " and resid "115 " and name "HD11") )( (segid " " and resid "115 " and name "HG ") ) 5.000 5.000 0.000 peak 12961 weight 0.10000E+01 volume 0.13960E+01 ppm1 1.213 ppm2 2.020 ASSI ( (segid " " and resid "115 " and name "HD23") OR (segid " " and resid "115 " and name "HD22") OR (segid " " and resid "115 " and name "HD21") )( (segid " " and resid "115 " and name "HB1 ") ) 5.000 5.000 0.000 peak 12891 weight 0.10000E+01 volume -0.54400E+00 ppm1 0.968 ppm2 2.195 ASSI ( (segid " " and resid "115 " and name "HA ") )( (segid " " and resid "118 " and name "HB2 ") OR (segid " " and resid "118 " and name "HB1 ") ) 5.000 5.000 0.000 peak 12895 weight 0.10000E+01 volume -0.42200E+00 ppm1 4.062 ppm2 2.056 ASSI ( (segid " " and resid "115 " and name "HA ") )( (segid " " and resid "115 " and name "HD23") OR (segid " " and resid "115 " and name "HD22") OR (segid " " and resid "115 " and name "HD21") ) 3.300 3.300 0.000 peak 12894 weight 0.10000E+01 volume -0.20460E+01 ppm1 4.062 ppm2 0.968 ASSI ( (segid " " and resid "115 " and name "HB1 ") )( (segid " " and resid "115 " and name "HD23") OR (segid " " and resid "115 " and name "HD22") OR (segid " " and resid "115 " and name "HD21") ) 5.000 5.000 0.000 peak 12890 weight 0.10000E+01 volume -0.44600E+00 ppm1 2.213 ppm2 0.961 ASSI ( (segid " " and resid "115 " and name "HG ") )( (segid " " and resid "115 " and name "HD23") OR (segid " " and resid "115 " and name "HD22") OR (segid " " and resid "115 " and name "HD21") ) 5.000 5.000 0.000 peak 12970 weight 0.10000E+01 volume 0.16440E+01 ppm1 2.027 ppm2 0.943 ASSI ( (segid " " and resid "115 " and name "HG ") )( (segid " " and resid "115 " and name "HD13") OR (segid " " and resid "115 " and name "HD12") OR (segid " " and resid "115 " and name "HD11") ) 5.000 5.000 0.000 peak 12971 weight 0.10000E+01 volume 0.67800E+00 ppm1 2.022 ppm2 1.228 ASSI ( (segid " " and resid "117 " and name "HA ") )( (segid " " and resid "117 " and name "HG23") OR (segid " " and resid "117 " and name "HG22") OR (segid " " and resid "117 " and name "HG21") ) 5.000 5.000 0.000 peak 5869 weight 0.10000E+01 volume 0.68600E+00 ppm1 3.515 ppm2 0.792 ASSI ( (segid " " and resid "117 " and name "HA ") )( (segid " " and resid "125 " and name "HG13") OR (segid " " and resid "125 " and name "HG12") OR (segid " " and resid "125 " and name "HG11") ) 6.000 6.000 0.000 peak 12989 weight 0.10000E+01 volume 0.21000E+00 ppm1 3.521 ppm2 0.992 ASSI ( (segid " " and resid "118 " and name "HG1 ") )( (segid " " and resid "118 " and name "HD1 ") ) 3.300 3.300 0.000 peak 12954 weight 0.10000E+01 volume -0.20370E+01 ppm1 1.936 ppm2 3.273 ASSI ( (segid " " and resid "118 " and name "HB2 ") OR (segid " " and resid "118 " and name "HB1 ") )( (segid " " and resid "118 " and name "HA ") ) 5.000 5.000 0.000 peak 5876 weight 0.10000E+01 volume 0.93700E+00 ppm1 2.073 ppm2 3.697 ASSI ( (segid " " and resid "118 " and name "HB2 ") OR (segid " " and resid "118 " and name "HB1 ") )( (segid " " and resid "118 " and name "HD2 ") OR (segid " " and resid "118 " and name "HD1 ") ) 5.000 5.000 0.000 peak 5877 weight 0.10000E+01 volume -0.13360E+01 ppm1 2.048 ppm2 3.268 ASSI ( (segid " " and resid "118 " and name "HA ") )( (segid " " and resid "118 " and name "HG1 ") ) 5.000 5.000 0.000 peak 13022 weight 0.10000E+01 volume 0.60200E+00 ppm1 3.689 ppm2 1.951 ASSI ( (segid " " and resid "118 " and name "HA ") )( (segid " " and resid "118 " and name "HB2 ") OR (segid " " and resid "118 " and name "HB1 ") ) 3.300 3.300 0.000 peak 13023 weight 0.10000E+01 volume 0.20230E+01 ppm1 3.682 ppm2 2.035 ASSI ( (segid " " and resid "118 " and name "HA ") )( (segid " " and resid "118 " and name "HG2 ") ) 5.000 5.000 0.000 peak 5878 weight 0.10000E+01 volume 0.49800E+00 ppm1 3.676 ppm2 1.648 ASSI ( (segid " " and resid "123 " and name "HB2 ") OR (segid " " and resid "123 " and name "HB1 ") )( (segid " " and resid "123 " and name "HA ") ) 5.000 5.000 0.000 peak 5879 weight 0.10000E+01 volume 0.19340E+01 ppm1 4.001 ppm2 4.336 ASSI ( (segid " " and resid "123 " and name "HB2 ") OR (segid " " and resid "123 " and name "HB1 ") )( (segid " " and resid "89 " and name "HD13") OR (segid " " and resid "89 " and name "HD12") OR (segid " " and resid "89 " and name "HD11") ) 5.000 5.000 0.000 peak 5880 weight 0.10000E+01 volume 0.99600E+00 ppm1 3.996 ppm2 0.837 ASSI ( (segid " " and resid "125 " and name "HG13") OR (segid " " and resid "125 " and name "HG12") OR (segid " " and resid "125 " and name "HG11") OR (segid " " and resid "14 " and name "HD21") )( (segid " " and resid "125 " and name "HA ") OR (segid " " and resid "26 " and name "HA ") ) 3.300 3.300 0.000 peak 5882 weight 0.10000E+01 volume 0.20730E+01 ppm1 0.975 ppm2 3.389 ASSI ( (segid " " and resid "125 " and name "HA ") )( (segid " " and resid "125 " and name "HG23") OR (segid " " and resid "125 " and name "HG22") OR (segid " " and resid "125 " and name "HG21") ) 3.300 3.300 0.000 peak 12982 weight 0.10000E+01 volume 0.20120E+01 ppm1 3.373 ppm2 0.869 ASSI ( (segid " " and resid "125 " and name "HG23") OR (segid " " and resid "125 " and name "HG22") OR (segid " " and resid "125 " and name "HG21") )( (segid " " and resid "125 " and name "HA ") ) 5.000 5.000 0.000 peak 5881 weight 0.10000E+01 volume 0.17010E+01 ppm1 0.885 ppm2 3.389 ASSI ( (segid " " and resid "127 " and name "HD2 ") OR (segid " " and resid "127 " and name "HD1 ") )( (segid " " and resid "127 " and name "HA ") ) 6.000 6.000 0.000 peak 5884 weight 0.10000E+01 volume 0.15700E+00 ppm1 7.138 ppm2 4.300 ASSI ( (segid " " and resid "127 " and name "HB2 ") )( (segid " " and resid "127 " and name "HD2 ") OR (segid " " and resid "127 " and name "HD1 ") ) 6.000 6.000 0.000 peak 5885 weight 0.10000E+01 volume -0.78000E-01 ppm1 2.967 ppm2 7.135 ASSI ( (segid " " and resid "127 " and name "HB1 ") )( (segid " " and resid "127 " and name "HD2 ") OR (segid " " and resid "127 " and name "HD1 ") ) 6.000 6.000 0.000 peak 5886 weight 0.10000E+01 volume -0.68000E-01 ppm1 3.428 ppm2 7.135 ASSI ( (segid " " and resid "127 " and name "HA ") )( (segid " " and resid "127 " and name "HB1 ") ) 5.000 5.000 0.000 peak 12845 weight 0.10000E+01 volume -0.47100E+00 ppm1 4.299 ppm2 3.421 ASSI ( (segid " " and resid "127 " and name "HA ") )( (segid " " and resid "127 " and name "HD2 ") OR (segid " " and resid "127 " and name "HD1 ") ) 6.000 6.000 0.000 peak 5887 weight 0.10000E+01 volume 0.23800E+00 ppm1 4.306 ppm2 7.143 ASSI ( (segid " " and resid "127 " and name "HD2 ") OR (segid " " and resid "127 " and name "HD1 ") )( (segid " " and resid "128 " and name "HD23") OR (segid " " and resid "128 " and name "HD22") OR (segid " " and resid "128 " and name "HD21") ) 6.000 6.000 0.000 peak 5890 weight 0.10000E+01 volume 0.18600E+00 ppm1 7.138 ppm2 0.907 ASSI ( (segid " " and resid "129 " and name "HA ") )( (segid " " and resid "129 " and name "HB3 ") OR (segid " " and resid "129 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB1 ") ) 5.000 5.000 0.000 peak 5895 weight 0.10000E+01 volume -0.13240E+01 ppm1 3.764 ppm2 1.132 ASSI ( (segid " " and resid "129 " and name "HB3 ") OR (segid " " and resid "129 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB1 ") )( (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "159 " and name "HG21") ) 5.000 5.000 0.000 peak 5896 weight 0.10000E+01 volume 0.70600E+00 ppm1 1.130 ppm2 0.897 ASSI ( (segid " " and resid "129 " and name "HB3 ") OR (segid " " and resid "129 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB1 ") )( (segid " " and resid "129 " and name "HA ") ) 5.000 5.000 0.000 peak 5894 weight 0.10000E+01 volume -0.15460E+01 ppm1 1.128 ppm2 3.768 ASSI ( (segid " " and resid "130 " and name "HB2 ") )( (segid " " and resid "130 " and name "HA ") ) 5.000 5.000 0.000 peak 5898 weight 0.10000E+01 volume 0.40800E+00 ppm1 1.889 ppm2 4.184 ASSI ( (segid " " and resid "130 " and name "HB1 ") )( (segid " " and resid "130 " and name "HA ") ) 5.000 5.000 0.000 peak 12877 weight 0.10000E+01 volume 0.66200E+00 ppm1 2.279 ppm2 4.166 ASSI ( (segid " " and resid "130 " and name "HB1 ") )( (segid " " and resid "130 " and name "HG1 ") ) 5.000 5.000 0.000 peak 12921 weight 0.10000E+01 volume 0.77300E+00 ppm1 2.281 ppm2 1.909 ASSI ( (segid " " and resid "131 " and name "HB1 ") )( (segid " " and resid "131 " and name "HA ") ) 5.000 5.000 0.000 peak 12880 weight 0.10000E+01 volume -0.41000E+00 ppm1 2.299 ppm2 4.528 ASSI ( (segid " " and resid "131 " and name "HB1 ") )( (segid " " and resid "131 " and name "HB2 ") ) 5.000 5.000 0.000 peak 13026 weight 0.10000E+01 volume 0.76900E+00 ppm1 2.271 ppm2 1.459 ASSI ( (segid " " and resid "131 " and name "HA ") )( (segid " " and resid "131 " and name "HB1 ") ) 5.000 5.000 0.000 peak 12883 weight 0.10000E+01 volume -0.88400E+00 ppm1 4.548 ppm2 2.285 ASSI ( (segid " " and resid "134 " and name "HD23") OR (segid " " and resid "134 " and name "HD22") OR (segid " " and resid "134 " and name "HD21") )( (segid " " and resid "134 " and name "HB2 ") OR (segid " " and resid "134 " and name "HB1 ") ) 5.000 5.000 0.000 peak 5903 weight 0.10000E+01 volume -0.50700E+00 ppm1 0.691 ppm2 1.631 ASSI ( (segid " " and resid "134 " and name "HD23") OR (segid " " and resid "134 " and name "HD22") OR (segid " " and resid "134 " and name "HD21") )( (segid " " and resid "134 " and name "HA ") ) 5.000 5.000 0.000 peak 5904 weight 0.10000E+01 volume -0.94800E+00 ppm1 0.695 ppm2 3.876 ASSI ( (segid " " and resid "137 " and name "HA ") )( (segid " " and resid "137 " and name "HG2 ") ) 5.000 5.000 0.000 peak 12887 weight 0.10000E+01 volume -0.38600E+00 ppm1 4.223 ppm2 1.443 ASSI ( (segid " " and resid "139 " and name "HB3 ") OR (segid " " and resid "139 " and name "HB2 ") OR (segid " " and resid "139 " and name "HB1 ") )( (segid " " and resid "139 " and name "HA ") ) 2.700 2.700 0.000 peak 5910 weight 0.10000E+01 volume -0.65550E+01 ppm1 1.399 ppm2 4.137 ASSI ( (segid " " and resid "139 " and name "HA ") )( (segid " " and resid "139 " and name "HB3 ") OR (segid " " and resid "139 " and name "HB2 ") OR (segid " " and resid "139 " and name "HB1 ") ) 2.700 2.700 0.000 peak 5911 weight 0.10000E+01 volume -0.11219E+02 ppm1 4.122 ppm2 1.407 ASSI ( (segid " " and resid "140 " and name "HA ") )( (segid " " and resid "140 " and name "HB2 ") ) 3.300 3.300 0.000 peak 12940 weight 0.10000E+01 volume -0.28210E+01 ppm1 4.504 ppm2 3.915 ASSI ( (segid " " and resid "140 " and name "HB1 ") )( (segid " " and resid "140 " and name "HA ") ) 5.000 5.000 0.000 peak 5912 weight 0.10000E+01 volume -0.55400E+00 ppm1 4.107 ppm2 4.525 ASSI ( (segid " " and resid "142 " and name "HD22") OR (segid " " and resid "142 " and name "HD21") )( (segid " " and resid "142 " and name "HA ") ) 5.000 5.000 0.000 peak 5914 weight 0.10000E+01 volume -0.99600E+00 ppm1 0.750 ppm2 4.983 ASSI ( (segid " " and resid "142 " and name "HD13") OR (segid " " and resid "142 " and name "HD12") OR (segid " " and resid "142 " and name "HD11") )( (segid " " and resid "142 " and name "HA ") ) 6.000 6.000 0.000 peak 5917 weight 0.10000E+01 volume -0.13300E+00 ppm1 0.893 ppm2 5.006 ASSI ( (segid " " and resid "142 " and name "HD23") OR (segid " " and resid "142 " and name "HD22") OR (segid " " and resid "142 " and name "HD21") )( (segid " " and resid "142 " and name "HG ") ) 5.000 5.000 0.000 peak 5913 weight 0.10000E+01 volume 0.14200E+01 ppm1 0.747 ppm2 1.507 ASSI ( (segid " " and resid "142 " and name "HB1 ") )( (segid " " and resid "142 " and name "HD23") OR (segid " " and resid "142 " and name "HD22") OR (segid " " and resid "142 " and name "HD21") ) 5.000 5.000 0.000 peak 5918 weight 0.10000E+01 volume -0.64600E+00 ppm1 2.046 ppm2 0.775 ASSI ( (segid " " and resid "142 " and name "HB2 ") )( (segid " " and resid "142 " and name "HD23") OR (segid " " and resid "142 " and name "HD22") OR (segid " " and resid "142 " and name "HD21") ) 5.000 5.000 0.000 peak 5919 weight 0.10000E+01 volume -0.11720E+01 ppm1 1.337 ppm2 0.754 ASSI ( (segid " " and resid "142 " and name "HB2 ") )( (segid " " and resid "142 " and name "HD13") OR (segid " " and resid "142 " and name "HD12") OR (segid " " and resid "142 " and name "HD11") ) 5.000 5.000 0.000 peak 5920 weight 0.10000E+01 volume -0.71700E+00 ppm1 1.337 ppm2 0.891 ASSI ( (segid " " and resid "142 " and name "HG ") )( (segid " " and resid "142 " and name "HD13") OR (segid " " and resid "142 " and name "HD12") OR (segid " " and resid "142 " and name "HD11") ) 5.000 5.000 0.000 peak 5915 weight 0.10000E+01 volume 0.19640E+01 ppm1 1.508 ppm2 0.901 ASSI ( (segid " " and resid "142 " and name "HG ") )( (segid " " and resid "142 " and name "HD23") OR (segid " " and resid "142 " and name "HD22") OR (segid " " and resid "142 " and name "HD21") ) 5.000 5.000 0.000 peak 5916 weight 0.10000E+01 volume 0.13770E+01 ppm1 1.509 ppm2 0.775 ASSI ( (segid " " and resid "143 " and name "HG23") OR (segid " " and resid "143 " and name "HG22") OR (segid " " and resid "143 " and name "HG21") )( (segid " " and resid "143 " and name "HB ") ) 5.000 5.000 0.000 peak 13016 weight 0.10000E+01 volume 0.85600E+00 ppm1 1.256 ppm2 4.701 ASSI ( (segid " " and resid "143 " and name "HA ") )( (segid " " and resid "143 " and name "HG23") OR (segid " " and resid "143 " and name "HG22") OR (segid " " and resid "143 " and name "HG21") ) 5.000 5.000 0.000 peak 5922 weight 0.10000E+01 volume 0.71900E+00 ppm1 5.384 ppm2 1.261 ASSI ( (segid " " and resid "143 " and name "HB ") )( (segid " " and resid "143 " and name "HG23") OR (segid " " and resid "143 " and name "HG22") OR (segid " " and resid "143 " and name "HG21") ) 5.000 5.000 0.000 peak 13017 weight 0.10000E+01 volume 0.16480E+01 ppm1 4.701 ppm2 1.255 ASSI ( (segid " " and resid "144 " and name "HA ") )( (segid " " and resid "117 " and name "HD13") OR (segid " " and resid "117 " and name "HD12") OR (segid " " and resid "117 " and name "HD11") ) 5.000 5.000 0.000 peak 5923 weight 0.10000E+01 volume 0.49200E+00 ppm1 3.689 ppm2 0.897 ASSI ( (segid " " and resid "145 " and name "HA ") )( (segid " " and resid "160 " and name "HD13") OR (segid " " and resid "160 " and name "HD12") OR (segid " " and resid "160 " and name "HD11") ) 5.000 5.000 0.000 peak 5924 weight 0.10000E+01 volume -0.16320E+01 ppm1 3.918 ppm2 0.679 ASSI ( (segid " " and resid "145 " and name "HD13") OR (segid " " and resid "145 " and name "HD12") OR (segid " " and resid "145 " and name "HD11") )( (segid " " and resid "145 " and name "HB2 ") ) 5.000 5.000 0.000 peak 12904 weight 0.10000E+01 volume -0.14400E+01 ppm1 0.952 ppm2 1.397 ASSI ( (segid " " and resid "145 " and name "HG ") )( (segid " " and resid "145 " and name "HA ") ) 5.000 5.000 0.000 peak 5925 weight 0.10000E+01 volume -0.36400E+00 ppm1 1.545 ppm2 3.976 ASSI ( (segid " " and resid "145 " and name "HB2 ") )( (segid " " and resid "145 " and name "HG ") ) 5.000 5.000 0.000 peak 13002 weight 0.10000E+01 volume -0.98100E+00 ppm1 1.393 ppm2 1.529 ASSI ( (segid " " and resid "145 " and name "HA ") )( (segid " " and resid "145 " and name "HB2 ") ) 5.000 5.000 0.000 peak 13007 weight 0.10000E+01 volume 0.47900E+00 ppm1 3.931 ppm2 1.405 ASSI ( (segid " " and resid "145 " and name "HD13") OR (segid " " and resid "145 " and name "HD12") OR (segid " " and resid "145 " and name "HD11") )( (segid " " and resid "145 " and name "HB1 ") ) 5.000 5.000 0.000 peak 12903 weight 0.10000E+01 volume -0.12150E+01 ppm1 0.952 ppm2 1.753 ASSI ( (segid " " and resid "145 " and name "HB2 ") )( (segid " " and resid "145 " and name "HD13") OR (segid " " and resid "145 " and name "HD12") OR (segid " " and resid "145 " and name "HD11") ) 5.000 5.000 0.000 peak 5926 weight 0.10000E+01 volume -0.18670E+01 ppm1 1.398 ppm2 0.947 ASSI ( (segid " " and resid "145 " and name "HA ") )( (segid " " and resid "145 " and name "HG ") ) 5.000 5.000 0.000 peak 12990 weight 0.10000E+01 volume -0.60100E+00 ppm1 3.917 ppm2 1.551 ASSI ( (segid " " and resid "147 " and name "HB2 ") )( (segid " " and resid "147 " and name "HD13") OR (segid " " and resid "147 " and name "HD12") OR (segid " " and resid "147 " and name "HD11") ) 5.000 5.000 0.000 peak 5932 weight 0.10000E+01 volume -0.56600E+00 ppm1 1.555 ppm2 1.193 ASSI ( (segid " " and resid "148 " and name "HB3 ") OR (segid " " and resid "148 " and name "HB2 ") OR (segid " " and resid "148 " and name "HB1 ") )( (segid " " and resid "148 " and name "HA ") ) 3.300 3.300 0.000 peak 5938 weight 0.10000E+01 volume -0.25350E+01 ppm1 1.440 ppm2 3.751 ASSI ( (segid " " and resid "149 " and name "HG2 ") )( (segid " " and resid "149 " and name "HD2 ") OR (segid " " and resid "149 " and name "HD1 ") ) 3.300 3.300 0.000 peak 5946 weight 0.10000E+01 volume -0.21410E+01 ppm1 1.593 ppm2 3.245 ASSI ( (segid " " and resid "149 " and name "HD2 ") OR (segid " " and resid "149 " and name "HD1 ") )( (segid " " and resid "149 " and name "HG1 ") ) 3.300 3.300 0.000 peak 12865 weight 0.10000E+01 volume -0.34100E+01 ppm1 3.247 ppm2 1.784 ASSI ( (segid " " and resid "149 " and name "HD2 ") OR (segid " " and resid "149 " and name "HD1 ") )( (segid " " and resid "149 " and name "HG2 ") ) 5.000 5.000 0.000 peak 12866 weight 0.10000E+01 volume -0.19160E+01 ppm1 3.247 ppm2 1.594 ASSI ( (segid " " and resid "149 " and name "HD2 ") OR (segid " " and resid "149 " and name "HD1 ") )( (segid " " and resid "149 " and name "HB1 ") ) 3.300 3.300 0.000 peak 5947 weight 0.10000E+01 volume -0.21660E+01 ppm1 3.263 ppm2 1.987 ASSI ( (segid " " and resid "149 " and name "HA ") )( (segid " " and resid "149 " and name "HB1 ") ) 5.000 5.000 0.000 peak 13013 weight 0.10000E+01 volume 0.52100E+00 ppm1 4.340 ppm2 1.975 ASSI ( (segid " " and resid "149 " and name "HA ") )( (segid " " and resid "149 " and name "HB2 ") ) 5.000 5.000 0.000 peak 13012 weight 0.10000E+01 volume 0.74300E+00 ppm1 4.340 ppm2 1.882 ASSI ( (segid " " and resid "151 " and name "HD1 ") )( (segid " " and resid "151 " and name "HG2 ") OR (segid " " and resid "151 " and name "HG1 ") ) 2.700 2.700 0.000 peak 5949 weight 0.10000E+01 volume -0.43120E+01 ppm1 3.287 ppm2 1.796 ASSI ( (segid " " and resid "151 " and name "HG2 ") )( (segid " " and resid "151 " and name "HA ") ) 5.000 5.000 0.000 peak 12816 weight 0.10000E+01 volume -0.54500E+00 ppm1 1.784 ppm2 4.296 ASSI ( (segid " " and resid "151 " and name "HA ") )( (segid " " and resid "151 " and name "HG2 ") OR (segid " " and resid "151 " and name "HG1 ") ) 5.000 5.000 0.000 peak 5950 weight 0.10000E+01 volume -0.13220E+01 ppm1 4.293 ppm2 1.820 ASSI ( (segid " " and resid "151 " and name "HD2 ") )( (segid " " and resid "151 " and name "HG2 ") OR (segid " " and resid "151 " and name "HG1 ") ) 5.000 5.000 0.000 peak 5948 weight 0.10000E+01 volume -0.12530E+01 ppm1 2.991 ppm2 1.796 ASSI ( (segid " " and resid "153 " and name "HB3 ") OR (segid " " and resid "153 " and name "HB2 ") OR (segid " " and resid "153 " and name "HB1 ") )( (segid " " and resid "156 " and name "HD13") OR (segid " " and resid "156 " and name "HD12") OR (segid " " and resid "156 " and name "HD11") ) 3.300 3.300 0.000 peak 5953 weight 0.10000E+01 volume 0.20910E+01 ppm1 1.361 ppm2 1.013 ASSI ( (segid " " and resid "155 " and name "HA ") )( (segid " " and resid "155 " and name "HB2 ") ) 5.000 5.000 0.000 peak 5956 weight 0.10000E+01 volume 0.17780E+01 ppm1 4.478 ppm2 2.869 ASSI ( (segid " " and resid "155 " and name "HB1 ") )( (segid " " and resid "155 " and name "HA ") ) 5.000 5.000 0.000 peak 5955 weight 0.10000E+01 volume 0.35200E+00 ppm1 2.940 ppm2 4.478 ASSI ( (segid " " and resid "156 " and name "HD23") OR (segid " " and resid "156 " and name "HD22") OR (segid " " and resid "156 " and name "HD21") )( (segid " " and resid "156 " and name "HA ") ) 5.000 5.000 0.000 peak 5958 weight 0.10000E+01 volume -0.17790E+01 ppm1 0.750 ppm2 4.164 ASSI ( (segid " " and resid "156 " and name "HD23") OR (segid " " and resid "156 " and name "HD22") OR (segid " " and resid "156 " and name "HD21") )( (segid " " and resid "156 " and name "HD13") OR (segid " " and resid "156 " and name "HD12") OR (segid " " and resid "156 " and name "HD11") ) 5.000 5.000 0.000 peak 5957 weight 0.10000E+01 volume 0.19370E+01 ppm1 0.735 ppm2 0.997 ASSI ( (segid " " and resid "156 " and name "HB2 ") )( (segid " " and resid "156 " and name "HD13") OR (segid " " and resid "156 " and name "HD12") OR (segid " " and resid "156 " and name "HD11") ) 5.000 5.000 0.000 peak 5961 weight 0.10000E+01 volume -0.46200E+00 ppm1 1.163 ppm2 1.000 ASSI ( (segid " " and resid "156 " and name "HA ") )( (segid " " and resid "156 " and name "HD23") OR (segid " " and resid "156 " and name "HD22") OR (segid " " and resid "156 " and name "HD21") ) 5.000 5.000 0.000 peak 5964 weight 0.10000E+01 volume -0.19010E+01 ppm1 4.166 ppm2 0.744 ASSI ( (segid " " and resid "157 " and name "HG2 ") OR (segid " " and resid "157 " and name "HG1 ") )( (segid " " and resid "157 " and name "HA ") ) 5.000 5.000 0.000 peak 5970 weight 0.10000E+01 volume 0.35500E+00 ppm1 2.339 ppm2 3.720 ASSI ( (segid " " and resid "157 " and name "HA ") )( (segid " " and resid "157 " and name "HG2 ") OR (segid " " and resid "157 " and name "HG1 ") ) 5.000 5.000 0.000 peak 5971 weight 0.10000E+01 volume 0.61300E+00 ppm1 3.719 ppm2 2.334 ASSI ( (segid " " and resid "157 " and name "HE3 ") OR (segid " " and resid "157 " and name "HE2 ") OR (segid " " and resid "157 " and name "HE1 ") )( (segid " " and resid "161 " and name "HA ") OR (segid " " and resid "150 " and name "HA ") OR (segid " " and resid "146 " and name "HA ") ) 5.000 5.000 0.000 peak 5972 weight 0.10000E+01 volume -0.61300E+00 ppm1 2.052 ppm2 4.005 ASSI ( (segid " " and resid "159 " and name "HD13") OR (segid " " and resid "159 " and name "HD12") OR (segid " " and resid "159 " and name "HD11") )( (segid " " and resid "126 " and name "HA ") ) 5.000 5.000 0.000 peak 5438 weight 0.10000E+01 volume 0.15460E+01 ppm1 0.912 ppm2 4.001 ASSI ( (segid " " and resid "159 " and name "HG11") )( (segid " " and resid "159 " and name "HG12") ) 5.000 5.000 0.000 peak 5982 weight 0.10000E+01 volume 0.80800E+00 ppm1 1.937 ppm2 1.156 ASSI ( (segid " " and resid "159 " and name "HB ") )( (segid " " and resid "159 " and name "HD13") OR (segid " " and resid "159 " and name "HD12") OR (segid " " and resid "159 " and name "HD11") ) 5.000 5.000 0.000 peak 5986 weight 0.10000E+01 volume -0.78300E+00 ppm1 1.877 ppm2 0.916 ASSI ( (segid " " and resid "159 " and name "HA ") )( (segid " " and resid "159 " and name "HD13") OR (segid " " and resid "159 " and name "HD12") OR (segid " " and resid "159 " and name "HD11") ) 5.000 5.000 0.000 peak 5991 weight 0.10000E+01 volume 0.54200E+00 ppm1 3.766 ppm2 0.911 ASSI ( (segid " " and resid "159 " and name "HA ") )( (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "159 " and name "HG21") ) 5.000 5.000 0.000 peak 5992 weight 0.10000E+01 volume 0.18930E+01 ppm1 3.763 ppm2 0.911 ASSI ( (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "159 " and name "HG21") )( (segid " " and resid "159 " and name "HA ") ) 5.000 5.000 0.000 peak 5979 weight 0.10000E+01 volume 0.18390E+01 ppm1 0.910 ppm2 3.764 ASSI ( (segid " " and resid "159 " and name "HG11") )( (segid " " and resid "159 " and name "HA ") ) 6.000 6.000 0.000 peak 5980 weight 0.10000E+01 volume 0.22500E+00 ppm1 1.941 ppm2 3.764 ASSI ( (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "159 " and name "HG21") )( (segid " " and resid "159 " and name "HB ") ) 5.000 5.000 0.000 peak 5978 weight 0.10000E+01 volume -0.19330E+01 ppm1 0.908 ppm2 1.872 ASSI ( (segid " " and resid "159 " and name "HG11") )( (segid " " and resid "159 " and name "HD13") OR (segid " " and resid "159 " and name "HD12") OR (segid " " and resid "159 " and name "HD11") ) 5.000 5.000 0.000 peak 5985 weight 0.10000E+01 volume 0.10510E+01 ppm1 1.941 ppm2 0.910 ASSI ( (segid " " and resid "159 " and name "HA ") )( (segid " " and resid "159 " and name "HG11") ) 5.000 5.000 0.000 peak 5989 weight 0.10000E+01 volume 0.30100E+00 ppm1 3.758 ppm2 1.941 ASSI ( (segid " " and resid "159 " and name "HB ") )( (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "159 " and name "HG21") ) 3.300 3.300 0.000 peak 5987 weight 0.10000E+01 volume -0.23470E+01 ppm1 1.877 ppm2 0.912 ASSI ( (segid " " and resid "159 " and name "HD13") OR (segid " " and resid "159 " and name "HD12") OR (segid " " and resid "159 " and name "HD11") )( (segid " " and resid "159 " and name "HG11") ) 5.000 5.000 0.000 peak 5974 weight 0.10000E+01 volume 0.16900E+01 ppm1 0.918 ppm2 1.951 ASSI ( (segid " " and resid "159 " and name "HG12") )( (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "159 " and name "HG21") ) 5.000 5.000 0.000 peak 5983 weight 0.10000E+01 volume 0.16690E+01 ppm1 1.158 ppm2 0.887 ASSI ( (segid " " and resid "160 " and name "HD22") OR (segid " " and resid "160 " and name "HD21") OR (segid " " and resid "29 " and name "HD23") OR (segid " " and resid "29 " and name "HD22") OR (segid " " and resid "29 " and name "HD21") )( (segid " " and resid "160 " and name "HA ") OR (segid " " and resid "29 " and name "HA ") ) 3.300 3.300 0.000 peak 5996 weight 0.10000E+01 volume -0.28850E+01 ppm1 0.757 ppm2 3.887 ASSI ( (segid " " and resid "160 " and name "HD13") OR (segid " " and resid "160 " and name "HD12") OR (segid " " and resid "160 " and name "HD11") )( (segid " " and resid "117 " and name "HD13") OR (segid " " and resid "117 " and name "HD12") OR (segid " " and resid "117 " and name "HD11") ) 5.000 5.000 0.000 peak 5999 weight 0.10000E+01 volume 0.12530E+01 ppm1 0.649 ppm2 0.891 ASSI ( (segid " " and resid "160 " and name "HD13") OR (segid " " and resid "160 " and name "HD12") OR (segid " " and resid "160 " and name "HD11") )( (segid " " and resid "160 " and name "HA ") OR (segid " " and resid "145 " and name "HA ") ) 5.000 5.000 0.000 peak 5998 weight 0.10000E+01 volume -0.16790E+01 ppm1 0.651 ppm2 3.919 ASSI ( (segid " " and resid "164 " and name "HB1 ") )( (segid " " and resid "164 " and name "HA ") ) 5.000 5.000 0.000 peak 13079 weight 0.10000E+01 volume 0.54400E+00 ppm1 2.306 ppm2 4.484 ASSI ( (segid " " and resid "164 " and name "HB2 ") )( (segid " " and resid "164 " and name "HA ") ) 6.000 6.000 0.000 peak 13080 weight 0.10000E+01 volume 0.21700E+00 ppm1 1.944 ppm2 4.484 ASSI ( (segid " " and resid "164 " and name "HA ") )( (segid " " and resid "164 " and name "HB2 ") ) 5.000 5.000 0.000 peak 6005 weight 0.10000E+01 volume 0.62400E+00 ppm1 4.504 ppm2 1.953 ASSI ( (segid " " and resid "164 " and name "HA ") )( (segid " " and resid "164 " and name "HB1 ") ) 5.000 5.000 0.000 peak 6004 weight 0.10000E+01 volume 0.81200E+00 ppm1 4.505 ppm2 2.298 ASSI ( (segid " " and resid "164 " and name "HE3 ") OR (segid " " and resid "164 " and name "HE2 ") OR (segid " " and resid "164 " and name "HE1 ") )( (segid " " and resid "166 " and name "HD13") OR (segid " " and resid "166 " and name "HD12") OR (segid " " and resid "166 " and name "HD11") ) 6.000 6.000 0.000 peak 6006 weight 0.10000E+01 volume 0.28500E+00 ppm1 1.973 ppm2 0.924 ASSI ( (segid " " and resid "164 " and name "HE3 ") OR (segid " " and resid "164 " and name "HE2 ") OR (segid " " and resid "164 " and name "HE1 ") )( (segid " " and resid "164 " and name "HB2 ") ) 5.000 5.000 0.000 peak 6003 weight 0.10000E+01 volume -0.57400E+00 ppm1 1.980 ppm2 1.966 ASSI ( (segid " " and resid "166 " and name "HG23") OR (segid " " and resid "166 " and name "HG22") OR (segid " " and resid "166 " and name "HG21") )( (segid " " and resid "166 " and name "HG11") ) 5.000 5.000 0.000 peak 12934 weight 0.10000E+01 volume 0.37900E+00 ppm1 0.997 ppm2 1.568 ASSI ( (segid " " and resid "166 " and name "HG23") OR (segid " " and resid "166 " and name "HG22") OR (segid " " and resid "166 " and name "HG21") )( (segid " " and resid "166 " and name "HB ") ) 3.300 3.300 0.000 peak 12935 weight 0.10000E+01 volume -0.22140E+01 ppm1 0.997 ppm2 1.905 ASSI ( (segid " " and resid "166 " and name "HG11") )( (segid " " and resid "166 " and name "HA ") ) 6.000 6.000 0.000 peak 6010 weight 0.10000E+01 volume -0.60000E-01 ppm1 1.550 ppm2 4.526 ASSI ( (segid " " and resid "166 " and name "HG12") )( (segid " " and resid "166 " and name "HD13") OR (segid " " and resid "166 " and name "HD12") OR (segid " " and resid "166 " and name "HD11") ) 5.000 5.000 0.000 peak 6012 weight 0.10000E+01 volume 0.16920E+01 ppm1 1.242 ppm2 0.930 ASSI ( (segid " " and resid "166 " and name "HG11") )( (segid " " and resid "166 " and name "HD13") OR (segid " " and resid "166 " and name "HD12") OR (segid " " and resid "166 " and name "HD11") ) 5.000 5.000 0.000 peak 6013 weight 0.10000E+01 volume 0.72300E+00 ppm1 1.580 ppm2 0.930 ASSI ( (segid " " and resid "166 " and name "HB ") )( (segid " " and resid "166 " and name "HA ") ) 6.000 6.000 0.000 peak 6014 weight 0.10000E+01 volume 0.13300E+00 ppm1 1.917 ppm2 4.526 ASSI ( (segid " " and resid "166 " and name "HD13") OR (segid " " and resid "166 " and name "HD12") OR (segid " " and resid "166 " and name "HD11") )( (segid " " and resid "166 " and name "HA ") ) 6.000 6.000 0.000 peak 6008 weight 0.10000E+01 volume -0.12900E+00 ppm1 0.913 ppm2 4.524 ASSI ( (segid " " and resid "166 " and name "HD13") OR (segid " " and resid "166 " and name "HD12") OR (segid " " and resid "166 " and name "HD11") )( (segid " " and resid "166 " and name "HG11") ) 5.000 5.000 0.000 peak 12858 weight 0.10000E+01 volume 0.11450E+01 ppm1 0.903 ppm2 1.549 ASSI ( (segid " " and resid "166 " and name "HG12") )( (segid " " and resid "166 " and name "HA ") ) 6.000 6.000 0.000 peak 6011 weight 0.10000E+01 volume -0.10900E+00 ppm1 1.213 ppm2 4.526 ASSI ( (segid " " and resid "166 " and name "HG23") OR (segid " " and resid "166 " and name "HG22") OR (segid " " and resid "166 " and name "HG21") )( (segid " " and resid "166 " and name "HA ") ) 5.000 5.000 0.000 peak 6009 weight 0.10000E+01 volume -0.42500E+00 ppm1 0.991 ppm2 4.526 ASSI ( (segid " " and resid "167 " and name "HB2 ") )( (segid " " and resid "167 " and name "HA ") ) 5.000 5.000 0.000 peak 12879 weight 0.10000E+01 volume 0.11370E+01 ppm1 1.988 ppm2 4.452 ASSI ( (segid " " and resid "167 " and name "HB1 ") )( (segid " " and resid "167 " and name "HA ") ) 5.000 5.000 0.000 peak 12878 weight 0.10000E+01 volume 0.12560E+01 ppm1 2.286 ppm2 4.452 ASSI ( (segid " " and resid "167 " and name "HA ") )( (segid " " and resid "167 " and name "HG2 ") ) 5.000 5.000 0.000 peak 6015 weight 0.10000E+01 volume 0.34000E+00 ppm1 4.460 ppm2 2.027 ASSI ( (segid " " and resid "167 " and name "HA ") )( (segid " " and resid "167 " and name "HB2 ") ) 5.000 5.000 0.000 peak 6016 weight 0.10000E+01 volume 0.71100E+00 ppm1 4.452 ppm2 1.971 ASSI ( (segid " " and resid "167 " and name "HA ") )( (segid " " and resid "167 " and name "HB1 ") ) 5.000 5.000 0.000 peak 6017 weight 0.10000E+01 volume 0.14280E+01 ppm1 4.453 ppm2 2.286 ASSI ( (segid " " and resid "99 " and name "HN ") OR (segid " " and resid "66 " and name "HN ") )( (segid " " and resid "102 " and name "HG23") OR (segid " " and resid "102 " and name "HG22") OR (segid " " and resid "102 " and name "HG21") OR (segid " " and resid "102 " and name "HG13") OR (segid " " and resid "102 " and name "HG12") OR (segid " " and resid "63 " and name "HD23") OR (segid " " and resid "63 " and name "HD22") OR (segid " " and resid "63 " and name "HD21") OR (segid " " and resid "63 " and name "HB2 ") OR (segid " " and resid "48 " and name "HD13") ) 6.000 6.000 0.000 peak 7883 weight 0.10000E+01 volume -0.15000E+00 ppm1 7.610 ppm2 0.843 ASSI ( (segid " " and resid "99 " and name "HN ") OR (segid " " and resid "66 " and name "HN ") )( (segid " " and resid "97 " and name "HB2 ") OR (segid " " and resid "65 " and name "HB2 ") ) 5.000 5.000 0.000 peak 7884 weight 0.10000E+01 volume -0.36100E+00 ppm1 7.610 ppm2 2.029 ASSI ( (segid " " and resid "162 " and name "HN ") OR (segid " " and resid "66 " and name "HN ") )( (segid " " and resid "161 " and name "HB2 ") OR (segid " " and resid "161 " and name "HB1 ") OR (segid " " and resid "65 " and name "HB1 ") ) 5.000 5.000 0.000 peak 7885 weight 0.10000E+01 volume -0.87300E+00 ppm1 7.581 ppm2 2.163 ASSI ( (segid " " and resid "162 " and name "HN ") OR (segid " " and resid "99 " and name "HN ") OR (segid " " and resid "66 " and name "HN ") )( (segid " " and resid "162 " and name "HA2 ") OR (segid " " and resid "159 " and name "HA ") OR (segid " " and resid "96 " and name "HA ") OR (segid " " and resid "66 " and name "HA2 ") ) 2.700 2.700 0.000 peak 7886 weight 0.10000E+01 volume -0.42820E+01 ppm1 7.585 ppm2 3.800 ASSI ( (segid " " and resid "66 " and name "HN ") )( (segid " " and resid "65 " and name "HA ") ) 5.000 5.000 0.000 peak 7887 weight 0.10000E+01 volume -0.10120E+01 ppm1 7.594 ppm2 4.485 ASSI ( (segid " " and resid "162 " and name "HN ") OR (segid " " and resid "99 " and name "HN ") OR (segid " " and resid "66 " and name "HN ") )( (segid " " and resid "158 " and name "HA ") OR (segid " " and resid "99 " and name "HA1 ") OR (segid " " and resid "66 " and name "HA1 ") ) 5.000 5.000 0.000 peak 7889 weight 0.10000E+01 volume -0.13330E+01 ppm1 7.589 ppm2 4.388 ASSI ( (segid " " and resid "99 " and name "HN ") )( (segid " " and resid "100 " and name "HA ") ) 6.000 6.000 0.000 peak 7890 weight 0.10000E+01 volume -0.21300E+00 ppm1 7.635 ppm2 4.213 ASSI ( (segid " " and resid "49 " and name "HE21") )( (segid " " and resid "73 " and name "HB2 ") OR (segid " " and resid "49 " and name "HG1 ") OR (segid " " and resid "49 " and name "HB1 ") ) 5.000 5.000 0.000 peak 7891 weight 0.10000E+01 volume 0.38000E+00 ppm1 8.466 ppm2 2.660 ASSI ( (segid " " and resid "49 " and name "HE22") )( (segid " " and resid "49 " and name "HE21") ) 3.300 3.300 0.000 peak 7892 weight 0.10000E+01 volume 0.23880E+01 ppm1 6.118 ppm2 8.461 ASSI ( (segid " " and resid "49 " and name "HE21") )( (segid " " and resid "49 " and name "HE22") ) 3.300 3.300 0.000 peak 7893 weight 0.10000E+01 volume 0.24440E+01 ppm1 8.465 ppm2 6.113 ASSI ( (segid " " and resid "49 " and name "HE22") )( (segid " " and resid "72 " and name "HG2 ") OR (segid " " and resid "72 " and name "HG1 ") OR (segid " " and resid "49 " and name "HG2 ") ) 6.000 6.000 0.000 peak 7894 weight 0.10000E+01 volume 0.25200E+00 ppm1 6.124 ppm2 2.215 ASSI ( (segid " " and resid "49 " and name "HE21") )( (segid " " and resid "71 " and name "HG13") OR (segid " " and resid "71 " and name "HG12") OR (segid " " and resid "71 " and name "HG11") ) 6.000 6.000 0.000 peak 7895 weight 0.10000E+01 volume 0.24700E+00 ppm1 8.461 ppm2 0.848 ASSI ( (segid " " and resid "49 " and name "HE21") )( (segid " " and resid "49 " and name "HG2 ") ) 5.000 5.000 0.000 peak 7896 weight 0.10000E+01 volume 0.43900E+00 ppm1 8.471 ppm2 2.223 ASSI ( (segid " " and resid "41 " and name "HD22") )( (segid " " and resid "41 " and name "HB1 ") ) 5.000 5.000 0.000 peak 7897 weight 0.10000E+01 volume 0.30600E+00 ppm1 5.873 ppm2 3.949 ASSI ( (segid " " and resid "41 " and name "HD22") )( (segid " " and resid "41 " and name "HD21") ) 5.000 5.000 0.000 peak 7898 weight 0.10000E+01 volume 0.14520E+01 ppm1 5.868 ppm2 7.952 ASSI ( (segid " " and resid "41 " and name "HD21") )( (segid " " and resid "41 " and name "HD22") ) 5.000 5.000 0.000 peak 7899 weight 0.10000E+01 volume 0.16910E+01 ppm1 7.952 ppm2 5.871 ASSI ( (segid " " and resid "41 " and name "HD22") )( (segid " " and resid "50 " and name "HG23") OR (segid " " and resid "50 " and name "HG22") OR (segid " " and resid "50 " and name "HG13") OR (segid " " and resid "50 " and name "HG11") ) 5.000 5.000 0.000 peak 7900 weight 0.10000E+01 volume 0.46000E+00 ppm1 5.869 ppm2 0.858 ASSI ( (segid " " and resid "41 " and name "HD21") )( (segid " " and resid "50 " and name "HG23") OR (segid " " and resid "50 " and name "HG13") OR (segid " " and resid "40 " and name "HD13") OR (segid " " and resid "40 " and name "HD11") ) 5.000 5.000 0.000 peak 7901 weight 0.10000E+01 volume 0.45600E+00 ppm1 7.942 ppm2 0.862 ASSI ( (segid " " and resid "141 " and name "HN ") )( (segid " " and resid "142 " and name "HG ") OR (segid " " and resid "137 " and name "HB1 ") ) 5.000 5.000 0.000 peak 7902 weight 0.10000E+01 volume 0.32500E+00 ppm1 8.458 ppm2 1.514 ASSI ( (segid " " and resid "141 " and name "HN ") )( (segid " " and resid "139 " and name "HB3 ") OR (segid " " and resid "139 " and name "HB2 ") OR (segid " " and resid "137 " and name "HG2 ") ) 6.000 6.000 0.000 peak 7903 weight 0.10000E+01 volume 0.23600E+00 ppm1 8.446 ppm2 1.397 ASSI ( (segid " " and resid "161 " and name "HE22") OR (segid " " and resid "65 " and name "HE22") )( (segid " " and resid "145 " and name "HD23") OR (segid " " and resid "145 " and name "HD22") OR (segid " " and resid "145 " and name "HD12") OR (segid " " and resid "145 " and name "HD11") OR (segid " " and resid "30 " and name "HB2 ") ) 6.000 6.000 0.000 peak 7904 weight 0.10000E+01 volume 0.24700E+00 ppm1 6.814 ppm2 0.988 ASSI ( (segid " " and resid "161 " and name "HE21") )( (segid " " and resid "145 " and name "HD23") OR (segid " " and resid "145 " and name "HD22") OR (segid " " and resid "145 " and name "HD13") OR (segid " " and resid "145 " and name "HD11") ) 6.000 6.000 0.000 peak 7905 weight 0.10000E+01 volume 0.12400E+00 ppm1 7.197 ppm2 0.988 ASSI ( (segid " " and resid "161 " and name "HE22") )( (segid " " and resid "161 " and name "HG2 ") ) 5.000 5.000 0.000 peak 7906 weight 0.10000E+01 volume 0.30300E+00 ppm1 6.820 ppm2 2.387 ASSI ( (segid " " and resid "161 " and name "HE22") OR (segid " " and resid "65 " and name "HE22") )( (segid " " and resid "161 " and name "HB2 ") OR (segid " " and resid "161 " and name "HB1 ") OR (segid " " and resid "65 " and name "HB1 ") ) 5.000 5.000 0.000 peak 7907 weight 0.10000E+01 volume 0.32100E+00 ppm1 6.817 ppm2 2.161 ASSI ( (segid " " and resid "150 " and name "HE22") )( (segid " " and resid "142 " and name "HD13") OR (segid " " and resid "142 " and name "HD12") OR (segid " " and resid "142 " and name "HD11") ) 5.000 5.000 0.000 peak 7908 weight 0.10000E+01 volume 0.30500E+00 ppm1 6.757 ppm2 0.878 ASSI ( (segid " " and resid "150 " and name "HE22") )( (segid " " and resid "150 " and name "HG2 ") OR (segid " " and resid "150 " and name "HB1 ") ) 6.000 6.000 0.000 peak 7909 weight 0.10000E+01 volume 0.18300E+00 ppm1 6.759 ppm2 2.354 ASSI ( (segid " " and resid "150 " and name "HE21") )( (segid " " and resid "150 " and name "HG2 ") OR (segid " " and resid "150 " and name "HB1 ") ) 6.000 6.000 0.000 peak 7910 weight 0.10000E+01 volume 0.17100E+00 ppm1 7.589 ppm2 2.353 ASSI ( (segid " " and resid "46 " and name "HN ") )( (segid " " and resid "49 " and name "HB1 ") ) 6.000 6.000 0.000 peak 7911 weight 0.10000E+01 volume 0.22600E+00 ppm1 9.194 ppm2 2.615 ASSI ( (segid " " and resid "103 " and name "HD21") )( (segid " " and resid "133 " and name "HN ") ) 6.000 6.000 0.000 peak 7913 weight 0.10000E+01 volume 0.10700E+00 ppm1 7.544 ppm2 8.700 ASSI ( (segid " " and resid "103 " and name "HD21") )( (segid " " and resid "103 " and name "HN ") OR (segid " " and resid "102 " and name "HN ") ) 6.000 6.000 0.000 peak 7914 weight 0.10000E+01 volume 0.21200E+00 ppm1 7.549 ppm2 8.538 ASSI ( (segid " " and resid "103 " and name "HD21") )( (segid " " and resid "132 " and name "HA ") ) 6.000 6.000 0.000 peak 7915 weight 0.10000E+01 volume 0.20700E+00 ppm1 7.545 ppm2 5.072 ASSI ( (segid " " and resid "103 " and name "HD22") )( (segid " " and resid "133 " and name "HN ") ) 6.000 6.000 0.000 peak 7916 weight 0.10000E+01 volume 0.23100E+00 ppm1 6.759 ppm2 8.712 ASSI ( (segid " " and resid "72 " and name "HE22") )( (segid " " and resid "72 " and name "HG2 ") OR (segid " " and resid "72 " and name "HG1 ") ) 5.000 5.000 0.000 peak 7917 weight 0.10000E+01 volume 0.68400E+00 ppm1 6.730 ppm2 2.249 ASSI ( (segid " " and resid "128 " and name "HN ") )( (segid " " and resid "127 " and name "HE2 ") OR (segid " " and resid "127 " and name "HE1 ") ) 6.000 6.000 0.000 peak 7918 weight 0.10000E+01 volume 0.28900E+00 ppm1 8.230 ppm2 7.188 ASSI ( (segid " " and resid "155 " and name "HD21") )( (segid " " and resid "155 " and name "HD22") ) 5.000 5.000 0.000 peak 7919 weight 0.10000E+01 volume 0.62100E+00 ppm1 7.849 ppm2 7.156 ASSI ( (segid " " and resid "70 " and name "HD22") )( (segid " " and resid "70 " and name "HB1 ") ) 6.000 6.000 0.000 peak 7920 weight 0.10000E+01 volume 0.20200E+00 ppm1 6.885 ppm2 3.022 ASSI ( (segid " " and resid "70 " and name "HD21") )( (segid " " and resid "101 " and name "HN ") ) 6.000 6.000 0.000 peak 7921 weight 0.10000E+01 volume 0.13500E+00 ppm1 7.862 ppm2 8.950 ASSI ( (segid " " and resid "70 " and name "HD22") )( (segid " " and resid "101 " and name "HN ") ) 6.000 6.000 0.000 peak 7922 weight 0.10000E+01 volume 0.29100E+00 ppm1 6.882 ppm2 8.968 ASSI ( (segid " " and resid "70 " and name "HD21") )( (segid " " and resid "70 " and name "HD22") ) 3.300 3.300 0.000 peak 7924 weight 0.10000E+01 volume 0.30670E+01 ppm1 7.863 ppm2 6.884 ASSI ( (segid " " and resid "155 " and name "HD21") OR (segid " " and resid "70 " and name "HD21") )( (segid " " and resid "158 " and name "HB1 ") OR (segid " " and resid "101 " and name "HB1 ") OR (segid " " and resid "70 " and name "HB2 ") ) 5.000 5.000 0.000 peak 7925 weight 0.10000E+01 volume 0.62400E+00 ppm1 7.869 ppm2 2.781 ASSI ( (segid " " and resid "70 " and name "HD22") )( (segid " " and resid "100 " and name "HA ") ) 6.000 6.000 0.000 peak 7926 weight 0.10000E+01 volume 0.21200E+00 ppm1 6.892 ppm2 4.219 ASSI ( (segid " " and resid "33 " and name "HN ") )( (segid " " and resid "32 " and name "HG2 ") OR (segid " " and resid "28 " and name "HG1 ") ) 6.000 6.000 0.000 peak 7927 weight 0.10000E+01 volume 0.23700E+00 ppm1 7.553 ppm2 1.706 ASSI ( (segid " " and resid "33 " and name "HN ") )( (segid " " and resid "29 " and name "HA ") ) 5.000 5.000 0.000 peak 7928 weight 0.10000E+01 volume 0.43800E+00 ppm1 7.545 ppm2 3.884 ASSI ( (segid " " and resid "154 " and name "HE22") )( (segid " " and resid "156 " and name "HB1 ") OR (segid " " and resid "154 " and name "HB2 ") ) 6.000 6.000 0.000 peak 7929 weight 0.10000E+01 volume 0.19500E+00 ppm1 6.806 ppm2 2.039 ASSI ( (segid " " and resid "154 " and name "HE22") )( (segid " " and resid "156 " and name "HB1 ") OR (segid " " and resid "154 " and name "HB2 ") ) 6.000 6.000 0.000 peak 7930 weight 0.10000E+01 volume 0.19500E+00 ppm1 6.806 ppm2 2.039 ASSI ( (segid " " and resid "154 " and name "HE22") )( (segid " " and resid "152 " and name "HA1 ") ) 6.000 6.000 0.000 peak 7931 weight 0.10000E+01 volume 0.11000E+00 ppm1 6.816 ppm2 3.995 ASSI ( (segid " " and resid "154 " and name "HE21") )( (segid " " and resid "154 " and name "HG2 ") OR (segid " " and resid "154 " and name "HG1 ") ) 5.000 5.000 0.000 peak 7934 weight 0.10000E+01 volume 0.18960E+01 ppm1 7.836 ppm2 2.414 ASSI ( (segid " " and resid "154 " and name "HE22") )( (segid " " and resid "154 " and name "HG2 ") OR (segid " " and resid "154 " and name "HG1 ") ) 5.000 5.000 0.000 peak 7935 weight 0.10000E+01 volume 0.75500E+00 ppm1 6.809 ppm2 2.414 ASSI ( (segid " " and resid "154 " and name "HE21") )( (segid " " and resid "154 " and name "HE22") ) 2.700 2.700 0.000 peak 7936 weight 0.10000E+01 volume 0.90360E+01 ppm1 7.837 ppm2 6.810 ASSI ( (segid " " and resid "154 " and name "HE22") )( (segid " " and resid "154 " and name "HE21") ) 2.700 2.700 0.000 peak 7937 weight 0.10000E+01 volume 0.92440E+01 ppm1 6.811 ppm2 7.841 ASSI ( (segid " " and resid "62 " and name "HN ") )( (segid " " and resid "64 " and name "HG2 ") OR (segid " " and resid "64 " and name "HG1 ") OR (segid " " and resid "63 " and name "HG ") OR (segid " " and resid "60 " and name "HB2 ") OR (segid " " and resid "30 " and name "HB1 ") ) 5.000 5.000 0.000 peak 7938 weight 0.10000E+01 volume 0.34400E+00 ppm1 7.504 ppm2 1.582 ASSI ( (segid " " and resid "85 " and name "HN ") )( (segid " " and resid "85 " and name "HG1 ") ) 6.000 6.000 0.000 peak 7939 weight 0.10000E+01 volume 0.25300E+00 ppm1 8.635 ppm2 1.752 ASSI ( (segid " " and resid "48 " and name "HN ") )( (segid " " and resid "46 " and name "HB ") ) 5.000 5.000 0.000 peak 7940 weight 0.10000E+01 volume 0.30300E+00 ppm1 8.376 ppm2 4.910 ASSI ( (segid " " and resid "48 " and name "HN ") OR (segid " " and resid "27 " and name "HN ") )( (segid " " and resid "48 " and name "HD23") OR (segid " " and resid "48 " and name "HD22") OR (segid " " and resid "26 " and name "HG23") OR (segid " " and resid "26 " and name "HG22") OR (segid " " and resid "26 " and name "HG21") ) 5.000 5.000 0.000 peak 7941 weight 0.10000E+01 volume 0.11880E+01 ppm1 8.385 ppm2 0.805 ASSI ( (segid " " and resid "27 " and name "HN ") )( (segid " " and resid "27 " and name "HB2 ") OR (segid " " and resid "27 " and name "HB1 ") ) 3.300 3.300 0.000 peak 7943 weight 0.10000E+01 volume 0.30100E+01 ppm1 8.417 ppm2 1.911 ASSI ( (segid " " and resid "32 " and name "HN ") OR (segid " " and resid "27 " and name "HN ") )( (segid " " and resid "32 " and name "HB1 ") OR (segid " " and resid "26 " and name "HB ") ) 3.300 3.300 0.000 peak 7944 weight 0.10000E+01 volume 0.27060E+01 ppm1 8.413 ppm2 2.184 ASSI ( (segid " " and resid "27 " and name "HN ") )( (segid " " and resid "58 " and name "HA ") OR (segid " " and resid "26 " and name "HA ") OR (segid " " and resid "23 " and name "HA ") ) 5.000 5.000 0.000 peak 7945 weight 0.10000E+01 volume 0.52500E+00 ppm1 8.415 ppm2 3.379 ASSI ( (segid " " and resid "27 " and name "HN ") )( (segid " " and resid "27 " and name "HG1 ") ) 3.300 3.300 0.000 peak 7946 weight 0.10000E+01 volume 0.28820E+01 ppm1 8.405 ppm2 1.707 ASSI ( (segid " " and resid "32 " and name "HN ") OR (segid " " and resid "27 " and name "HN ") )( (segid " " and resid "31 " and name "HB2 ") OR (segid " " and resid "31 " and name "HB1 ") OR (segid " " and resid "27 " and name "HD2 ") OR (segid " " and resid "27 " and name "HD1 ") ) 5.000 5.000 0.000 peak 7947 weight 0.10000E+01 volume 0.89000E+00 ppm1 8.416 ppm2 3.115 ASSI ( (segid " " and resid "27 " and name "HN ") )( (segid " " and resid "28 " and name "HN ") OR (segid " " and resid "26 " and name "HN ") ) 5.000 5.000 0.000 peak 7948 weight 0.10000E+01 volume 0.18770E+01 ppm1 8.416 ppm2 8.137 ASSI ( (segid " " and resid "32 " and name "HN ") OR (segid " " and resid "27 " and name "HN ") )( (segid " " and resid "32 " and name "HG1 ") OR (segid " " and resid "27 " and name "HB2 ") ) 3.300 3.300 0.000 peak 7949 weight 0.10000E+01 volume 0.29210E+01 ppm1 8.415 ppm2 1.847 ASSI ( (segid " " and resid "48 " and name "HN ") OR (segid " " and resid "32 " and name "HN ") OR (segid " " and resid "27 " and name "HN ") )( (segid " " and resid "67 " and name "HA ") OR (segid " " and resid "34 " and name "HA ") OR (segid " " and resid "28 " and name "HA ") OR (segid " " and resid "24 " and name "HA ") ) 5.000 5.000 0.000 peak 7950 weight 0.10000E+01 volume 0.88100E+00 ppm1 8.413 ppm2 4.004 ASSI ( (segid " " and resid "48 " and name "HN ") OR (segid " " and resid "27 " and name "HN ") )( (segid " " and resid "48 " and name "HD23") OR (segid " " and resid "48 " and name "HD22") OR (segid " " and resid "26 " and name "HG23") OR (segid " " and resid "26 " and name "HG22") OR (segid " " and resid "26 " and name "HG21") ) 5.000 5.000 0.000 peak 7951 weight 0.10000E+01 volume 0.10720E+01 ppm1 8.410 ppm2 0.806 ASSI ( (segid " " and resid "32 " and name "HN ") OR (segid " " and resid "27 " and name "HN ") )( (segid " " and resid "61 " and name "HG2 ") OR (segid " " and resid "32 " and name "HB2 ") ) 3.300 3.300 0.000 peak 7952 weight 0.10000E+01 volume 0.20440E+01 ppm1 8.409 ppm2 2.092 ASSI ( (segid " " and resid "84 " and name "HN ") OR (segid " " and resid "58 " and name "HN ") )( (segid " " and resid "112 " and name "HA ") OR (segid " " and resid "57 " and name "HA ") ) 6.000 6.000 0.000 peak 7953 weight 0.10000E+01 volume 0.21100E+00 ppm1 7.804 ppm2 4.114 ASSI ( (segid " " and resid "103 " and name "HN ") )( (segid " " and resid "104 " and name "HB3 ") OR (segid " " and resid "104 " and name "HB2 ") OR (segid " " and resid "104 " and name "HB1 ") ) 5.000 5.000 0.000 peak 7955 weight 0.10000E+01 volume 0.56600E+00 ppm1 8.545 ppm2 1.315 ASSI ( (segid " " and resid "160 " and name "HN ") OR (segid " " and resid "43 " and name "HN ") )( (segid " " and resid "160 " and name "HG ") OR (segid " " and resid "42 " and name "HB2 ") ) 3.300 3.300 0.000 peak 7956 weight 0.10000E+01 volume 0.28090E+01 ppm1 7.941 ppm2 1.774 ASSI ( (segid " " and resid "160 " and name "HN ") OR (segid " " and resid "43 " and name "HN ") )( (segid " " and resid "159 " and name "HD12") OR (segid " " and resid "159 " and name "HD11") OR (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "159 " and name "HG21") OR (segid " " and resid "40 " and name "HD13") OR (segid " " and resid "40 " and name "HD12") ) 5.000 5.000 0.000 peak 7957 weight 0.10000E+01 volume 0.15300E+01 ppm1 7.944 ppm2 0.888 ASSI ( (segid " " and resid "160 " and name "HN ") OR (segid " " and resid "116 " and name "HN ") OR (segid " " and resid "91 " and name "HN ") OR (segid " " and resid "43 " and name "HN ") )( (segid " " and resid "162 " and name "HA1 ") OR (segid " " and resid "161 " and name "HA ") OR (segid " " and resid "126 " and name "HA ") OR (segid " " and resid "114 " and name "HA ") OR (segid " " and resid "84 " and name "HA ") OR (segid " " and resid "56 " and name "HD1 ") OR (segid " " and resid "15 " and name "HB2 ") OR (segid " " and resid "15 " and name "HB1 ") ) 5.000 5.000 0.000 peak 7958 weight 0.10000E+01 volume 0.34400E+00 ppm1 7.942 ppm2 4.001 ASSI ( (segid " " and resid "160 " and name "HN ") OR (segid " " and resid "43 " and name "HN ") )( (segid " " and resid "159 " and name "HB ") OR (segid " " and resid "42 " and name "HB1 ") ) 3.300 3.300 0.000 peak 7959 weight 0.10000E+01 volume 0.29550E+01 ppm1 7.944 ppm2 1.883 ASSI ( (segid " " and resid "160 " and name "HN ") )( (segid " " and resid "160 " and name "HD23") OR (segid " " and resid "160 " and name "HD22") OR (segid " " and resid "160 " and name "HD21") ) 5.000 5.000 0.000 peak 7960 weight 0.10000E+01 volume 0.77900E+00 ppm1 7.944 ppm2 0.750 ASSI ( (segid " " and resid "160 " and name "HN ") OR (segid " " and resid "43 " and name "HN ") )( (segid " " and resid "159 " and name "HB ") OR (segid " " and resid "42 " and name "HB1 ") ) 3.300 3.300 0.000 peak 7961 weight 0.10000E+01 volume 0.29550E+01 ppm1 7.944 ppm2 1.893 ASSI ( (segid " " and resid "160 " and name "HN ") OR (segid " " and resid "43 " and name "HN ") )( (segid " " and resid "160 " and name "HB2 ") OR (segid " " and resid "42 " and name "HG1 ") OR (segid " " and resid "40 " and name "HB2 ") ) 5.000 5.000 0.000 peak 7962 weight 0.10000E+01 volume 0.16180E+01 ppm1 7.937 ppm2 1.282 ASSI ( (segid " " and resid "160 " and name "HN ") OR (segid " " and resid "43 " and name "HN ") )( (segid " " and resid "160 " and name "HB2 ") OR (segid " " and resid "42 " and name "HG1 ") OR (segid " " and resid "40 " and name "HB2 ") ) 5.000 5.000 0.000 peak 7963 weight 0.10000E+01 volume 0.16180E+01 ppm1 7.941 ppm2 1.278 ASSI ( (segid " " and resid "91 " and name "HN ") )( (segid " " and resid "90 " and name "HB2 ") ) 5.000 5.000 0.000 peak 7964 weight 0.10000E+01 volume 0.58000E+00 ppm1 7.938 ppm2 2.563 ASSI ( (segid " " and resid "160 " and name "HN ") OR (segid " " and resid "116 " and name "HN ") OR (segid " " and resid "91 " and name "HN ") )( (segid " " and resid "159 " and name "HG12") OR (segid " " and resid "156 " and name "HB2 ") OR (segid " " and resid "147 " and name "HD12") OR (segid " " and resid "147 " and name "HD11") OR (segid " " and resid "129 " and name "HB3 ") OR (segid " " and resid "129 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB1 ") OR (segid " " and resid "94 " and name "HG13") OR (segid " " and resid "94 " and name "HG12") OR (segid " " and resid "94 " and name "HG11") OR (segid " " and resid "91 " and name "HG23") OR (segid " " and resid "91 " and name "HG22") OR (segid " " and resid "91 " and name "HG21") ) 5.000 5.000 0.000 peak 7965 weight 0.10000E+01 volume 0.95200E+00 ppm1 7.939 ppm2 1.140 ASSI ( (segid " " and resid "160 " and name "HN ") OR (segid " " and resid "91 " and name "HN ") )( (segid " " and resid "159 " and name "HG12") OR (segid " " and resid "156 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB3 ") OR (segid " " and resid "129 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB1 ") OR (segid " " and resid "91 " and name "HG23") OR (segid " " and resid "91 " and name "HG22") OR (segid " " and resid "91 " and name "HG21") ) 5.000 5.000 0.000 peak 7966 weight 0.10000E+01 volume 0.95200E+00 ppm1 7.934 ppm2 1.128 ASSI ( (segid " " and resid "116 " and name "HN ") OR (segid " " and resid "43 " and name "HN ") )( (segid " " and resid "115 " and name "HB1 ") OR (segid " " and resid "8 " and name "HB ") ) 5.000 5.000 0.000 peak 7967 weight 0.10000E+01 volume 0.10690E+01 ppm1 7.896 ppm2 2.187 ASSI ( (segid " " and resid "116 " and name "HN ") OR (segid " " and resid "91 " and name "HN ") )( (segid " " and resid "128 " and name "HG ") OR (segid " " and resid "115 " and name "HG ") OR (segid " " and resid "92 " and name "HB1 ") OR (segid " " and resid "56 " and name "HG1 ") ) 5.000 5.000 0.000 peak 7968 weight 0.10000E+01 volume 0.17240E+01 ppm1 7.905 ppm2 2.047 ASSI ( (segid " " and resid "164 " and name "HN ") )( (segid " " and resid "163 " and name "HB1 ") ) 6.000 6.000 0.000 peak 7970 weight 0.10000E+01 volume 0.24000E+00 ppm1 7.604 ppm2 3.268 ASSI ( (segid " " and resid "91 " and name "HN ") OR (segid " " and resid "43 " and name "HN ") )( (segid " " and resid "88 " and name "HD2 ") OR (segid " " and resid "88 " and name "HD1 ") OR (segid " " and resid "45 " and name "HN ") ) 5.000 5.000 0.000 peak 7971 weight 0.10000E+01 volume 0.12410E+01 ppm1 7.932 ppm2 7.443 ASSI ( (segid " " and resid "43 " and name "HN ") )( (segid " " and resid "42 " and name "HN ") ) 5.000 5.000 0.000 peak 7972 weight 0.10000E+01 volume 0.41000E+00 ppm1 7.929 ppm2 9.849 ASSI ( (segid " " and resid "77 " and name "HN ") OR (segid " " and resid "22 " and name "HN ") )( (segid " " and resid "75 " and name "HB1 ") OR (segid " " and resid "17 " and name "HA ") ) 5.000 5.000 0.000 peak 7973 weight 0.10000E+01 volume 0.63600E+00 ppm1 8.150 ppm2 4.138 ASSI ( (segid " " and resid "77 " and name "HN ") OR (segid " " and resid "22 " and name "HN ") )( (segid " " and resid "72 " and name "HB1 ") OR (segid " " and resid "25 " and name "HB1 ") OR (segid " " and resid "20 " and name "HB2 ") ) 5.000 5.000 0.000 peak 7974 weight 0.10000E+01 volume 0.12300E+01 ppm1 8.157 ppm2 1.970 ASSI ( (segid " " and resid "26 " and name "HN ") )( (segid " " and resid "29 " and name "HD13") OR (segid " " and resid "26 " and name "HG23") OR (segid " " and resid "26 " and name "HG22") OR (segid " " and resid "26 " and name "HG21") ) 5.000 5.000 0.000 peak 7977 weight 0.10000E+01 volume 0.14770E+01 ppm1 8.129 ppm2 0.798 ASSI ( (segid " " and resid "165 " and name "HN ") OR (segid " " and resid "26 " and name "HN ") )( (segid " " and resid "166 " and name "HD13") OR (segid " " and resid "166 " and name "HD12") OR (segid " " and resid "134 " and name "HD12") OR (segid " " and resid "134 " and name "HD11") OR (segid " " and resid "26 " and name "HG12") OR (segid " " and resid "26 " and name "HG11") ) 3.300 3.300 0.000 peak 7978 weight 0.10000E+01 volume 0.35410E+01 ppm1 8.132 ppm2 0.912 ASSI ( (segid " " and resid "26 " and name "HN ") )( (segid " " and resid "17 " and name "HB3 ") OR (segid " " and resid "17 " and name "HB2 ") OR (segid " " and resid "17 " and name "HB1 ") ) 5.000 5.000 0.000 peak 7979 weight 0.10000E+01 volume 0.13030E+01 ppm1 8.131 ppm2 1.500 ASSI ( (segid " " and resid "52 " and name "HN ") )( (segid " " and resid "51 " and name "HB1 ") ) 5.000 5.000 0.000 peak 7981 weight 0.10000E+01 volume 0.93500E+00 ppm1 7.134 ppm2 1.918 ASSI ( (segid " " and resid "118 " and name "HN ") OR (segid " " and resid "26 " and name "HN ") )( (segid " " and resid "118 " and name "HG2 ") OR (segid " " and resid "25 " and name "HB2 ") ) 5.000 5.000 0.000 peak 7982 weight 0.10000E+01 volume 0.13280E+01 ppm1 8.123 ppm2 1.610 ASSI ( (segid " " and resid "118 " and name "HN ") OR (segid " " and resid "28 " and name "HN ") )( (segid " " and resid "151 " and name "HD1 ") OR (segid " " and resid "118 " and name "HD2 ") OR (segid " " and resid "118 " and name "HD1 ") OR (segid " " and resid "32 " and name "HD2 ") ) 5.000 5.000 0.000 peak 7983 weight 0.10000E+01 volume 0.53700E+00 ppm1 8.116 ppm2 3.265 ASSI ( (segid " " and resid "118 " and name "HN ") )( (segid " " and resid "147 " and name "HD13") OR (segid " " and resid "147 " and name "HD12") OR (segid " " and resid "147 " and name "HD11") ) 5.000 5.000 0.000 peak 7984 weight 0.10000E+01 volume 0.12110E+01 ppm1 8.116 ppm2 1.183 ASSI ( (segid " " and resid "28 " and name "HN ") OR (segid " " and resid "26 " and name "HN ") )( (segid " " and resid "28 " and name "HG2 ") OR (segid " " and resid "27 " and name "HG2 ") OR (segid " " and resid "17 " and name "HB3 ") OR (segid " " and resid "17 " and name "HB1 ") ) 5.000 5.000 0.000 peak 7985 weight 0.10000E+01 volume 0.15800E+01 ppm1 8.129 ppm2 1.498 ASSI ( (segid " " and resid "35 " and name "HN ") )( (segid " " and resid "34 " and name "HD23") OR (segid " " and resid "34 " and name "HD22") OR (segid " " and resid "34 " and name "HD21") OR (segid " " and resid "30 " and name "HD23") OR (segid " " and resid "30 " and name "HD22") OR (segid " " and resid "30 " and name "HD21") OR (segid " " and resid "29 " and name "HD22") ) 5.000 5.000 0.000 peak 7986 weight 0.10000E+01 volume 0.48000E+00 ppm1 7.973 ppm2 0.792 ASSI ( (segid " " and resid "118 " and name "HN ") OR (segid " " and resid "28 " and name "HN ") )( (segid " " and resid "118 " and name "HG2 ") OR (segid " " and resid "28 " and name "HG1 ") OR (segid " " and resid "27 " and name "HG1 ") ) 5.000 5.000 0.000 peak 7987 weight 0.10000E+01 volume 0.15050E+01 ppm1 8.130 ppm2 1.661 ASSI ( (segid " " and resid "118 " and name "HN ") OR (segid " " and resid "28 " and name "HN ") )( (segid " " and resid "118 " and name "HG1 ") OR (segid " " and resid "28 " and name "HB2 ") OR (segid " " and resid "28 " and name "HB1 ") ) 2.700 2.700 0.000 peak 7988 weight 0.10000E+01 volume 0.66460E+01 ppm1 8.140 ppm2 1.957 ASSI ( (segid " " and resid "73 " and name "HN ") OR (segid " " and resid "35 " and name "HN ") )( (segid " " and resid "77 " and name "HB ") OR (segid " " and resid "30 " and name "HA ") ) 5.000 5.000 0.000 peak 7989 weight 0.10000E+01 volume 0.12100E+01 ppm1 7.979 ppm2 4.242 ASSI ( (segid " " and resid "28 " and name "HN ") )( (segid " " and resid "25 " and name "HA ") ) 5.000 5.000 0.000 peak 7990 weight 0.10000E+01 volume 0.43200E+00 ppm1 8.138 ppm2 4.617 ASSI ( (segid " " and resid "73 " and name "HN ") )( (segid " " and resid "49 " and name "HE22") ) 6.000 6.000 0.000 peak 7992 weight 0.10000E+01 volume 0.23200E+00 ppm1 7.994 ppm2 6.115 ASSI ( (segid " " and resid "73 " and name "HN ") OR (segid " " and resid "35 " and name "HN ") )( (segid " " and resid "76 " and name "HN ") OR (segid " " and resid "75 " and name "HN ") OR (segid " " and resid "32 " and name "HN ") ) 5.000 5.000 0.000 peak 7993 weight 0.10000E+01 volume 0.44800E+00 ppm1 7.991 ppm2 8.362 ASSI ( (segid " " and resid "73 " and name "HN ") )( (segid " " and resid "72 " and name "HB1 ") ) 5.000 5.000 0.000 peak 7994 weight 0.10000E+01 volume 0.96100E+00 ppm1 7.983 ppm2 1.973 ASSI ( (segid " " and resid "73 " and name "HN ") )( (segid " " and resid "72 " and name "HB2 ") ) 5.000 5.000 0.000 peak 7995 weight 0.10000E+01 volume 0.55700E+00 ppm1 7.993 ppm2 1.834 ASSI ( (segid " " and resid "125 " and name "HN ") OR (segid " " and resid "28 " and name "HN ") )( (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB1 ") OR (segid " " and resid "27 " and name "HG2 ") ) 5.000 5.000 0.000 peak 7996 weight 0.10000E+01 volume 0.12290E+01 ppm1 8.137 ppm2 1.501 ASSI ( (segid " " and resid "125 " and name "HN ") OR (segid " " and resid "95 " and name "HN ") )( (segid " " and resid "125 " and name "HG23") OR (segid " " and resid "125 " and name "HG22") OR (segid " " and resid "125 " and name "HG21") OR (segid " " and resid "95 " and name "HD23") OR (segid " " and resid "95 " and name "HD22") ) 2.700 2.700 0.000 peak 7997 weight 0.10000E+01 volume 0.44040E+01 ppm1 8.130 ppm2 0.912 ASSI ( (segid " " and resid "95 " and name "HN ") )( (segid " " and resid "95 " and name "HD13") OR (segid " " and resid "95 " and name "HD12") ) 5.000 5.000 0.000 peak 7998 weight 0.10000E+01 volume 0.15520E+01 ppm1 8.127 ppm2 0.730 ASSI ( (segid " " and resid "125 " and name "HN ") OR (segid " " and resid "95 " and name "HN ") )( (segid " " and resid "125 " and name "HB ") OR (segid " " and resid "94 " and name "HB ") ) 3.300 3.300 0.000 peak 7999 weight 0.10000E+01 volume 0.32410E+01 ppm1 8.125 ppm2 2.234 ASSI ( (segid " " and resid "125 " and name "HN ") OR (segid " " and resid "95 " and name "HN ") )( (segid " " and resid "124 " and name "HA ") OR (segid " " and resid "96 " and name "HA ") OR (segid " " and resid "91 " and name "HA ") ) 5.000 5.000 0.000 peak 8000 weight 0.10000E+01 volume 0.11800E+01 ppm1 8.130 ppm2 3.764 ASSI ( (segid " " and resid "8 " and name "HN ") )( (segid " " and resid "8 " and name "HA ") ) 5.000 5.000 0.000 peak 8001 weight 0.10000E+01 volume 0.13530E+01 ppm1 8.332 ppm2 4.226 ASSI ( (segid " " and resid "138 " and name "HN ") )( (segid " " and resid "137 " and name "HG2 ") ) 5.000 5.000 0.000 peak 8002 weight 0.10000E+01 volume 0.34900E+00 ppm1 7.709 ppm2 1.408 ASSI ( (segid " " and resid "14 " and name "HN ") )( (segid " " and resid "16 " and name "HA1 ") OR (segid " " and resid "15 " and name "HA ") OR (segid " " and resid "10 " and name "HA ") ) 6.000 6.000 0.000 peak 8003 weight 0.10000E+01 volume 0.26100E+00 ppm1 8.341 ppm2 3.921 ASSI ( (segid " " and resid "67 " and name "HN ") )( (segid " " and resid "66 " and name "HA1 ") ) 5.000 5.000 0.000 peak 8005 weight 0.10000E+01 volume 0.30300E+00 ppm1 8.018 ppm2 4.413 ASSI ( (segid " " and resid "92 " and name "HN ") OR (segid " " and resid "67 " and name "HN ") )( (segid " " and resid "91 " and name "HA ") OR (segid " " and resid "66 " and name "HA2 ") ) 5.000 5.000 0.000 peak 8006 weight 0.10000E+01 volume 0.11900E+01 ppm1 8.030 ppm2 3.771 ASSI ( (segid " " and resid "67 " and name "HN ") )( (segid " " and resid "37 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8007 weight 0.10000E+01 volume 0.82400E+00 ppm1 8.039 ppm2 1.957 ASSI ( (segid " " and resid "153 " and name "HN ") OR (segid " " and resid "39 " and name "HN ") )( (segid " " and resid "151 " and name "HG2 ") OR (segid " " and resid "151 " and name "HG1 ") OR (segid " " and resid "151 " and name "HB2 ") OR (segid " " and resid "40 " and name "HG ") ) 5.000 5.000 0.000 peak 8008 weight 0.10000E+01 volume 0.55900E+00 ppm1 7.835 ppm2 1.792 ASSI ( (segid " " and resid "39 " and name "HN ") )( (segid " " and resid "47 " and name "HB3 ") OR (segid " " and resid "47 " and name "HB2 ") OR (segid " " and resid "47 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8009 weight 0.10000E+01 volume 0.41000E+00 ppm1 7.859 ppm2 1.251 ASSI ( (segid " " and resid "100 " and name "HN ") OR (segid " " and resid "5 " and name "HN ") OR (segid " " and resid "4 " and name "HN ") )( (segid " " and resid "95 " and name "HB1 ") OR (segid " " and resid "6 " and name "HG2 ") ) 6.000 6.000 0.000 peak 8011 weight 0.10000E+01 volume 0.10800E+00 ppm1 8.256 ppm2 2.251 ASSI ( (segid " " and resid "100 " and name "HN ") OR (segid " " and resid "4 " and name "HN ") )( (segid " " and resid "102 " and name "HG23") OR (segid " " and resid "102 " and name "HG22") OR (segid " " and resid "102 " and name "HG21") OR (segid " " and resid "4 " and name "HD23") OR (segid " " and resid "4 " and name "HD22") OR (segid " " and resid "4 " and name "HD21") ) 6.000 6.000 0.000 peak 8012 weight 0.10000E+01 volume 0.23200E+00 ppm1 8.264 ppm2 0.836 ASSI ( (segid " " and resid "100 " and name "HN ") OR (segid " " and resid "5 " and name "HN ") OR (segid " " and resid "4 " and name "HN ") )( (segid " " and resid "95 " and name "HD23") OR (segid " " and resid "5 " and name "HD11") OR (segid " " and resid "4 " and name "HD13") OR (segid " " and resid "4 " and name "HD12") OR (segid " " and resid "4 " and name "HD11") ) 6.000 6.000 0.000 peak 8013 weight 0.10000E+01 volume 0.28100E+00 ppm1 8.264 ppm2 0.956 ASSI ( (segid " " and resid "100 " and name "HN ") )( (segid " " and resid "69 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8014 weight 0.10000E+01 volume 0.58600E+00 ppm1 8.260 ppm2 1.694 ASSI ( (segid " " and resid "111 " and name "HN ") )( (segid " " and resid "136 " and name "HD2 ") ) 6.000 6.000 0.000 peak 8016 weight 0.10000E+01 volume 0.11600E+00 ppm1 9.445 ppm2 6.798 ASSI ( (segid " " and resid "5 " and name "HN ") )( (segid " " and resid "5 " and name "HG ") OR (segid " " and resid "5 " and name "HB2 ") OR (segid " " and resid "4 " and name "HG ") OR (segid " " and resid "4 " and name "HB2 ") OR (segid " " and resid "4 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8017 weight 0.10000E+01 volume 0.89700E+00 ppm1 8.220 ppm2 1.639 ASSI ( (segid " " and resid "5 " and name "HN ") )( (segid " " and resid "5 " and name "HA ") OR (segid " " and resid "4 " and name "HA ") ) 5.000 5.000 0.000 peak 8018 weight 0.10000E+01 volume 0.89400E+00 ppm1 8.218 ppm2 4.380 ASSI ( (segid " " and resid "8 " and name "HN ") )( (segid " " and resid "8 " and name "HG23") OR (segid " " and resid "8 " and name "HG21") OR (segid " " and resid "8 " and name "HG13") OR (segid " " and resid "8 " and name "HG12") OR (segid " " and resid "8 " and name "HG11") ) 3.300 3.300 0.000 peak 8024 weight 0.10000E+01 volume 0.22310E+01 ppm1 8.331 ppm2 0.961 ASSI ( (segid " " and resid "8 " and name "HN ") )( (segid " " and resid "8 " and name "HB ") ) 5.000 5.000 0.000 peak 8025 weight 0.10000E+01 volume 0.15440E+01 ppm1 8.329 ppm2 2.147 ASSI ( (segid " " and resid "8 " and name "HN ") )( (segid " " and resid "7 " and name "HA ") OR (segid " " and resid "6 " and name "HA ") ) 3.300 3.300 0.000 peak 8026 weight 0.10000E+01 volume 0.33800E+01 ppm1 8.328 ppm2 4.336 ASSI ( (segid " " and resid "11 " and name "HN ") )( (segid " " and resid "39 " and name "HB3 ") OR (segid " " and resid "39 " and name "HB1 ") ) 6.000 6.000 0.000 peak 8028 weight 0.10000E+01 volume 0.21500E+00 ppm1 8.764 ppm2 1.404 ASSI ( (segid " " and resid "11 " and name "HN ") )( (segid " " and resid "10 " and name "HG23") OR (segid " " and resid "10 " and name "HG22") OR (segid " " and resid "10 " and name "HG21") OR (segid " " and resid "10 " and name "HG11") ) 5.000 5.000 0.000 peak 8030 weight 0.10000E+01 volume 0.50300E+00 ppm1 8.763 ppm2 1.142 ASSI ( (segid " " and resid "12 " and name "HN ") )( (segid " " and resid "13 " and name "HD2 ") OR (segid " " and resid "13 " and name "HD1 ") OR (segid " " and resid "9 " and name "HB2 ") OR (segid " " and resid "9 " and name "HB1 ") ) 6.000 6.000 0.000 peak 8033 weight 0.10000E+01 volume 0.23500E+00 ppm1 8.091 ppm2 3.183 ASSI ( (segid " " and resid "14 " and name "HN ") )( (segid " " and resid "29 " and name "HD23") OR (segid " " and resid "29 " and name "HD22") OR (segid " " and resid "29 " and name "HD21") OR (segid " " and resid "29 " and name "HD13") OR (segid " " and resid "29 " and name "HD12") ) 5.000 5.000 0.000 peak 8040 weight 0.10000E+01 volume 0.64600E+00 ppm1 8.337 ppm2 0.765 ASSI ( (segid " " and resid "14 " and name "HN ") )( (segid " " and resid "13 " and name "HN ") ) 6.000 6.000 0.000 peak 8041 weight 0.10000E+01 volume 0.18200E+00 ppm1 8.338 ppm2 8.007 ASSI ( (segid " " and resid "15 " and name "HN ") )( (segid " " and resid "39 " and name "HB3 ") OR (segid " " and resid "39 " and name "HB2 ") OR (segid " " and resid "39 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8046 weight 0.10000E+01 volume 0.38900E+00 ppm1 8.248 ppm2 1.363 ASSI ( (segid " " and resid "15 " and name "HN ") )( (segid " " and resid "39 " and name "HA ") OR (segid " " and resid "14 " and name "HA ") OR (segid " " and resid "13 " and name "HA ") ) 5.000 5.000 0.000 peak 8047 weight 0.10000E+01 volume 0.10970E+01 ppm1 8.253 ppm2 4.094 ASSI ( (segid " " and resid "15 " and name "HN ") )( (segid " " and resid "40 " and name "HD13") OR (segid " " and resid "35 " and name "HG23") OR (segid " " and resid "14 " and name "HD23") OR (segid " " and resid "14 " and name "HD22") OR (segid " " and resid "14 " and name "HD21") ) 5.000 5.000 0.000 peak 8049 weight 0.10000E+01 volume 0.41300E+00 ppm1 8.250 ppm2 0.907 ASSI ( (segid " " and resid "15 " and name "HN ") )( (segid " " and resid "47 " and name "HB3 ") OR (segid " " and resid "47 " and name "HB2 ") OR (segid " " and resid "47 " and name "HB1 ") ) 6.000 6.000 0.000 peak 8050 weight 0.10000E+01 volume 0.28700E+00 ppm1 8.251 ppm2 1.229 ASSI ( (segid " " and resid "15 " and name "HN ") )( (segid " " and resid "15 " and name "HB2 ") OR (segid " " and resid "15 " and name "HB1 ") OR (segid " " and resid "15 " and name "HA ") ) 5.000 5.000 0.000 peak 8052 weight 0.10000E+01 volume 0.19000E+01 ppm1 8.257 ppm2 3.945 ASSI ( (segid " " and resid "15 " and name "HN ") )( (segid " " and resid "12 " and name "HA ") ) 6.000 6.000 0.000 peak 8053 weight 0.10000E+01 volume 0.14900E+00 ppm1 8.257 ppm2 4.612 ASSI ( (segid " " and resid "15 " and name "HN ") )( (segid " " and resid "14 " and name "HD13") OR (segid " " and resid "14 " and name "HD12") ) 6.000 6.000 0.000 peak 8054 weight 0.10000E+01 volume 0.25700E+00 ppm1 8.253 ppm2 0.995 ASSI ( (segid " " and resid "16 " and name "HN ") )( (segid " " and resid "16 " and name "HA1 ") OR (segid " " and resid "15 " and name "HB2 ") OR (segid " " and resid "15 " and name "HB1 ") OR (segid " " and resid "15 " and name "HA ") ) 3.300 3.300 0.000 peak 8059 weight 0.10000E+01 volume 0.31280E+01 ppm1 8.350 ppm2 3.954 ASSI ( (segid " " and resid "16 " and name "HN ") )( (segid " " and resid "17 " and name "HA ") OR (segid " " and resid "13 " and name "HA ") ) 5.000 5.000 0.000 peak 8060 weight 0.10000E+01 volume 0.12180E+01 ppm1 8.347 ppm2 4.164 ASSI ( (segid " " and resid "16 " and name "HN ") )( (segid " " and resid "17 " and name "HA ") OR (segid " " and resid "14 " and name "HA ") OR (segid " " and resid "13 " and name "HA ") ) 5.000 5.000 0.000 peak 8061 weight 0.10000E+01 volume 0.12450E+01 ppm1 8.352 ppm2 4.117 ASSI ( (segid " " and resid "16 " and name "HN ") )( (segid " " and resid "19 " and name "HB3 ") OR (segid " " and resid "19 " and name "HB2 ") OR (segid " " and resid "19 " and name "HB1 ") OR (segid " " and resid "17 " and name "HB3 ") OR (segid " " and resid "17 " and name "HB2 ") OR (segid " " and resid "17 " and name "HB1 ") OR (segid " " and resid "14 " and name "HG ") ) 5.000 5.000 0.000 peak 8062 weight 0.10000E+01 volume 0.34300E+00 ppm1 8.341 ppm2 1.539 ASSI ( (segid " " and resid "17 " and name "HN ") )( (segid " " and resid "26 " and name "HG12") OR (segid " " and resid "14 " and name "HD23") OR (segid " " and resid "14 " and name "HD22") OR (segid " " and resid "14 " and name "HD21") ) 6.000 6.000 0.000 peak 8066 weight 0.10000E+01 volume 0.28400E+00 ppm1 7.623 ppm2 0.929 ASSI ( (segid " " and resid "17 " and name "HN ") )( (segid " " and resid "18 " and name "HB3 ") OR (segid " " and resid "18 " and name "HB2 ") OR (segid " " and resid "18 " and name "HB1 ") ) 6.000 6.000 0.000 peak 8067 weight 0.10000E+01 volume -0.18300E+00 ppm1 7.620 ppm2 1.300 ASSI ( (segid " " and resid "17 " and name "HN ") )( (segid " " and resid "29 " and name "HB1 ") OR (segid " " and resid "25 " and name "HB1 ") OR (segid " " and resid "20 " and name "HG1 ") OR (segid " " and resid "20 " and name "HB2 ") OR (segid " " and resid "20 " and name "HB1 ") OR (segid " " and resid "14 " and name "HB1 ") OR (segid " " and resid "13 " and name "HB1 ") ) 6.000 6.000 0.000 peak 8068 weight 0.10000E+01 volume -0.56000E-01 ppm1 7.621 ppm2 1.970 ASSI ( (segid " " and resid "17 " and name "HN ") )( (segid " " and resid "18 " and name "HN ") OR (segid " " and resid "16 " and name "HN ") ) 3.300 3.300 0.000 peak 8069 weight 0.10000E+01 volume 0.27050E+01 ppm1 7.620 ppm2 8.354 ASSI ( (segid " " and resid "18 " and name "HN ") )( (segid " " and resid "30 " and name "HD21") OR (segid " " and resid "29 " and name "HD23") OR (segid " " and resid "29 " and name "HD22") OR (segid " " and resid "29 " and name "HD21") OR (segid " " and resid "29 " and name "HD13") OR (segid " " and resid "29 " and name "HD12") OR (segid " " and resid "29 " and name "HD11") ) 6.000 6.000 0.000 peak 8074 weight 0.10000E+01 volume 0.64000E-01 ppm1 8.369 ppm2 0.767 ASSI ( (segid " " and resid "18 " and name "HN ") )( (segid " " and resid "21 " and name "HA1 ") OR (segid " " and resid "19 " and name "HA ") ) 6.000 6.000 0.000 peak 8075 weight 0.10000E+01 volume 0.12000E+00 ppm1 8.370 ppm2 4.273 ASSI ( (segid " " and resid "18 " and name "HN ") )( (segid " " and resid "26 " and name "HG12") OR (segid " " and resid "14 " and name "HD23") OR (segid " " and resid "14 " and name "HD22") OR (segid " " and resid "14 " and name "HD21") ) 5.000 5.000 0.000 peak 8077 weight 0.10000E+01 volume 0.11920E+01 ppm1 8.363 ppm2 0.920 ASSI ( (segid " " and resid "18 " and name "HN ") )( (segid " " and resid "47 " and name "HA ") OR (segid " " and resid "16 " and name "HA1 ") OR (segid " " and resid "15 " and name "HA ") ) 5.000 5.000 0.000 peak 8078 weight 0.10000E+01 volume 0.57600E+00 ppm1 8.360 ppm2 3.943 ASSI ( (segid " " and resid "19 " and name "HN ") )( (segid " " and resid "51 " and name "HA ") ) 6.000 6.000 0.000 peak 8085 weight 0.10000E+01 volume 0.20700E+00 ppm1 8.965 ppm2 3.447 ASSI ( (segid " " and resid "19 " and name "HN ") )( (segid " " and resid "17 " and name "HA ") ) 6.000 6.000 0.000 peak 8086 weight 0.10000E+01 volume 0.13900E+00 ppm1 8.957 ppm2 4.113 ASSI ( (segid " " and resid "19 " and name "HN ") )( (segid " " and resid "18 " and name "HA ") OR (segid " " and resid "16 " and name "HA2 ") ) 5.000 5.000 0.000 peak 8087 weight 0.10000E+01 volume 0.46300E+00 ppm1 8.964 ppm2 3.846 ASSI ( (segid " " and resid "19 " and name "HN ") )( (segid " " and resid "50 " and name "HG23") OR (segid " " and resid "50 " and name "HG22") OR (segid " " and resid "50 " and name "HG21") ) 5.000 5.000 0.000 peak 8088 weight 0.10000E+01 volume 0.37500E+00 ppm1 8.963 ppm2 0.909 ASSI ( (segid " " and resid "20 " and name "HN ") )( (segid " " and resid "17 " and name "HA ") ) 6.000 6.000 0.000 peak 8096 weight 0.10000E+01 volume 0.14700E+00 ppm1 7.420 ppm2 4.154 ASSI ( (segid " " and resid "21 " and name "HN ") )( (segid " " and resid "52 " and name "HE3 ") OR (segid " " and resid "52 " and name "HE1 ") OR (segid " " and resid "52 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8107 weight 0.10000E+01 volume 0.57400E+00 ppm1 7.905 ppm2 2.090 ASSI ( (segid " " and resid "21 " and name "HN ") )( (segid " " and resid "58 " and name "HG23") OR (segid " " and resid "58 " and name "HG22") OR (segid " " and resid "58 " and name "HG21") ) 5.000 5.000 0.000 peak 8108 weight 0.10000E+01 volume 0.56600E+00 ppm1 7.904 ppm2 0.987 ASSI ( (segid " " and resid "21 " and name "HN ") )( (segid " " and resid "52 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8109 weight 0.10000E+01 volume 0.50000E+00 ppm1 7.904 ppm2 1.850 ASSI ( (segid " " and resid "21 " and name "HN ") )( (segid " " and resid "22 " and name "HB2 ") ) 6.000 6.000 0.000 peak 8110 weight 0.10000E+01 volume 0.12000E+00 ppm1 7.901 ppm2 2.451 ASSI ( (segid " " and resid "22 " and name "HN ") )( (segid " " and resid "20 " and name "HN ") ) 6.000 6.000 0.000 peak 8118 weight 0.10000E+01 volume 0.25100E+00 ppm1 8.155 ppm2 7.413 ASSI ( (segid " " and resid "22 " and name "HN ") )( (segid " " and resid "23 " and name "HN ") OR (segid " " and resid "21 " and name "HN ") ) 5.000 5.000 0.000 peak 8119 weight 0.10000E+01 volume 0.16780E+01 ppm1 8.155 ppm2 7.902 ASSI ( (segid " " and resid "22 " and name "HN ") )( (segid " " and resid "21 " and name "HA2 ") ) 5.000 5.000 0.000 peak 8120 weight 0.10000E+01 volume 0.40500E+00 ppm1 8.153 ppm2 3.556 ASSI ( (segid " " and resid "23 " and name "HN ") )( (segid " " and resid "26 " and name "HB ") OR (segid " " and resid "24 " and name "HB2 ") OR (segid " " and resid "24 " and name "HB1 ") ) 6.000 6.000 0.000 peak 8123 weight 0.10000E+01 volume 0.22300E+00 ppm1 7.880 ppm2 2.200 ASSI ( (segid " " and resid "23 " and name "HN ") )( (segid " " and resid "22 " and name "HB1 ") ) 6.000 6.000 0.000 peak 8124 weight 0.10000E+01 volume 0.56000E-01 ppm1 7.873 ppm2 3.058 ASSI ( (segid " " and resid "23 " and name "HN ") )( (segid " " and resid "24 " and name "HG1 ") OR (segid " " and resid "22 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8125 weight 0.10000E+01 volume 0.30500E+00 ppm1 7.885 ppm2 2.457 ASSI ( (segid " " and resid "23 " and name "HN ") )( (segid " " and resid "23 " and name "HG23") OR (segid " " and resid "23 " and name "HG21") OR (segid " " and resid "23 " and name "HG13") OR (segid " " and resid "23 " and name "HG12") OR (segid " " and resid "23 " and name "HG11") ) 3.300 3.300 0.000 peak 8128 weight 0.10000E+01 volume 0.28860E+01 ppm1 7.876 ppm2 0.929 ASSI ( (segid " " and resid "24 " and name "HN ") )( (segid " " and resid "26 " and name "HN ") OR (segid " " and resid "22 " and name "HN ") ) 6.000 6.000 0.000 peak 8132 weight 0.10000E+01 volume 0.21200E+00 ppm1 8.446 ppm2 8.130 ASSI ( (segid " " and resid "25 " and name "HN ") )( (segid " " and resid "26 " and name "HG13") OR (segid " " and resid "26 " and name "HG12") OR (segid " " and resid "26 " and name "HG11") OR (segid " " and resid "23 " and name "HG23") OR (segid " " and resid "23 " and name "HG22") OR (segid " " and resid "23 " and name "HG21") OR (segid " " and resid "23 " and name "HG13") OR (segid " " and resid "23 " and name "HG12") OR (segid " " and resid "23 " and name "HG11") ) 5.000 5.000 0.000 peak 8146 weight 0.10000E+01 volume 0.34600E+00 ppm1 7.742 ppm2 0.929 ASSI ( (segid " " and resid "25 " and name "HN ") )( (segid " " and resid "23 " and name "HN ") ) 5.000 5.000 0.000 peak 8148 weight 0.10000E+01 volume 0.68800E+00 ppm1 7.741 ppm2 7.867 ASSI ( (segid " " and resid "25 " and name "HN ") )( (segid " " and resid "25 " and name "HG2 ") OR (segid " " and resid "24 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8149 weight 0.10000E+01 volume 0.17040E+01 ppm1 7.742 ppm2 2.164 ASSI ( (segid " " and resid "25 " and name "HN ") )( (segid " " and resid "25 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8150 weight 0.10000E+01 volume 0.18030E+01 ppm1 7.743 ppm2 1.958 ASSI ( (segid " " and resid "25 " and name "HN ") )( (segid " " and resid "26 " and name "HA ") OR (segid " " and resid "23 " and name "HA ") ) 6.000 6.000 0.000 peak 8151 weight 0.10000E+01 volume 0.14500E+00 ppm1 7.750 ppm2 3.362 ASSI ( (segid " " and resid "25 " and name "HN ") )( (segid " " and resid "24 " and name "HG2 ") OR (segid " " and resid "24 " and name "HG1 ") ) 5.000 5.000 0.000 peak 8152 weight 0.10000E+01 volume 0.31800E+00 ppm1 7.739 ppm2 2.480 ASSI ( (segid " " and resid "26 " and name "HN ") )( (segid " " and resid "26 " and name "HA ") OR (segid " " and resid "23 " and name "HA ") ) 5.000 5.000 0.000 peak 8160 weight 0.10000E+01 volume 0.15520E+01 ppm1 8.130 ppm2 3.380 ASSI ( (segid " " and resid "28 " and name "HN ") )( (segid " " and resid "28 " and name "HA ") OR (segid " " and resid "24 " and name "HA ") ) 5.000 5.000 0.000 peak 8165 weight 0.10000E+01 volume 0.19290E+01 ppm1 8.145 ppm2 4.007 ASSI ( (segid " " and resid "29 " and name "HN ") )( (segid " " and resid "35 " and name "HG23") OR (segid " " and resid "35 " and name "HG22") OR (segid " " and resid "35 " and name "HG21") OR (segid " " and resid "35 " and name "HG13") OR (segid " " and resid "35 " and name "HG12") OR (segid " " and resid "35 " and name "HG11") OR (segid " " and resid "26 " and name "HG13") OR (segid " " and resid "26 " and name "HG12") OR (segid " " and resid "26 " and name "HG11") OR (segid " " and resid "14 " and name "HD23") OR (segid " " and resid "14 " and name "HD21") ) 5.000 5.000 0.000 peak 8167 weight 0.10000E+01 volume 0.10560E+01 ppm1 8.570 ppm2 0.932 ASSI ( (segid " " and resid "29 " and name "HN ") )( (segid " " and resid "30 " and name "HN ") OR (segid " " and resid "28 " and name "HN ") ) 5.000 5.000 0.000 peak 8168 weight 0.10000E+01 volume 0.13720E+01 ppm1 8.567 ppm2 8.142 ASSI ( (segid " " and resid "29 " and name "HN ") )( (segid " " and resid "28 " and name "HG2 ") OR (segid " " and resid "25 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8169 weight 0.10000E+01 volume 0.79800E+00 ppm1 8.575 ppm2 1.569 ASSI ( (segid " " and resid "29 " and name "HN ") )( (segid " " and resid "32 " and name "HB2 ") OR (segid " " and resid "26 " and name "HB ") OR (segid " " and resid "25 " and name "HG2 ") ) 5.000 5.000 0.000 peak 8170 weight 0.10000E+01 volume 0.53000E+00 ppm1 8.572 ppm2 2.129 ASSI ( (segid " " and resid "29 " and name "HN ") )( (segid " " and resid "33 " and name "HG1 ") OR (segid " " and resid "25 " and name "HG1 ") ) 6.000 6.000 0.000 peak 8171 weight 0.10000E+01 volume 0.25300E+00 ppm1 8.571 ppm2 2.343 ASSI ( (segid " " and resid "29 " and name "HN ") )( (segid " " and resid "29 " and name "HB1 ") OR (segid " " and resid "28 " and name "HB2 ") OR (segid " " and resid "28 " and name "HB1 ") ) 3.300 3.300 0.000 peak 8172 weight 0.10000E+01 volume 0.26120E+01 ppm1 8.567 ppm2 1.976 ASSI ( (segid " " and resid "30 " and name "HN ") )( (segid " " and resid "32 " and name "HN ") OR (segid " " and resid "27 " and name "HN ") ) 6.000 6.000 0.000 peak 8180 weight 0.10000E+01 volume 0.12500E+00 ppm1 8.145 ppm2 8.394 ASSI ( (segid " " and resid "30 " and name "HN ") )( (segid " " and resid "30 " and name "HD23") OR (segid " " and resid "30 " and name "HD22") OR (segid " " and resid "30 " and name "HD21") OR (segid " " and resid "29 " and name "HD23") OR (segid " " and resid "29 " and name "HD12") OR (segid " " and resid "29 " and name "HD11") OR (segid " " and resid "26 " and name "HG23") ) 5.000 5.000 0.000 peak 8181 weight 0.10000E+01 volume 0.10810E+01 ppm1 8.149 ppm2 0.775 ASSI ( (segid " " and resid "30 " and name "HN ") )( (segid " " and resid "35 " and name "HG23") OR (segid " " and resid "35 " and name "HG21") OR (segid " " and resid "35 " and name "HG12") OR (segid " " and resid "35 " and name "HG11") OR (segid " " and resid "30 " and name "HB2 ") OR (segid " " and resid "14 " and name "HD23") OR (segid " " and resid "14 " and name "HD22") ) 5.000 5.000 0.000 peak 8183 weight 0.10000E+01 volume 0.11400E+01 ppm1 8.149 ppm2 0.966 ASSI ( (segid " " and resid "31 " and name "HN ") )( (segid " " and resid "61 " and name "HB1 ") OR (segid " " and resid "30 " and name "HG ") OR (segid " " and resid "29 " and name "HB1 ") OR (segid " " and resid "28 " and name "HB2 ") OR (segid " " and resid "28 " and name "HB1 ") ) 6.000 6.000 0.000 peak 8192 weight 0.10000E+01 volume 0.24300E+00 ppm1 8.740 ppm2 1.977 ASSI ( (segid " " and resid "31 " and name "HN ") )( (segid " " and resid "29 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8193 weight 0.10000E+01 volume 0.31700E+00 ppm1 8.744 ppm2 1.057 ASSI ( (segid " " and resid "31 " and name "HN ") )( (segid " " and resid "27 " and name "HA ") ) 6.000 6.000 0.000 peak 8194 weight 0.10000E+01 volume 0.48000E-01 ppm1 8.755 ppm2 3.661 ASSI ( (segid " " and resid "31 " and name "HN ") )( (segid " " and resid "29 " and name "HN ") ) 6.000 6.000 0.000 peak 8195 weight 0.10000E+01 volume 0.13300E+00 ppm1 8.747 ppm2 8.542 ASSI ( (segid " " and resid "33 " and name "HN ") )( (segid " " and resid "32 " and name "HA ") OR (segid " " and resid "31 " and name "HA ") ) 6.000 6.000 0.000 peak 8209 weight 0.10000E+01 volume 0.29500E+00 ppm1 7.544 ppm2 4.663 ASSI ( (segid " " and resid "33 " and name "HN ") )( (segid " " and resid "34 " and name "HA ") OR (segid " " and resid "28 " and name "HA ") ) 5.000 5.000 0.000 peak 8210 weight 0.10000E+01 volume 0.45400E+00 ppm1 7.543 ppm2 4.013 ASSI ( (segid " " and resid "33 " and name "HN ") )( (segid " " and resid "32 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8212 weight 0.10000E+01 volume 0.59400E+00 ppm1 7.539 ppm2 2.075 ASSI ( (segid " " and resid "33 " and name "HN ") )( (segid " " and resid "33 " and name "HG2 ") OR (segid " " and resid "32 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8213 weight 0.10000E+01 volume 0.16040E+01 ppm1 7.546 ppm2 2.206 ASSI ( (segid " " and resid "33 " and name "HN ") )( (segid " " and resid "33 " and name "HG1 ") OR (segid " " and resid "33 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8215 weight 0.10000E+01 volume 0.13980E+01 ppm1 7.546 ppm2 2.303 ASSI ( (segid " " and resid "33 " and name "HN ") )( (segid " " and resid "33 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8216 weight 0.10000E+01 volume 0.69200E+00 ppm1 7.546 ppm2 2.425 ASSI ( (segid " " and resid "34 " and name "HN ") )( (segid " " and resid "30 " and name "HA ") ) 6.000 6.000 0.000 peak 8219 weight 0.10000E+01 volume 0.20700E+00 ppm1 6.811 ppm2 4.251 ASSI ( (segid " " and resid "34 " and name "HN ") )( (segid " " and resid "35 " and name "HB ") OR (segid " " and resid "34 " and name "HB2 ") ) 6.000 6.000 0.000 peak 8220 weight 0.10000E+01 volume 0.26100E+00 ppm1 6.813 ppm2 1.604 ASSI ( (segid " " and resid "34 " and name "HN ") )( (segid " " and resid "34 " and name "HB1 ") ) 6.000 6.000 0.000 peak 8221 weight 0.10000E+01 volume 0.21400E+00 ppm1 6.817 ppm2 1.966 ASSI ( (segid " " and resid "34 " and name "HN ") )( (segid " " and resid "35 " and name "HG22") OR (segid " " and resid "35 " and name "HG13") OR (segid " " and resid "35 " and name "HG11") OR (segid " " and resid "34 " and name "HD13") OR (segid " " and resid "34 " and name "HD12") OR (segid " " and resid "34 " and name "HD11") ) 6.000 6.000 0.000 peak 8222 weight 0.10000E+01 volume 0.25800E+00 ppm1 6.815 ppm2 0.948 ASSI ( (segid " " and resid "36 " and name "HN ") )( (segid " " and resid "65 " and name "HG1 ") OR (segid " " and resid "38 " and name "HB2 ") OR (segid " " and resid "37 " and name "HD2 ") ) 6.000 6.000 0.000 peak 8235 weight 0.10000E+01 volume -0.11700E+00 ppm1 8.816 ppm2 2.564 ASSI ( (segid " " and resid "36 " and name "HN ") )( (segid " " and resid "35 " and name "HN ") ) 6.000 6.000 0.000 peak 8236 weight 0.10000E+01 volume -0.12700E+00 ppm1 8.817 ppm2 7.959 ASSI ( (segid " " and resid "36 " and name "HN ") )( (segid " " and resid "39 " and name "HB3 ") OR (segid " " and resid "39 " and name "HB2 ") OR (segid " " and resid "39 " and name "HB1 ") OR (segid " " and resid "14 " and name "HB2 ") ) 6.000 6.000 0.000 peak 8237 weight 0.10000E+01 volume -0.27400E+00 ppm1 8.810 ppm2 1.389 ASSI ( (segid " " and resid "38 " and name "HN ") )( (segid " " and resid "37 " and name "HA ") ) 6.000 6.000 0.000 peak 8244 weight 0.10000E+01 volume 0.19200E+00 ppm1 10.206 ppm2 4.055 ASSI ( (segid " " and resid "38 " and name "HN ") )( (segid " " and resid "36 " and name "HA ") ) 6.000 6.000 0.000 peak 8245 weight 0.10000E+01 volume 0.69000E-01 ppm1 10.205 ppm2 4.366 ASSI ( (segid " " and resid "38 " and name "HN ") )( (segid " " and resid "37 " and name "HG1 ") OR (segid " " and resid "37 " and name "HB2 ") ) 6.000 6.000 0.000 peak 8246 weight 0.10000E+01 volume 0.13400E+00 ppm1 10.208 ppm2 1.697 ASSI ( (segid " " and resid "39 " and name "HN ") )( (segid " " and resid "40 " and name "HN ") OR (segid " " and resid "15 " and name "HN ") ) 6.000 6.000 0.000 peak 8252 weight 0.10000E+01 volume 0.17300E+00 ppm1 7.860 ppm2 8.289 ASSI ( (segid " " and resid "39 " and name "HN ") )( (segid " " and resid "62 " and name "HD23") OR (segid " " and resid "62 " and name "HD22") OR (segid " " and resid "62 " and name "HD21") OR (segid " " and resid "40 " and name "HD13") OR (segid " " and resid "40 " and name "HD12") OR (segid " " and resid "40 " and name "HD11") OR (segid " " and resid "35 " and name "HG23") OR (segid " " and resid "35 " and name "HG22") OR (segid " " and resid "35 " and name "HG21") OR (segid " " and resid "35 " and name "HG13") OR (segid " " and resid "35 " and name "HG11") OR (segid " " and resid "14 " and name "HD23") OR (segid " " and resid "14 " and name "HD21") ) 5.000 5.000 0.000 peak 8253 weight 0.10000E+01 volume 0.52000E+00 ppm1 7.859 ppm2 0.930 ASSI ( (segid " " and resid "39 " and name "HN ") )( (segid " " and resid "35 " and name "HG21") OR (segid " " and resid "14 " and name "HD13") OR (segid " " and resid "14 " and name "HD12") OR (segid " " and resid "14 " and name "HD11") ) 5.000 5.000 0.000 peak 8254 weight 0.10000E+01 volume 0.56900E+00 ppm1 7.859 ppm2 0.984 ASSI ( (segid " " and resid "39 " and name "HN ") )( (segid " " and resid "41 " and name "HN ") OR (segid " " and resid "36 " and name "HN ") OR (segid " " and resid "11 " and name "HN ") ) 6.000 6.000 0.000 peak 8255 weight 0.10000E+01 volume 0.12000E+00 ppm1 7.868 ppm2 8.801 ASSI ( (segid " " and resid "39 " and name "HN ") )( (segid " " and resid "36 " and name "HB2 ") ) 6.000 6.000 0.000 peak 8256 weight 0.10000E+01 volume 0.25500E+00 ppm1 7.866 ppm2 2.880 ASSI ( (segid " " and resid "40 " and name "HN ") )( (segid " " and resid "10 " and name "HG23") OR (segid " " and resid "10 " and name "HG22") OR (segid " " and resid "10 " and name "HG12") OR (segid " " and resid "10 " and name "HG11") ) 5.000 5.000 0.000 peak 8263 weight 0.10000E+01 volume 0.40800E+00 ppm1 8.305 ppm2 1.151 ASSI ( (segid " " and resid "40 " and name "HN ") )( (segid " " and resid "40 " and name "HG ") OR (segid " " and resid "40 " and name "HB1 ") ) 3.300 3.300 0.000 peak 8266 weight 0.10000E+01 volume 0.29800E+01 ppm1 8.300 ppm2 1.782 ASSI ( (segid " " and resid "42 " and name "HN ") )( (segid " " and resid "41 " and name "HA ") ) 5.000 5.000 0.000 peak 8283 weight 0.10000E+01 volume 0.63500E+00 ppm1 9.848 ppm2 4.483 ASSI ( (segid " " and resid "44 " and name "HN ") )( (segid " " and resid "40 " and name "HD13") OR (segid " " and resid "40 " and name "HD12") OR (segid " " and resid "40 " and name "HD11") ) 6.000 6.000 0.000 peak 8299 weight 0.10000E+01 volume 0.15000E+00 ppm1 8.494 ppm2 0.922 ASSI ( (segid " " and resid "44 " and name "HN ") )( (segid " " and resid "40 " and name "HB2 ") ) 6.000 6.000 0.000 peak 8300 weight 0.10000E+01 volume 0.18600E+00 ppm1 8.497 ppm2 1.272 ASSI ( (segid " " and resid "44 " and name "HN ") )( (segid " " and resid "40 " and name "HA ") ) 5.000 5.000 0.000 peak 8301 weight 0.10000E+01 volume 0.10300E+01 ppm1 8.496 ppm2 4.284 ASSI ( (segid " " and resid "44 " and name "HN ") )( (segid " " and resid "43 " and name "HA ") ) 5.000 5.000 0.000 peak 8303 weight 0.10000E+01 volume 0.37000E+00 ppm1 8.490 ppm2 4.837 ASSI ( (segid " " and resid "45 " and name "HN ") )( (segid " " and resid "40 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8311 weight 0.10000E+01 volume 0.36300E+00 ppm1 7.453 ppm2 1.274 ASSI ( (segid " " and resid "46 " and name "HN ") )( (segid " " and resid "40 " and name "HD23") OR (segid " " and resid "40 " and name "HD22") OR (segid " " and resid "40 " and name "HD21") ) 6.000 6.000 0.000 peak 8322 weight 0.10000E+01 volume 0.15300E+00 ppm1 9.203 ppm2 0.671 ASSI ( (segid " " and resid "46 " and name "HN ") )( (segid " " and resid "45 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8323 weight 0.10000E+01 volume 0.42100E+00 ppm1 9.208 ppm2 1.859 ASSI ( (segid " " and resid "46 " and name "HN ") )( (segid " " and resid "49 " and name "HG1 ") ) 6.000 6.000 0.000 peak 8324 weight 0.10000E+01 volume 0.24400E+00 ppm1 9.211 ppm2 2.709 ASSI ( (segid " " and resid "46 " and name "HN ") )( (segid " " and resid "45 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8325 weight 0.10000E+01 volume 0.40600E+00 ppm1 9.203 ppm2 1.547 ASSI ( (segid " " and resid "46 " and name "HN ") )( (segid " " and resid "50 " and name "HG23") OR (segid " " and resid "50 " and name "HG22") OR (segid " " and resid "50 " and name "HG21") OR (segid " " and resid "50 " and name "HG13") OR (segid " " and resid "50 " and name "HG12") ) 6.000 6.000 0.000 peak 8326 weight 0.10000E+01 volume 0.20100E+00 ppm1 9.212 ppm2 0.857 ASSI ( (segid " " and resid "47 " and name "HN ") )( (segid " " and resid "47 " and name "HA ") OR (segid " " and resid "15 " and name "HB2 ") ) 6.000 6.000 0.000 peak 8331 weight 0.10000E+01 volume 0.23900E+00 ppm1 10.265 ppm2 3.947 ASSI ( (segid " " and resid "48 " and name "HN ") )( (segid " " and resid "62 " and name "HD13") OR (segid " " and resid "62 " and name "HD12") OR (segid " " and resid "62 " and name "HD11") ) 5.000 5.000 0.000 peak 8335 weight 0.10000E+01 volume 0.59400E+00 ppm1 8.375 ppm2 0.671 ASSI ( (segid " " and resid "49 " and name "HN ") )( (segid " " and resid "51 " and name "HG2 ") OR (segid " " and resid "47 " and name "HB3 ") OR (segid " " and resid "47 " and name "HB2 ") OR (segid " " and resid "47 " and name "HB1 ") OR (segid " " and resid "46 " and name "HG23") OR (segid " " and resid "46 " and name "HG22") OR (segid " " and resid "46 " and name "HG21") ) 6.000 6.000 0.000 peak 8342 weight 0.10000E+01 volume 0.14800E+00 ppm1 7.385 ppm2 1.201 ASSI ( (segid " " and resid "49 " and name "HN ") )( (segid " " and resid "48 " and name "HB1 ") ) 6.000 6.000 0.000 peak 8343 weight 0.10000E+01 volume 0.22600E+00 ppm1 7.384 ppm2 1.536 ASSI ( (segid " " and resid "49 " and name "HN ") )( (segid " " and resid "62 " and name "HB1 ") OR (segid " " and resid "45 " and name "HB1 ") ) 6.000 6.000 0.000 peak 8344 weight 0.10000E+01 volume 0.21100E+00 ppm1 7.371 ppm2 1.867 ASSI ( (segid " " and resid "49 " and name "HN ") )( (segid " " and resid "71 " and name "HG13") OR (segid " " and resid "71 " and name "HG12") OR (segid " " and resid "71 " and name "HG11") OR (segid " " and resid "50 " and name "HG13") OR (segid " " and resid "50 " and name "HG12") OR (segid " " and resid "50 " and name "HG11") OR (segid " " and resid "48 " and name "HD23") OR (segid " " and resid "48 " and name "HD22") OR (segid " " and resid "48 " and name "HD12") OR (segid " " and resid "48 " and name "HD11") ) 5.000 5.000 0.000 peak 8345 weight 0.10000E+01 volume 0.64100E+00 ppm1 7.378 ppm2 0.840 ASSI ( (segid " " and resid "50 " and name "HN ") )( (segid " " and resid "49 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8355 weight 0.10000E+01 volume 0.31400E+00 ppm1 7.186 ppm2 2.572 ASSI ( (segid " " and resid "50 " and name "HN ") )( (segid " " and resid "49 " and name "HA ") ) 6.000 6.000 0.000 peak 8356 weight 0.10000E+01 volume 0.11100E+00 ppm1 7.183 ppm2 4.187 ASSI ( (segid " " and resid "50 " and name "HN ") )( (segid " " and resid "47 " and name "HA ") OR (segid " " and resid "15 " and name "HB2 ") ) 6.000 6.000 0.000 peak 8357 weight 0.10000E+01 volume 0.27300E+00 ppm1 7.189 ppm2 3.950 ASSI ( (segid " " and resid "51 " and name "HN ") )( (segid " " and resid "18 " and name "HB3 ") OR (segid " " and resid "18 " and name "HB2 ") OR (segid " " and resid "18 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8363 weight 0.10000E+01 volume 0.51000E+00 ppm1 6.855 ppm2 1.317 ASSI ( (segid " " and resid "51 " and name "HN ") )( (segid " " and resid "48 " and name "HA ") ) 6.000 6.000 0.000 peak 8364 weight 0.10000E+01 volume 0.23600E+00 ppm1 6.845 ppm2 3.785 ASSI ( (segid " " and resid "52 " and name "HN ") )( (segid " " and resid "52 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8373 weight 0.10000E+01 volume 0.10870E+01 ppm1 7.135 ppm2 2.092 ASSI ( (segid " " and resid "52 " and name "HN ") )( (segid " " and resid "19 " and name "HB3 ") OR (segid " " and resid "19 " and name "HB2 ") OR (segid " " and resid "19 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8374 weight 0.10000E+01 volume 0.41100E+00 ppm1 7.131 ppm2 1.540 ASSI ( (segid " " and resid "52 " and name "HN ") )( (segid " " and resid "54 " and name "HN ") OR (segid " " and resid "21 " and name "HN ") ) 6.000 6.000 0.000 peak 8375 weight 0.10000E+01 volume 0.14500E+00 ppm1 7.133 ppm2 7.902 ASSI ( (segid " " and resid "52 " and name "HN ") )( (segid " " and resid "18 " and name "HB3 ") OR (segid " " and resid "18 " and name "HB2 ") OR (segid " " and resid "18 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8376 weight 0.10000E+01 volume 0.58200E+00 ppm1 7.129 ppm2 1.308 ASSI ( (segid " " and resid "53 " and name "HN ") )( (segid " " and resid "52 " and name "HE3 ") OR (segid " " and resid "52 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8381 weight 0.10000E+01 volume -0.31400E+00 ppm1 8.301 ppm2 2.137 ASSI ( (segid " " and resid "55 " and name "HN ") )( (segid " " and resid "56 " and name "HD2 ") OR (segid " " and resid "20 " and name "HD1 ") ) 6.000 6.000 0.000 peak 8393 weight 0.10000E+01 volume 0.15900E+00 ppm1 7.499 ppm2 3.372 ASSI ( (segid " " and resid "55 " and name "HN ") )( (segid " " and resid "52 " and name "HE3 ") OR (segid " " and resid "52 " and name "HE2 ") OR (segid " " and resid "52 " and name "HE1 ") OR (segid " " and resid "52 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8394 weight 0.10000E+01 volume 0.51700E+00 ppm1 7.500 ppm2 2.139 ASSI ( (segid " " and resid "55 " and name "HN ") )( (segid " " and resid "53 " and name "HN ") ) 6.000 6.000 0.000 peak 8395 weight 0.10000E+01 volume 0.27000E+00 ppm1 7.500 ppm2 8.312 ASSI ( (segid " " and resid "57 " and name "HN ") )( (segid " " and resid "56 " and name "HD1 ") OR (segid " " and resid "55 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8402 weight 0.10000E+01 volume 0.39000E+00 ppm1 8.048 ppm2 3.983 ASSI ( (segid " " and resid "57 " and name "HN ") )( (segid " " and resid "94 " and name "HG22") OR (segid " " and resid "58 " and name "HG23") OR (segid " " and resid "58 " and name "HG22") OR (segid " " and resid "58 " and name "HG21") OR (segid " " and resid "58 " and name "HG13") OR (segid " " and resid "58 " and name "HG11") OR (segid " " and resid "23 " and name "HG23") OR (segid " " and resid "23 " and name "HG22") OR (segid " " and resid "23 " and name "HG21") OR (segid " " and resid "23 " and name "HG13") OR (segid " " and resid "23 " and name "HG12") OR (segid " " and resid "23 " and name "HG11") ) 5.000 5.000 0.000 peak 8403 weight 0.10000E+01 volume 0.31000E+00 ppm1 8.048 ppm2 0.944 ASSI ( (segid " " and resid "57 " and name "HN ") )( (segid " " and resid "55 " and name "HA ") ) 6.000 6.000 0.000 peak 8404 weight 0.10000E+01 volume 0.14900E+00 ppm1 8.044 ppm2 5.060 ASSI ( (segid " " and resid "57 " and name "HN ") )( (segid " " and resid "56 " and name "HA ") ) 6.000 6.000 0.000 peak 8406 weight 0.10000E+01 volume 0.21400E+00 ppm1 8.046 ppm2 4.300 ASSI ( (segid " " and resid "58 " and name "HN ") )( (segid " " and resid "62 " and name "HG ") OR (segid " " and resid "51 " and name "HE3 ") OR (segid " " and resid "51 " and name "HE2 ") OR (segid " " and resid "51 " and name "HE1 ") OR (segid " " and resid "27 " and name "HG1 ") ) 6.000 6.000 0.000 peak 8413 weight 0.10000E+01 volume 0.24200E+00 ppm1 7.804 ppm2 1.679 ASSI ( (segid " " and resid "59 " and name "HN ") )( (segid " " and resid "58 " and name "HG22") OR (segid " " and resid "58 " and name "HG21") OR (segid " " and resid "58 " and name "HG12") OR (segid " " and resid "58 " and name "HG11") ) 5.000 5.000 0.000 peak 8421 weight 0.10000E+01 volume 0.12750E+01 ppm1 7.066 ppm2 0.959 ASSI ( (segid " " and resid "59 " and name "HN ") )( (segid " " and resid "51 " and name "HE3 ") OR (segid " " and resid "51 " and name "HE2 ") OR (segid " " and resid "51 " and name "HE1 ") ) 6.000 6.000 0.000 peak 8422 weight 0.10000E+01 volume 0.26200E+00 ppm1 7.072 ppm2 1.684 ASSI ( (segid " " and resid "59 " and name "HN ") )( (segid " " and resid "91 " and name "HG23") OR (segid " " and resid "91 " and name "HG22") OR (segid " " and resid "91 " and name "HG21") ) 6.000 6.000 0.000 peak 8423 weight 0.10000E+01 volume 0.26500E+00 ppm1 7.069 ppm2 1.152 ASSI ( (segid " " and resid "59 " and name "HN ") )( (segid " " and resid "57 " and name "HB3 ") OR (segid " " and resid "57 " and name "HB2 ") OR (segid " " and resid "57 " and name "HB1 ") OR (segid " " and resid "51 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8424 weight 0.10000E+01 volume 0.38000E+00 ppm1 7.064 ppm2 1.427 ASSI ( (segid " " and resid "60 " and name "HN ") )( (segid " " and resid "94 " and name "HG23") OR (segid " " and resid "94 " and name "HG22") OR (segid " " and resid "94 " and name "HG21") OR (segid " " and resid "60 " and name "HD21") OR (segid " " and resid "60 " and name "HD12") ) 5.000 5.000 0.000 peak 8436 weight 0.10000E+01 volume 0.18740E+01 ppm1 8.386 ppm2 0.958 ASSI ( (segid " " and resid "61 " and name "HN ") )( (segid " " and resid "60 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8441 weight 0.10000E+01 volume 0.58800E+00 ppm1 7.636 ppm2 1.637 ASSI ( (segid " " and resid "61 " and name "HN ") )( (segid " " and resid "94 " and name "HG23") OR (segid " " and resid "60 " and name "HD23") OR (segid " " and resid "60 " and name "HD22") OR (segid " " and resid "60 " and name "HD21") OR (segid " " and resid "60 " and name "HD13") OR (segid " " and resid "60 " and name "HD12") OR (segid " " and resid "60 " and name "HD11") OR (segid " " and resid "58 " and name "HG12") OR (segid " " and resid "26 " and name "HG13") OR (segid " " and resid "26 " and name "HG12") OR (segid " " and resid "26 " and name "HG11") ) 5.000 5.000 0.000 peak 8443 weight 0.10000E+01 volume 0.61400E+00 ppm1 7.634 ppm2 0.944 ASSI ( (segid " " and resid "62 " and name "HN ") )( (segid " " and resid "62 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8452 weight 0.10000E+01 volume 0.78500E+00 ppm1 7.504 ppm2 1.151 ASSI ( (segid " " and resid "62 " and name "HN ") )( (segid " " and resid "63 " and name "HD21") OR (segid " " and resid "48 " and name "HD23") OR (segid " " and resid "48 " and name "HD22") OR (segid " " and resid "48 " and name "HD21") OR (segid " " and resid "30 " and name "HD23") OR (segid " " and resid "30 " and name "HD21") OR (segid " " and resid "26 " and name "HG23") OR (segid " " and resid "26 " and name "HG22") OR (segid " " and resid "26 " and name "HG21") ) 5.000 5.000 0.000 peak 8453 weight 0.10000E+01 volume 0.70500E+00 ppm1 7.509 ppm2 0.807 ASSI ( (segid " " and resid "62 " and name "HN ") )( (segid " " and resid "62 " and name "HD23") OR (segid " " and resid "62 " and name "HD22") OR (segid " " and resid "62 " and name "HD21") ) 5.000 5.000 0.000 peak 8454 weight 0.10000E+01 volume 0.83600E+00 ppm1 7.499 ppm2 0.914 ASSI ( (segid " " and resid "62 " and name "HN ") )( (segid " " and resid "62 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8455 weight 0.10000E+01 volume 0.72800E+00 ppm1 7.505 ppm2 1.204 ASSI ( (segid " " and resid "62 " and name "HN ") )( (segid " " and resid "61 " and name "HB2 ") OR (segid " " and resid "61 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8456 weight 0.10000E+01 volume 0.91700E+00 ppm1 7.506 ppm2 1.967 ASSI ( (segid " " and resid "62 " and name "HN ") )( (segid " " and resid "62 " and name "HD13") OR (segid " " and resid "62 " and name "HD12") OR (segid " " and resid "30 " and name "HD13") OR (segid " " and resid "30 " and name "HD12") OR (segid " " and resid "30 " and name "HD11") ) 5.000 5.000 0.000 peak 8459 weight 0.10000E+01 volume 0.57600E+00 ppm1 7.510 ppm2 0.673 ASSI ( (segid " " and resid "63 " and name "HN ") )( (segid " " and resid "63 " and name "HB1 ") OR (segid " " and resid "62 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8464 weight 0.10000E+01 volume 0.12760E+01 ppm1 8.594 ppm2 1.207 ASSI ( (segid " " and resid "63 " and name "HN ") )( (segid " " and resid "63 " and name "HD21") OR (segid " " and resid "63 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8468 weight 0.10000E+01 volume 0.17940E+01 ppm1 8.593 ppm2 0.849 ASSI ( (segid " " and resid "64 " and name "HN ") )( (segid " " and resid "60 " and name "HD23") OR (segid " " and resid "60 " and name "HD22") OR (segid " " and resid "60 " and name "HD21") OR (segid " " and resid "60 " and name "HD13") OR (segid " " and resid "60 " and name "HD12") ) 5.000 5.000 0.000 peak 8473 weight 0.10000E+01 volume 0.53800E+00 ppm1 8.961 ppm2 0.958 ASSI ( (segid " " and resid "64 " and name "HN ") )( (segid " " and resid "60 " and name "HA ") ) 6.000 6.000 0.000 peak 8474 weight 0.10000E+01 volume 0.20800E+00 ppm1 8.954 ppm2 3.652 ASSI ( (segid " " and resid "64 " and name "HN ") )( (segid " " and resid "66 " and name "HN ") OR (segid " " and resid "61 " and name "HN ") ) 6.000 6.000 0.000 peak 8475 weight 0.10000E+01 volume 0.14500E+00 ppm1 8.953 ppm2 7.636 ASSI ( (segid " " and resid "64 " and name "HN ") )( (segid " " and resid "63 " and name "HA ") OR (segid " " and resid "61 " and name "HA ") ) 5.000 5.000 0.000 peak 8476 weight 0.10000E+01 volume 0.38700E+00 ppm1 8.952 ppm2 3.878 ASSI ( (segid " " and resid "64 " and name "HN ") )( (segid " " and resid "63 " and name "HA ") OR (segid " " and resid "61 " and name "HA ") ) 5.000 5.000 0.000 peak 8478 weight 0.10000E+01 volume 0.39500E+00 ppm1 8.952 ppm2 3.901 ASSI ( (segid " " and resid "65 " and name "HN ") )( (segid " " and resid "66 " and name "HA2 ") OR (segid " " and resid "62 " and name "HA ") ) 6.000 6.000 0.000 peak 8488 weight 0.10000E+01 volume 0.14000E+00 ppm1 7.003 ppm2 3.754 ASSI ( (segid " " and resid "65 " and name "HN ") )( (segid " " and resid "64 " and name "HA ") ) 5.000 5.000 0.000 peak 8489 weight 0.10000E+01 volume 0.35200E+00 ppm1 7.006 ppm2 4.095 ASSI ( (segid " " and resid "65 " and name "HN ") )( (segid " " and resid "30 " and name "HD13") OR (segid " " and resid "30 " and name "HD12") OR (segid " " and resid "30 " and name "HD11") ) 6.000 6.000 0.000 peak 8490 weight 0.10000E+01 volume 0.20600E+00 ppm1 7.002 ppm2 0.674 ASSI ( (segid " " and resid "65 " and name "HN ") )( (segid " " and resid "64 " and name "HD2 ") OR (segid " " and resid "64 " and name "HG2 ") OR (segid " " and resid "64 " and name "HG1 ") OR (segid " " and resid "37 " and name "HG1 ") ) 6.000 6.000 0.000 peak 8491 weight 0.10000E+01 volume 0.24400E+00 ppm1 7.005 ppm2 1.654 ASSI ( (segid " " and resid "65 " and name "HE21") )( (segid " " and resid "65 " and name "HE22") ) 2.700 2.700 0.000 peak 8501 weight 0.10000E+01 volume 0.94450E+01 ppm1 7.286 ppm2 6.796 ASSI ( (segid " " and resid "65 " and name "HE21") )( (segid " " and resid "65 " and name "HG1 ") OR (segid " " and resid "37 " and name "HD2 ") ) 5.000 5.000 0.000 peak 8503 weight 0.10000E+01 volume 0.42400E+00 ppm1 7.279 ppm2 2.563 ASSI ( (segid " " and resid "65 " and name "HE21") )( (segid " " and resid "65 " and name "HG2 ") ) 5.000 5.000 0.000 peak 8504 weight 0.10000E+01 volume 0.38600E+00 ppm1 7.276 ppm2 2.456 ASSI ( (segid " " and resid "65 " and name "HE22") )( (segid " " and resid "65 " and name "HE21") ) 2.700 2.700 0.000 peak 8505 weight 0.10000E+01 volume 0.14511E+02 ppm1 6.794 ppm2 7.285 ASSI ( (segid " " and resid "66 " and name "HN ") )( (segid " " and resid "65 " and name "HN ") ) 5.000 5.000 0.000 peak 8508 weight 0.10000E+01 volume -0.10560E+01 ppm1 7.594 ppm2 6.994 ASSI ( (segid " " and resid "67 " and name "HN ") )( (segid " " and resid "63 " and name "HA ") ) 5.000 5.000 0.000 peak 8510 weight 0.10000E+01 volume 0.19330E+01 ppm1 8.027 ppm2 3.897 ASSI ( (segid " " and resid "67 " and name "HN ") )( (segid " " and resid "37 " and name "HG1 ") OR (segid " " and resid "37 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8511 weight 0.10000E+01 volume 0.12440E+01 ppm1 8.025 ppm2 1.678 ASSI ( (segid " " and resid "67 " and name "HN ") )( (segid " " and resid "63 " and name "HD23") OR (segid " " and resid "63 " and name "HD22") OR (segid " " and resid "63 " and name "HD21") OR (segid " " and resid "62 " and name "HD23") OR (segid " " and resid "62 " and name "HD22") OR (segid " " and resid "62 " and name "HD21") OR (segid " " and resid "48 " and name "HD12") ) 5.000 5.000 0.000 peak 8512 weight 0.10000E+01 volume 0.85000E+00 ppm1 8.031 ppm2 0.851 ASSI ( (segid " " and resid "68 " and name "HN ") )( (segid " " and resid "68 " and name "HB2 ") OR (segid " " and resid "68 " and name "HB1 ") OR (segid " " and resid "67 " and name "HA ") ) 3.300 3.300 0.000 peak 8519 weight 0.10000E+01 volume 0.36540E+01 ppm1 10.195 ppm2 4.020 ASSI ( (segid " " and resid "68 " and name "HN ") )( (segid " " and resid "68 " and name "HB2 ") OR (segid " " and resid "68 " and name "HB1 ") ) 3.300 3.300 0.000 peak 8521 weight 0.10000E+01 volume 0.35800E+01 ppm1 10.196 ppm2 3.973 ASSI ( (segid " " and resid "70 " and name "HN ") )( (segid " " and resid "71 " and name "HG13") OR (segid " " and resid "71 " and name "HG12") OR (segid " " and resid "71 " and name "HG11") OR (segid " " and resid "48 " and name "HD13") OR (segid " " and resid "48 " and name "HD11") ) 5.000 5.000 0.000 peak 8522 weight 0.10000E+01 volume 0.74400E+00 ppm1 7.985 ppm2 0.834 ASSI ( (segid " " and resid "70 " and name "HN ") )( (segid " " and resid "71 " and name "HG23") OR (segid " " and resid "71 " and name "HG22") OR (segid " " and resid "71 " and name "HG21") ) 5.000 5.000 0.000 peak 8523 weight 0.10000E+01 volume 0.77800E+00 ppm1 7.985 ppm2 0.919 ASSI ( (segid " " and resid "70 " and name "HN ") )( (segid " " and resid "71 " and name "HN ") OR (segid " " and resid "70 " and name "HD22") ) 5.000 5.000 0.000 peak 8524 weight 0.10000E+01 volume 0.78400E+00 ppm1 7.985 ppm2 6.884 ASSI ( (segid " " and resid "70 " and name "HN ") )( (segid " " and resid "68 " and name "HB2 ") OR (segid " " and resid "68 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8526 weight 0.10000E+01 volume 0.83800E+00 ppm1 7.980 ppm2 3.973 ASSI ( (segid " " and resid "70 " and name "HN ") )( (segid " " and resid "69 " and name "HG2 ") ) 5.000 5.000 0.000 peak 8527 weight 0.10000E+01 volume 0.58100E+00 ppm1 7.981 ppm2 1.820 ASSI ( (segid " " and resid "70 " and name "HN ") )( (segid " " and resid "69 " and name "HD2 ") OR (segid " " and resid "69 " and name "HD1 ") ) 5.000 5.000 0.000 peak 8528 weight 0.10000E+01 volume 0.10610E+01 ppm1 7.981 ppm2 4.095 ASSI ( (segid " " and resid "70 " and name "HD22") )( (segid " " and resid "101 " and name "HB1 ") OR (segid " " and resid "70 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8533 weight 0.10000E+01 volume 0.49300E+00 ppm1 6.882 ppm2 2.800 ASSI ( (segid " " and resid "70 " and name "HD22") )( (segid " " and resid "70 " and name "HD21") ) 3.300 3.300 0.000 peak 8535 weight 0.10000E+01 volume 0.29340E+01 ppm1 6.884 ppm2 7.864 ASSI ( (segid " " and resid "71 " and name "HN ") )( (segid " " and resid "78 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8536 weight 0.10000E+01 volume 0.59800E+00 ppm1 6.892 ppm2 4.418 ASSI ( (segid " " and resid "71 " and name "HN ") )( (segid " " and resid "78 " and name "HA ") ) 6.000 6.000 0.000 peak 8537 weight 0.10000E+01 volume 0.89000E-01 ppm1 6.876 ppm2 5.831 ASSI ( (segid " " and resid "72 " and name "HE21") )( (segid " " and resid "72 " and name "HG2 ") OR (segid " " and resid "72 " and name "HG1 ") ) 5.000 5.000 0.000 peak 8557 weight 0.10000E+01 volume 0.11520E+01 ppm1 7.809 ppm2 2.250 ASSI ( (segid " " and resid "72 " and name "HE21") )( (segid " " and resid "72 " and name "HE22") ) 2.700 2.700 0.000 peak 8558 weight 0.10000E+01 volume 0.13421E+02 ppm1 7.807 ppm2 6.729 ASSI ( (segid " " and resid "72 " and name "HE22") )( (segid " " and resid "72 " and name "HE21") ) 2.700 2.700 0.000 peak 8559 weight 0.10000E+01 volume 0.12962E+02 ppm1 6.730 ppm2 7.805 ASSI ( (segid " " and resid "77 " and name "HN ") )( (segid " " and resid "77 " and name "HB ") OR (segid " " and resid "76 " and name "HA1 ") ) 3.300 3.300 0.000 peak 8578 weight 0.10000E+01 volume 0.33270E+01 ppm1 8.154 ppm2 4.247 ASSI ( (segid " " and resid "77 " and name "HN ") )( (segid " " and resid "77 " and name "HA ") OR (segid " " and resid "76 " and name "HA2 ") ) 5.000 5.000 0.000 peak 8579 weight 0.10000E+01 volume 0.14280E+01 ppm1 8.151 ppm2 3.781 ASSI ( (segid " " and resid "80 " and name "HN ") )( (segid " " and resid "80 " and name "HG13") OR (segid " " and resid "80 " and name "HG12") OR (segid " " and resid "80 " and name "HG11") ) 3.300 3.300 0.000 peak 8591 weight 0.10000E+01 volume 0.34450E+01 ppm1 8.463 ppm2 0.886 ASSI ( (segid " " and resid "80 " and name "HN ") )( (segid " " and resid "78 " and name "HB1 ") ) 6.000 6.000 0.000 peak 8592 weight 0.10000E+01 volume 0.26600E+00 ppm1 8.461 ppm2 4.440 ASSI ( (segid " " and resid "80 " and name "HN ") )( (segid " " and resid "79 " and name "HD2 ") OR (segid " " and resid "78 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8593 weight 0.10000E+01 volume 0.78300E+00 ppm1 8.462 ppm2 4.298 ASSI ( (segid " " and resid "80 " and name "HN ") )( (segid " " and resid "80 " and name "HG23") OR (segid " " and resid "80 " and name "HG22") ) 3.300 3.300 0.000 peak 8594 weight 0.10000E+01 volume 0.30860E+01 ppm1 8.464 ppm2 0.810 ASSI ( (segid " " and resid "80 " and name "HN ") )( (segid " " and resid "79 " and name "HG2 ") OR (segid " " and resid "79 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8595 weight 0.10000E+01 volume 0.17830E+01 ppm1 8.463 ppm2 1.984 ASSI ( (segid " " and resid "81 " and name "HN ") )( (segid " " and resid "79 " and name "HD2 ") OR (segid " " and resid "78 " and name "HB2 ") OR (segid " " and resid "77 " and name "HB ") ) 6.000 6.000 0.000 peak 8600 weight 0.10000E+01 volume 0.26600E+00 ppm1 7.711 ppm2 4.291 ASSI ( (segid " " and resid "81 " and name "HN ") )( (segid " " and resid "115 " and name "HD13") OR (segid " " and resid "115 " and name "HD12") OR (segid " " and resid "77 " and name "HG23") OR (segid " " and resid "77 " and name "HG22") OR (segid " " and resid "77 " and name "HG21") ) 5.000 5.000 0.000 peak 8601 weight 0.10000E+01 volume 0.62800E+00 ppm1 7.715 ppm2 1.238 ASSI ( (segid " " and resid "81 " and name "HN ") )( (segid " " and resid "78 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8602 weight 0.10000E+01 volume 0.40400E+00 ppm1 7.711 ppm2 4.461 ASSI ( (segid " " and resid "81 " and name "HN ") )( (segid " " and resid "80 " and name "HA ") ) 5.000 5.000 0.000 peak 8605 weight 0.10000E+01 volume 0.96500E+00 ppm1 7.711 ppm2 3.688 ASSI ( (segid " " and resid "81 " and name "HN ") )( (segid " " and resid "80 " and name "HG22") OR (segid " " and resid "80 " and name "HG13") OR (segid " " and resid "80 " and name "HG12") OR (segid " " and resid "80 " and name "HG11") ) 5.000 5.000 0.000 peak 8606 weight 0.10000E+01 volume 0.10700E+01 ppm1 7.716 ppm2 0.863 ASSI ( (segid " " and resid "82 " and name "HN ") )( (segid " " and resid "81 " and name "HA ") ) 5.000 5.000 0.000 peak 8617 weight 0.10000E+01 volume 0.71200E+00 ppm1 7.365 ppm2 3.868 ASSI ( (segid " " and resid "82 " and name "HN ") )( (segid " " and resid "77 " and name "HG23") OR (segid " " and resid "77 " and name "HG22") OR (segid " " and resid "77 " and name "HG21") ) 5.000 5.000 0.000 peak 8618 weight 0.10000E+01 volume 0.76600E+00 ppm1 7.362 ppm2 1.240 ASSI ( (segid " " and resid "83 " and name "HN ") )( (segid " " and resid "80 " and name "HA ") ) 5.000 5.000 0.000 peak 8627 weight 0.10000E+01 volume 0.48200E+00 ppm1 8.757 ppm2 3.665 ASSI ( (segid " " and resid "83 " and name "HN ") )( (segid " " and resid "82 " and name "HA ") ) 6.000 6.000 0.000 peak 8628 weight 0.10000E+01 volume 0.28900E+00 ppm1 8.752 ppm2 4.460 ASSI ( (segid " " and resid "84 " and name "HN ") )( (segid " " and resid "80 " and name "HA ") ) 6.000 6.000 0.000 peak 8635 weight 0.10000E+01 volume 0.29200E+00 ppm1 7.848 ppm2 3.682 ASSI ( (segid " " and resid "84 " and name "HN ") )( (segid " " and resid "128 " and name "HG ") OR (segid " " and resid "115 " and name "HG ") OR (segid " " and resid "92 " and name "HB1 ") OR (segid " " and resid "85 " and name "HB2 ") OR (segid " " and resid "85 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8636 weight 0.10000E+01 volume 0.49100E+00 ppm1 7.836 ppm2 2.053 ASSI ( (segid " " and resid "85 " and name "HN ") )( (segid " " and resid "124 " and name "HG23") OR (segid " " and resid "124 " and name "HG22") OR (segid " " and resid "124 " and name "HG21") OR (segid " " and resid "124 " and name "HG13") OR (segid " " and resid "124 " and name "HG12") OR (segid " " and resid "124 " and name "HG11") OR (segid " " and resid "92 " and name "HD23") OR (segid " " and resid "92 " and name "HD22") OR (segid " " and resid "92 " and name "HD21") OR (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") OR (segid " " and resid "92 " and name "HD11") ) 6.000 6.000 0.000 peak 8643 weight 0.10000E+01 volume 0.22800E+00 ppm1 8.635 ppm2 0.964 ASSI ( (segid " " and resid "85 " and name "HN ") )( (segid " " and resid "86 " and name "HG23") OR (segid " " and resid "86 " and name "HG22") OR (segid " " and resid "86 " and name "HG21") OR (segid " " and resid "83 " and name "HB3 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "83 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8644 weight 0.10000E+01 volume 0.71600E+00 ppm1 8.640 ppm2 1.340 ASSI ( (segid " " and resid "85 " and name "HN ") )( (segid " " and resid "85 " and name "HG2 ") ) 5.000 5.000 0.000 peak 8645 weight 0.10000E+01 volume 0.32400E+00 ppm1 8.637 ppm2 1.612 ASSI ( (segid " " and resid "87 " and name "HN ") )( (segid " " and resid "121 " and name "HD2 ") ) 5.000 5.000 0.000 peak 8661 weight 0.10000E+01 volume 0.46300E+00 ppm1 7.098 ppm2 7.267 ASSI ( (segid " " and resid "87 " and name "HN ") )( (segid " " and resid "124 " and name "HG23") OR (segid " " and resid "124 " and name "HG22") OR (segid " " and resid "124 " and name "HG21") OR (segid " " and resid "124 " and name "HG13") OR (segid " " and resid "124 " and name "HG12") OR (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") OR (segid " " and resid "92 " and name "HD11") ) 5.000 5.000 0.000 peak 8662 weight 0.10000E+01 volume 0.46200E+00 ppm1 7.094 ppm2 0.934 ASSI ( (segid " " and resid "88 " and name "HN ") )( (segid " " and resid "124 " and name "HG23") OR (segid " " and resid "124 " and name "HG22") OR (segid " " and resid "124 " and name "HG21") OR (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") ) 6.000 6.000 0.000 peak 8670 weight 0.10000E+01 volume 0.26300E+00 ppm1 7.576 ppm2 0.959 ASSI ( (segid " " and resid "88 " and name "HN ") )( (segid " " and resid "92 " and name "HB2 ") OR (segid " " and resid "86 " and name "HG22") OR (segid " " and resid "83 " and name "HB3 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "83 " and name "HB1 ") ) 6.000 6.000 0.000 peak 8671 weight 0.10000E+01 volume 0.28400E+00 ppm1 7.578 ppm2 1.319 ASSI ( (segid " " and resid "88 " and name "HN ") )( (segid " " and resid "124 " and name "HA ") OR (segid " " and resid "83 " and name "HA ") ) 6.000 6.000 0.000 peak 8672 weight 0.10000E+01 volume 0.28100E+00 ppm1 7.583 ppm2 3.788 ASSI ( (segid " " and resid "89 " and name "HN ") )( (segid " " and resid "124 " and name "HG22") OR (segid " " and resid "124 " and name "HG21") OR (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") OR (segid " " and resid "92 " and name "HD11") ) 5.000 5.000 0.000 peak 8681 weight 0.10000E+01 volume 0.34000E+00 ppm1 7.688 ppm2 0.938 ASSI ( (segid " " and resid "92 " and name "HN ") )( (segid " " and resid "93 " and name "HG2 ") OR (segid " " and resid "89 " and name "HD23") OR (segid " " and resid "89 " and name "HD22") OR (segid " " and resid "89 " and name "HD21") ) 6.000 6.000 0.000 peak 8703 weight 0.10000E+01 volume 0.21500E+00 ppm1 8.059 ppm2 0.605 ASSI ( (segid " " and resid "92 " and name "HN ") )( (segid " " and resid "95 " and name "HD22") OR (segid " " and resid "92 " and name "HD23") OR (segid " " and resid "92 " and name "HD22") OR (segid " " and resid "92 " and name "HD21") OR (segid " " and resid "92 " and name "HD12") ) 5.000 5.000 0.000 peak 8704 weight 0.10000E+01 volume 0.76700E+00 ppm1 8.060 ppm2 0.970 ASSI ( (segid " " and resid "92 " and name "HN ") )( (segid " " and resid "91 " and name "HA ") OR (segid " " and resid "89 " and name "HA ") ) 5.000 5.000 0.000 peak 8705 weight 0.10000E+01 volume 0.10550E+01 ppm1 8.051 ppm2 3.737 ASSI ( (segid " " and resid "93 " and name "HN ") )( (segid " " and resid "93 " and name "HD2 ") ) 5.000 5.000 0.000 peak 8712 weight 0.10000E+01 volume 0.83700E+00 ppm1 8.579 ppm2 1.427 ASSI ( (segid " " and resid "93 " and name "HN ") )( (segid " " and resid "92 " and name "HD23") OR (segid " " and resid "92 " and name "HD22") OR (segid " " and resid "92 " and name "HD21") OR (segid " " and resid "92 " and name "HD11") ) 5.000 5.000 0.000 peak 8713 weight 0.10000E+01 volume 0.57600E+00 ppm1 8.582 ppm2 0.968 ASSI ( (segid " " and resid "94 " and name "HN ") )( (segid " " and resid "97 " and name "HG2 ") OR (segid " " and resid "92 " and name "HB1 ") OR (segid " " and resid "56 " and name "HG1 ") ) 6.000 6.000 0.000 peak 8724 weight 0.10000E+01 volume 0.18300E+00 ppm1 7.377 ppm2 2.084 ASSI ( (segid " " and resid "94 " and name "HN ") )( (segid " " and resid "95 " and name "HA ") OR (segid " " and resid "92 " and name "HA ") ) 6.000 6.000 0.000 peak 8725 weight 0.10000E+01 volume 0.17800E+00 ppm1 7.384 ppm2 3.895 ASSI ( (segid " " and resid "94 " and name "HN ") )( (segid " " and resid "90 " and name "HA ") OR (segid " " and resid "56 " and name "HA ") ) 6.000 6.000 0.000 peak 8726 weight 0.10000E+01 volume 0.34000E-01 ppm1 7.376 ppm2 4.273 ASSI ( (segid " " and resid "94 " and name "HN ") )( (segid " " and resid "92 " and name "HB2 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "59 " and name "HB3 ") OR (segid " " and resid "59 " and name "HB2 ") OR (segid " " and resid "59 " and name "HB1 ") ) 6.000 6.000 0.000 peak 8727 weight 0.10000E+01 volume 0.22700E+00 ppm1 7.378 ppm2 1.315 ASSI ( (segid " " and resid "94 " and name "HN ") )( (segid " " and resid "93 " and name "HA ") OR (segid " " and resid "91 " and name "HA ") ) 5.000 5.000 0.000 peak 8728 weight 0.10000E+01 volume 0.63600E+00 ppm1 7.382 ppm2 3.756 ASSI ( (segid " " and resid "94 " and name "HN ") )( (segid " " and resid "93 " and name "HA ") OR (segid " " and resid "91 " and name "HA ") ) 5.000 5.000 0.000 peak 8729 weight 0.10000E+01 volume 0.68400E+00 ppm1 7.382 ppm2 3.711 ASSI ( (segid " " and resid "94 " and name "HN ") )( (segid " " and resid "94 " and name "HB ") ) 3.300 3.300 0.000 peak 8735 weight 0.10000E+01 volume 0.22560E+01 ppm1 7.380 ppm2 2.259 ASSI ( (segid " " and resid "95 " and name "HN ") )( (segid " " and resid "94 " and name "HB ") ) 3.300 3.300 0.000 peak 8740 weight 0.10000E+01 volume 0.27550E+01 ppm1 8.083 ppm2 2.262 ASSI ( (segid " " and resid "96 " and name "HN ") )( (segid " " and resid "95 " and name "HD23") OR (segid " " and resid "95 " and name "HD22") OR (segid " " and resid "95 " and name "HD21") ) 5.000 5.000 0.000 peak 8748 weight 0.10000E+01 volume 0.59600E+00 ppm1 8.465 ppm2 0.956 ASSI ( (segid " " and resid "96 " and name "HN ") )( (segid " " and resid "95 " and name "HD23") OR (segid " " and resid "95 " and name "HD22") OR (segid " " and resid "95 " and name "HD21") ) 5.000 5.000 0.000 peak 8749 weight 0.10000E+01 volume 0.49800E+00 ppm1 8.460 ppm2 0.904 ASSI ( (segid " " and resid "96 " and name "HN ") )( (segid " " and resid "95 " and name "HA ") OR (segid " " and resid "92 " and name "HA ") ) 5.000 5.000 0.000 peak 8750 weight 0.10000E+01 volume 0.32700E+00 ppm1 8.465 ppm2 3.896 ASSI ( (segid " " and resid "96 " and name "HN ") )( (segid " " and resid "96 " and name "HA ") OR (segid " " and resid "93 " and name "HA ") ) 5.000 5.000 0.000 peak 8751 weight 0.10000E+01 volume 0.10310E+01 ppm1 8.465 ppm2 3.717 ASSI ( (segid " " and resid "96 " and name "HN ") )( (segid " " and resid "97 " and name "HB1 ") OR (segid " " and resid "95 " and name "HB1 ") OR (segid " " and resid "94 " and name "HB ") ) 5.000 5.000 0.000 peak 8752 weight 0.10000E+01 volume 0.17950E+01 ppm1 8.465 ppm2 2.251 ASSI ( (segid " " and resid "96 " and name "HN ") )( (segid " " and resid "100 " and name "HB2 ") OR (segid " " and resid "100 " and name "HB1 ") OR (segid " " and resid "96 " and name "HG23") OR (segid " " and resid "96 " and name "HG22") OR (segid " " and resid "96 " and name "HG21") OR (segid " " and resid "96 " and name "HG13") OR (segid " " and resid "95 " and name "HB2 ") ) 3.300 3.300 0.000 peak 8756 weight 0.10000E+01 volume 0.36450E+01 ppm1 8.462 ppm2 1.124 ASSI ( (segid " " and resid "97 " and name "HN ") )( (segid " " and resid "96 " and name "HA ") OR (segid " " and resid "93 " and name "HA ") ) 5.000 5.000 0.000 peak 8760 weight 0.10000E+01 volume 0.46700E+00 ppm1 8.795 ppm2 3.731 ASSI ( (segid " " and resid "97 " and name "HN ") )( (segid " " and resid "96 " and name "HG23") OR (segid " " and resid "96 " and name "HG13") OR (segid " " and resid "96 " and name "HG12") OR (segid " " and resid "96 " and name "HG11") ) 5.000 5.000 0.000 peak 8762 weight 0.10000E+01 volume 0.11920E+01 ppm1 8.806 ppm2 1.123 ASSI ( (segid " " and resid "98 " and name "HN ") )( (segid " " and resid "100 " and name "HB3 ") OR (segid " " and resid "100 " and name "HB2 ") OR (segid " " and resid "100 " and name "HB1 ") OR (segid " " and resid "96 " and name "HG23") OR (segid " " and resid "96 " and name "HG13") OR (segid " " and resid "96 " and name "HG12") OR (segid " " and resid "96 " and name "HG11") OR (segid " " and resid "95 " and name "HB2 ") OR (segid " " and resid "93 " and name "HG1 ") ) 5.000 5.000 0.000 peak 8769 weight 0.10000E+01 volume 0.44300E+00 ppm1 7.456 ppm2 1.123 ASSI ( (segid " " and resid "98 " and name "HN ") )( (segid " " and resid "102 " and name "HG23") OR (segid " " and resid "102 " and name "HG22") OR (segid " " and resid "102 " and name "HG21") OR (segid " " and resid "102 " and name "HG13") OR (segid " " and resid "102 " and name "HG12") OR (segid " " and resid "102 " and name "HG11") OR (segid " " and resid "80 " and name "HG21") OR (segid " " and resid "80 " and name "HG12") OR (segid " " and resid "63 " and name "HD23") OR (segid " " and resid "63 " and name "HD22") OR (segid " " and resid "63 " and name "HD21") OR (segid " " and resid "63 " and name "HB2 ") ) 6.000 6.000 0.000 peak 8770 weight 0.10000E+01 volume 0.20300E+00 ppm1 7.464 ppm2 0.856 ASSI ( (segid " " and resid "98 " and name "HN ") )( (segid " " and resid "95 " and name "HD23") OR (segid " " and resid "95 " and name "HD22") OR (segid " " and resid "95 " and name "HD21") OR (segid " " and resid "94 " and name "HG23") OR (segid " " and resid "94 " and name "HG22") OR (segid " " and resid "94 " and name "HG21") OR (segid " " and resid "92 " and name "HD22") OR (segid " " and resid "92 " and name "HD21") OR (segid " " and resid "92 " and name "HD11") OR (segid " " and resid "60 " and name "HD23") OR (segid " " and resid "60 " and name "HD13") OR (segid " " and resid "60 " and name "HD12") ) 6.000 6.000 0.000 peak 8771 weight 0.10000E+01 volume 0.17100E+00 ppm1 7.465 ppm2 0.965 ASSI ( (segid " " and resid "98 " and name "HN ") )( (segid " " and resid "99 " and name "HA2 ") OR (segid " " and resid "95 " and name "HA ") ) 5.000 5.000 0.000 peak 8772 weight 0.10000E+01 volume 0.61000E+00 ppm1 7.465 ppm2 3.884 ASSI ( (segid " " and resid "99 " and name "HN ") )( (segid " " and resid "100 " and name "HB3 ") OR (segid " " and resid "100 " and name "HB2 ") OR (segid " " and resid "100 " and name "HB1 ") OR (segid " " and resid "96 " and name "HG22") OR (segid " " and resid "96 " and name "HG12") OR (segid " " and resid "96 " and name "HG11") OR (segid " " and resid "95 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8783 weight 0.10000E+01 volume -0.52400E+00 ppm1 7.634 ppm2 1.122 ASSI ( (segid " " and resid "99 " and name "HN ") )( (segid " " and resid "97 " and name "HA ") OR (segid " " and resid "69 " and name "HD2 ") OR (segid " " and resid "69 " and name "HD1 ") ) 5.000 5.000 0.000 peak 8784 weight 0.10000E+01 volume -0.41300E+00 ppm1 7.631 ppm2 4.112 ASSI ( (segid " " and resid "100 " and name "HN ") )( (segid " " and resid "98 " and name "HB1 ") OR (segid " " and resid "96 " and name "HA ") ) 5.000 5.000 0.000 peak 8790 weight 0.10000E+01 volume 0.19200E+01 ppm1 8.263 ppm2 3.761 ASSI ( (segid " " and resid "101 " and name "HN ") )( (segid " " and resid "70 " and name "HD22") ) 5.000 5.000 0.000 peak 8797 weight 0.10000E+01 volume 0.31100E+00 ppm1 8.959 ppm2 6.882 ASSI ( (segid " " and resid "101 " and name "HN ") )( (segid " " and resid "70 " and name "HD21") ) 6.000 6.000 0.000 peak 8798 weight 0.10000E+01 volume 0.54000E-01 ppm1 8.962 ppm2 7.873 ASSI ( (segid " " and resid "102 " and name "HN ") )( (segid " " and resid "100 " and name "HB3 ") OR (segid " " and resid "100 " and name "HB2 ") OR (segid " " and resid "100 " and name "HB1 ") OR (segid " " and resid "96 " and name "HG22") OR (segid " " and resid "96 " and name "HG21") OR (segid " " and resid "96 " and name "HG12") OR (segid " " and resid "96 " and name "HG11") ) 6.000 6.000 0.000 peak 8805 weight 0.10000E+01 volume 0.20000E+00 ppm1 8.508 ppm2 1.123 ASSI ( (segid " " and resid "102 " and name "HN ") )( (segid " " and resid "102 " and name "HG23") OR (segid " " and resid "102 " and name "HG22") OR (segid " " and resid "102 " and name "HG21") ) 3.300 3.300 0.000 peak 8810 weight 0.10000E+01 volume 0.30620E+01 ppm1 8.503 ppm2 0.864 ASSI ( (segid " " and resid "103 " and name "HN ") )( (segid " " and resid "112 " and name "HG2 ") OR (segid " " and resid "102 " and name "HG23") OR (segid " " and resid "102 " and name "HG22") OR (segid " " and resid "102 " and name "HG21") ) 5.000 5.000 0.000 peak 8813 weight 0.10000E+01 volume 0.10040E+01 ppm1 8.546 ppm2 0.860 ASSI ( (segid " " and resid "103 " and name "HN ") )( (segid " " and resid "111 " and name "HD23") OR (segid " " and resid "111 " and name "HD22") OR (segid " " and resid "111 " and name "HD21") ) 5.000 5.000 0.000 peak 8814 weight 0.10000E+01 volume 0.58800E+00 ppm1 8.547 ppm2 0.967 ASSI ( (segid " " and resid "103 " and name "HN ") )( (segid " " and resid "101 " and name "HA ") ) 5.000 5.000 0.000 peak 8815 weight 0.10000E+01 volume 0.31000E+00 ppm1 8.545 ppm2 4.646 ASSI ( (segid " " and resid "103 " and name "HD21") )( (segid " " and resid "102 " and name "HG23") OR (segid " " and resid "102 " and name "HG21") ) 6.000 6.000 0.000 peak 8823 weight 0.10000E+01 volume 0.20300E+00 ppm1 7.549 ppm2 0.860 ASSI ( (segid " " and resid "103 " and name "HD21") )( (segid " " and resid "103 " and name "HD22") ) 2.700 2.700 0.000 peak 8824 weight 0.10000E+01 volume 0.48240E+01 ppm1 7.544 ppm2 6.756 ASSI ( (segid " " and resid "103 " and name "HD21") )( (segid " " and resid "133 " and name "HB2 ") OR (segid " " and resid "103 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8825 weight 0.10000E+01 volume 0.80900E+00 ppm1 7.549 ppm2 2.580 ASSI ( (segid " " and resid "103 " and name "HD21") )( (segid " " and resid "103 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8826 weight 0.10000E+01 volume 0.45800E+00 ppm1 7.550 ppm2 2.940 ASSI ( (segid " " and resid "103 " and name "HD22") )( (segid " " and resid "103 " and name "HD21") ) 3.300 3.300 0.000 peak 8827 weight 0.10000E+01 volume 0.37250E+01 ppm1 6.756 ppm2 7.545 ASSI ( (segid " " and resid "103 " and name "HD22") )( (segid " " and resid "102 " and name "HG23") OR (segid " " and resid "102 " and name "HG22") OR (segid " " and resid "102 " and name "HG21") ) 6.000 6.000 0.000 peak 8828 weight 0.10000E+01 volume 0.27300E+00 ppm1 6.758 ppm2 0.854 ASSI ( (segid " " and resid "103 " and name "HD22") )( (segid " " and resid "132 " and name "HA ") ) 5.000 5.000 0.000 peak 8829 weight 0.10000E+01 volume 0.35800E+00 ppm1 6.757 ppm2 5.071 ASSI ( (segid " " and resid "104 " and name "HN ") )( (segid " " and resid "111 " and name "HD23") OR (segid " " and resid "111 " and name "HD22") OR (segid " " and resid "111 " and name "HD21") ) 6.000 6.000 0.000 peak 8832 weight 0.10000E+01 volume 0.23600E+00 ppm1 6.326 ppm2 0.964 ASSI ( (segid " " and resid "104 " and name "HN ") )( (segid " " and resid "112 " and name "HG1 ") ) 6.000 6.000 0.000 peak 8833 weight 0.10000E+01 volume 0.21600E+00 ppm1 6.349 ppm2 1.810 ASSI ( (segid " " and resid "104 " and name "HN ") )( (segid " " and resid "102 " and name "HA ") ) 6.000 6.000 0.000 peak 8834 weight 0.10000E+01 volume 0.21000E+00 ppm1 6.328 ppm2 3.894 ASSI ( (segid " " and resid "104 " and name "HN ") )( (segid " " and resid "112 " and name "HG2 ") OR (segid " " and resid "80 " and name "HG11") ) 5.000 5.000 0.000 peak 8835 weight 0.10000E+01 volume 0.33300E+00 ppm1 6.326 ppm2 0.855 ASSI ( (segid " " and resid "105 " and name "HN ") )( (segid " " and resid "105 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8841 weight 0.10000E+01 volume 0.14100E+01 ppm1 8.238 ppm2 1.253 ASSI ( (segid " " and resid "106 " and name "HN ") )( (segid " " and resid "107 " and name "HN ") ) 6.000 6.000 0.000 peak 8850 weight 0.10000E+01 volume 0.23500E+00 ppm1 7.647 ppm2 8.163 ASSI ( (segid " " and resid "107 " and name "HN ") )( (segid " " and resid "109 " and name "HA2 ") OR (segid " " and resid "77 " and name "HA ") OR (segid " " and resid "76 " and name "HA2 ") ) 5.000 5.000 0.000 peak 8860 weight 0.10000E+01 volume 0.30900E+00 ppm1 8.187 ppm2 3.787 ASSI ( (segid " " and resid "108 " and name "HN ") )( (segid " " and resid "107 " and name "HA ") ) 5.000 5.000 0.000 peak 8869 weight 0.10000E+01 volume 0.43700E+00 ppm1 8.475 ppm2 4.295 ASSI ( (segid " " and resid "108 " and name "HN ") )( (segid " " and resid "109 " and name "HA2 ") ) 6.000 6.000 0.000 peak 8870 weight 0.10000E+01 volume 0.19700E+00 ppm1 8.474 ppm2 3.837 ASSI ( (segid " " and resid "108 " and name "HN ") )( (segid " " and resid "107 " and name "HB2 ") OR (segid " " and resid "107 " and name "HB1 ") ) 6.000 6.000 0.000 peak 8872 weight 0.10000E+01 volume 0.19400E+00 ppm1 8.474 ppm2 4.068 ASSI ( (segid " " and resid "109 " and name "HN ") )( (segid " " and resid "106 " and name "HN ") ) 6.000 6.000 0.000 peak 8878 weight 0.10000E+01 volume 0.13500E+00 ppm1 8.511 ppm2 7.623 ASSI ( (segid " " and resid "109 " and name "HN ") )( (segid " " and resid "139 " and name "HN ") OR (segid " " and resid "105 " and name "HN ") ) 6.000 6.000 0.000 peak 8879 weight 0.10000E+01 volume 0.16800E+00 ppm1 8.511 ppm2 8.280 ASSI ( (segid " " and resid "109 " and name "HN ") )( (segid " " and resid "105 " and name "HB2 ") ) 6.000 6.000 0.000 peak 8880 weight 0.10000E+01 volume 0.12900E+00 ppm1 8.509 ppm2 1.268 ASSI ( (segid " " and resid "109 " and name "HN ") )( (segid " " and resid "139 " and name "HB3 ") OR (segid " " and resid "139 " and name "HB2 ") OR (segid " " and resid "139 " and name "HB1 ") OR (segid " " and resid "106 " and name "HB2 ") ) 6.000 6.000 0.000 peak 8881 weight 0.10000E+01 volume 0.96000E-01 ppm1 8.500 ppm2 1.407 ASSI ( (segid " " and resid "109 " and name "HN ") )( (segid " " and resid "110 " and name "HB1 ") OR (segid " " and resid "110 " and name "HA ") OR (segid " " and resid "107 " and name "HB2 ") OR (segid " " and resid "107 " and name "HB1 ") ) 6.000 6.000 0.000 peak 8882 weight 0.10000E+01 volume 0.24800E+00 ppm1 8.510 ppm2 4.066 ASSI ( (segid " " and resid "110 " and name "HN ") )( (segid " " and resid "109 " and name "HA2 ") ) 5.000 5.000 0.000 peak 8890 weight 0.10000E+01 volume 0.76800E+00 ppm1 8.000 ppm2 3.790 ASSI ( (segid " " and resid "110 " and name "HN ") )( (segid " " and resid "110 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8891 weight 0.10000E+01 volume 0.72300E+00 ppm1 7.992 ppm2 3.695 ASSI ( (segid " " and resid "110 " and name "HN ") )( (segid " " and resid "110 " and name "HB1 ") OR (segid " " and resid "110 " and name "HA ") ) 5.000 5.000 0.000 peak 8893 weight 0.10000E+01 volume 0.15120E+01 ppm1 8.003 ppm2 4.064 ASSI ( (segid " " and resid "110 " and name "HN ") )( (segid " " and resid "109 " and name "HN ") OR (segid " " and resid "108 " and name "HN ") ) 5.000 5.000 0.000 peak 8894 weight 0.10000E+01 volume 0.16450E+01 ppm1 8.003 ppm2 8.499 ASSI ( (segid " " and resid "111 " and name "HN ") )( (segid " " and resid "110 " and name "HB1 ") OR (segid " " and resid "110 " and name "HA ") ) 5.000 5.000 0.000 peak 8898 weight 0.10000E+01 volume 0.14740E+01 ppm1 9.449 ppm2 4.069 ASSI ( (segid " " and resid "113 " and name "HN ") )( (segid " " and resid "111 " and name "HD23") OR (segid " " and resid "111 " and name "HD21") ) 6.000 6.000 0.000 peak 8908 weight 0.10000E+01 volume 0.25500E+00 ppm1 8.280 ppm2 0.973 ASSI ( (segid " " and resid "113 " and name "HN ") )( (segid " " and resid "128 " and name "HB2 ") OR (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") ) 5.000 5.000 0.000 peak 8909 weight 0.10000E+01 volume 0.30600E+00 ppm1 8.277 ppm2 1.199 ASSI ( (segid " " and resid "113 " and name "HN ") )( (segid " " and resid "128 " and name "HD23") OR (segid " " and resid "128 " and name "HD22") OR (segid " " and resid "128 " and name "HD21") OR (segid " " and resid "112 " and name "HG2 ") OR (segid " " and resid "102 " and name "HG12") OR (segid " " and resid "102 " and name "HG11") ) 5.000 5.000 0.000 peak 8910 weight 0.10000E+01 volume 0.42400E+00 ppm1 8.274 ppm2 0.859 ASSI ( (segid " " and resid "113 " and name "HN ") )( (segid " " and resid "111 " and name "HB1 ") ) 6.000 6.000 0.000 peak 8911 weight 0.10000E+01 volume 0.18800E+00 ppm1 8.276 ppm2 2.426 ASSI ( (segid " " and resid "113 " and name "HN ") )( (segid " " and resid "112 " and name "HD2 ") ) 6.000 6.000 0.000 peak 8912 weight 0.10000E+01 volume 0.18500E+00 ppm1 8.276 ppm2 3.959 ASSI ( (segid " " and resid "113 " and name "HN ") )( (segid " " and resid "112 " and name "HD1 ") ) 6.000 6.000 0.000 peak 8913 weight 0.10000E+01 volume 0.18700E+00 ppm1 8.276 ppm2 4.269 ASSI ( (segid " " and resid "114 " and name "HE2 ") )( (segid " " and resid "144 " and name "HD1 ") OR (segid " " and resid "137 " and name "HA ") ) 6.000 6.000 0.000 peak 8921 weight 0.10000E+01 volume 0.20000E+00 ppm1 11.345 ppm2 4.260 ASSI ( (segid " " and resid "114 " and name "HE2 ") )( (segid " " and resid "143 " and name "HA ") ) 6.000 6.000 0.000 peak 8923 weight 0.10000E+01 volume 0.16800E+00 ppm1 11.347 ppm2 5.354 ASSI ( (segid " " and resid "114 " and name "HE2 ") )( (segid " " and resid "114 " and name "HD2 ") ) 6.000 6.000 0.000 peak 8924 weight 0.10000E+01 volume 0.29600E+00 ppm1 11.343 ppm2 6.965 ASSI ( (segid " " and resid "114 " and name "HE2 ") )( (segid " " and resid "114 " and name "HE1 ") ) 6.000 6.000 0.000 peak 8925 weight 0.10000E+01 volume 0.14500E+00 ppm1 11.345 ppm2 7.819 ASSI ( (segid " " and resid "114 " and name "HN ") )( (segid " " and resid "115 " and name "HA ") OR (segid " " and resid "110 " and name "HB1 ") OR (segid " " and resid "110 " and name "HA ") ) 5.000 5.000 0.000 peak 8926 weight 0.10000E+01 volume 0.55000E+00 ppm1 7.672 ppm2 4.061 ASSI ( (segid " " and resid "114 " and name "HN ") )( (segid " " and resid "111 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8927 weight 0.10000E+01 volume 0.84900E+00 ppm1 7.672 ppm2 2.005 ASSI ( (segid " " and resid "114 " and name "HN ") )( (segid " " and resid "115 " and name "HD23") OR (segid " " and resid "115 " and name "HD22") OR (segid " " and resid "115 " and name "HD21") OR (segid " " and resid "111 " and name "HD23") ) 5.000 5.000 0.000 peak 8928 weight 0.10000E+01 volume 0.44300E+00 ppm1 7.659 ppm2 0.957 ASSI ( (segid " " and resid "114 " and name "HN ") )( (segid " " and resid "111 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8929 weight 0.10000E+01 volume 0.43200E+00 ppm1 7.666 ppm2 2.434 ASSI ( (segid " " and resid "114 " and name "HN ") )( (segid " " and resid "147 " and name "HD13") OR (segid " " and resid "147 " and name "HD12") OR (segid " " and resid "147 " and name "HD11") OR (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") ) 5.000 5.000 0.000 peak 8930 weight 0.10000E+01 volume 0.89600E+00 ppm1 7.665 ppm2 1.204 ASSI ( (segid " " and resid "115 " and name "HN ") )( (segid " " and resid "114 " and name "HB1 ") OR (segid " " and resid "110 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8939 weight 0.10000E+01 volume 0.51900E+00 ppm1 7.305 ppm2 3.714 ASSI ( (segid " " and resid "116 " and name "HN ") )( (segid " " and resid "125 " and name "HG13") OR (segid " " and resid "125 " and name "HG12") OR (segid " " and resid "125 " and name "HG11") OR (segid " " and resid "124 " and name "HG22") OR (segid " " and resid "124 " and name "HG13") OR (segid " " and resid "124 " and name "HG12") OR (segid " " and resid "124 " and name "HG11") OR (segid " " and resid "115 " and name "HD23") OR (segid " " and resid "115 " and name "HD22") OR (segid " " and resid "115 " and name "HD21") ) 5.000 5.000 0.000 peak 8951 weight 0.10000E+01 volume 0.10670E+01 ppm1 7.890 ppm2 0.969 ASSI ( (segid " " and resid "116 " and name "HN ") )( (segid " " and resid "128 " and name "HD13") OR (segid " " and resid "128 " and name "HD12") OR (segid " " and resid "128 " and name "HD11") OR (segid " " and resid "117 " and name "HG12") OR (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD12") OR (segid " " and resid "113 " and name "HD11") OR (segid " " and resid "113 " and name "HG22") OR (segid " " and resid "113 " and name "HG21") ) 5.000 5.000 0.000 peak 8952 weight 0.10000E+01 volume 0.66400E+00 ppm1 7.893 ppm2 0.725 ASSI ( (segid " " and resid "117 " and name "HN ") )( (segid " " and resid "118 " and name "HG2 ") ) 5.000 5.000 0.000 peak 8955 weight 0.10000E+01 volume 0.38600E+00 ppm1 7.945 ppm2 1.601 ASSI ( (segid " " and resid "117 " and name "HN ") )( (segid " " and resid "147 " and name "HD13") OR (segid " " and resid "147 " and name "HD12") OR (segid " " and resid "147 " and name "HD11") OR (segid " " and resid "128 " and name "HB2 ") ) 5.000 5.000 0.000 peak 8956 weight 0.10000E+01 volume 0.32100E+00 ppm1 7.941 ppm2 1.177 ASSI ( (segid " " and resid "117 " and name "HN ") )( (segid " " and resid "118 " and name "HG1 ") ) 5.000 5.000 0.000 peak 8957 weight 0.10000E+01 volume 0.41700E+00 ppm1 7.946 ppm2 1.893 ASSI ( (segid " " and resid "117 " and name "HN ") )( (segid " " and resid "147 " and name "HB1 ") OR (segid " " and resid "125 " and name "HB ") OR (segid " " and resid "115 " and name "HB1 ") ) 5.000 5.000 0.000 peak 8958 weight 0.10000E+01 volume 0.65500E+00 ppm1 7.943 ppm2 2.179 ASSI ( (segid " " and resid "117 " and name "HN ") )( (segid " " and resid "119 " and name "HN ") OR (segid " " and resid "115 " and name "HN ") ) 6.000 6.000 0.000 peak 8959 weight 0.10000E+01 volume 0.15300E+00 ppm1 7.940 ppm2 7.295 ASSI ( (segid " " and resid "117 " and name "HN ") )( (segid " " and resid "125 " and name "HG13") OR (segid " " and resid "125 " and name "HG12") OR (segid " " and resid "125 " and name "HG11") ) 5.000 5.000 0.000 peak 8960 weight 0.10000E+01 volume 0.99100E+00 ppm1 7.946 ppm2 0.992 ASSI ( (segid " " and resid "118 " and name "HN ") )( (segid " " and resid "118 " and name "HB2 ") OR (segid " " and resid "118 " and name "HB1 ") OR (segid " " and resid "117 " and name "HB ") ) 2.700 2.700 0.000 peak 8967 weight 0.10000E+01 volume 0.64500E+01 ppm1 8.118 ppm2 2.058 ASSI ( (segid " " and resid "119 " and name "HN ") )( (segid " " and resid "120 " and name "HA2 ") OR (segid " " and resid "117 " and name "HA ") OR (segid " " and resid "85 " and name "HD1 ") ) 6.000 6.000 0.000 peak 8974 weight 0.10000E+01 volume 0.20000E+00 ppm1 7.326 ppm2 3.508 ASSI ( (segid " " and resid "120 " and name "HN ") )( (segid " " and resid "156 " and name "HD13") OR (segid " " and resid "156 " and name "HD12") OR (segid " " and resid "156 " and name "HD11") OR (segid " " and resid "125 " and name "HG13") OR (segid " " and resid "125 " and name "HG12") OR (segid " " and resid "125 " and name "HG11") ) 5.000 5.000 0.000 peak 8986 weight 0.10000E+01 volume -0.50900E+00 ppm1 7.483 ppm2 0.989 ASSI ( (segid " " and resid "120 " and name "HN ") )( (segid " " and resid "118 " and name "HA ") ) 5.000 5.000 0.000 peak 8987 weight 0.10000E+01 volume -0.33900E+00 ppm1 7.481 ppm2 3.675 ASSI ( (segid " " and resid "120 " and name "HN ") )( (segid " " and resid "116 " and name "HA ") ) 5.000 5.000 0.000 peak 8988 weight 0.10000E+01 volume -0.59900E+00 ppm1 7.475 ppm2 4.125 ASSI ( (segid " " and resid "120 " and name "HN ") )( (segid " " and resid "160 " and name "HD23") OR (segid " " and resid "117 " and name "HG23") OR (segid " " and resid "117 " and name "HG22") OR (segid " " and resid "117 " and name "HG21") OR (segid " " and resid "117 " and name "HG12") OR (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD12") OR (segid " " and resid "113 " and name "HD11") ) 6.000 6.000 0.000 peak 8989 weight 0.10000E+01 volume -0.18800E+00 ppm1 7.474 ppm2 0.776 ASSI ( (segid " " and resid "120 " and name "HN ") )( (segid " " and resid "120 " and name "HA2 ") OR (segid " " and resid "117 " and name "HA ") ) 3.300 3.300 0.000 peak 8990 weight 0.10000E+01 volume -0.23730E+01 ppm1 7.477 ppm2 3.517 ASSI ( (segid " " and resid "121 " and name "HN ") )( (segid " " and resid "125 " and name "HG13") OR (segid " " and resid "125 " and name "HG12") OR (segid " " and resid "125 " and name "HG11") OR (segid " " and resid "124 " and name "HG12") OR (segid " " and resid "124 " and name "HG11") ) 5.000 5.000 0.000 peak 8998 weight 0.10000E+01 volume 0.65400E+00 ppm1 7.833 ppm2 0.986 ASSI ( (segid " " and resid "121 " and name "HN ") )( (segid " " and resid "116 " and name "HA ") ) 5.000 5.000 0.000 peak 8999 weight 0.10000E+01 volume 0.59900E+00 ppm1 7.832 ppm2 4.138 ASSI ( (segid " " and resid "121 " and name "HN ") )( (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9000 weight 0.10000E+01 volume 0.95300E+00 ppm1 7.826 ppm2 1.497 ASSI ( (segid " " and resid "121 " and name "HN ") )( (segid " " and resid "125 " and name "HG23") OR (segid " " and resid "125 " and name "HG22") OR (segid " " and resid "125 " and name "HG21") ) 6.000 6.000 0.000 peak 9001 weight 0.10000E+01 volume 0.22800E+00 ppm1 7.834 ppm2 0.882 ASSI ( (segid " " and resid "124 " and name "HN ") )( (segid " " and resid "89 " and name "HD23") OR (segid " " and resid "89 " and name "HD22") OR (segid " " and resid "89 " and name "HD21") ) 6.000 6.000 0.000 peak 9009 weight 0.10000E+01 volume 0.45000E-01 ppm1 7.136 ppm2 0.591 ASSI ( (segid " " and resid "124 " and name "HN ") )( (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB1 ") OR (segid " " and resid "84 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9010 weight 0.10000E+01 volume 0.11800E+00 ppm1 7.133 ppm2 1.467 ASSI ( (segid " " and resid "124 " and name "HN ") )( (segid " " and resid "125 " and name "HB ") ) 6.000 6.000 0.000 peak 9011 weight 0.10000E+01 volume 0.21600E+00 ppm1 7.136 ppm2 2.240 ASSI ( (segid " " and resid "124 " and name "HN ") )( (segid " " and resid "121 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9012 weight 0.10000E+01 volume 0.15000E+00 ppm1 7.135 ppm2 2.975 ASSI ( (segid " " and resid "124 " and name "HN ") )( (segid " " and resid "121 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9013 weight 0.10000E+01 volume 0.24300E+00 ppm1 7.135 ppm2 3.139 ASSI ( (segid " " and resid "124 " and name "HN ") )( (segid " " and resid "126 " and name "HN ") ) 6.000 6.000 0.000 peak 9014 weight 0.10000E+01 volume 0.21200E+00 ppm1 7.136 ppm2 8.489 ASSI ( (segid " " and resid "125 " and name "HN ") )( (segid " " and resid "125 " and name "HG13") OR (segid " " and resid "125 " and name "HG12") OR (segid " " and resid "125 " and name "HG11") OR (segid " " and resid "124 " and name "HG13") OR (segid " " and resid "124 " and name "HG12") OR (segid " " and resid "124 " and name "HG11") ) 2.700 2.700 0.000 peak 9023 weight 0.10000E+01 volume 0.42980E+01 ppm1 8.130 ppm2 0.979 ASSI ( (segid " " and resid "126 " and name "HN ") )( (segid " " and resid "159 " and name "HG12") OR (segid " " and resid "156 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB3 ") OR (segid " " and resid "129 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9026 weight 0.10000E+01 volume 0.34900E+00 ppm1 8.505 ppm2 1.119 ASSI ( (segid " " and resid "126 " and name "HN ") )( (segid " " and resid "159 " and name "HA ") OR (segid " " and resid "124 " and name "HA ") ) 5.000 5.000 0.000 peak 9027 weight 0.10000E+01 volume 0.59200E+00 ppm1 8.502 ppm2 3.762 ASSI ( (segid " " and resid "126 " and name "HN ") )( (segid " " and resid "160 " and name "HD23") OR (segid " " and resid "160 " and name "HD22") OR (segid " " and resid "160 " and name "HD21") OR (segid " " and resid "156 " and name "HD23") OR (segid " " and resid "156 " and name "HD22") OR (segid " " and resid "156 " and name "HD21") OR (segid " " and resid "113 " and name "HD11") ) 5.000 5.000 0.000 peak 9028 weight 0.10000E+01 volume 0.10830E+01 ppm1 8.494 ppm2 0.752 ASSI ( (segid " " and resid "126 " and name "HN ") )( (segid " " and resid "159 " and name "HD13") OR (segid " " and resid "159 " and name "HD11") OR (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "159 " and name "HG21") OR (segid " " and resid "125 " and name "HG23") OR (segid " " and resid "125 " and name "HG21") ) 3.300 3.300 0.000 peak 9029 weight 0.10000E+01 volume 0.33630E+01 ppm1 8.498 ppm2 0.881 ASSI ( (segid " " and resid "126 " and name "HN ") )( (segid " " and resid "125 " and name "HG12") OR (segid " " and resid "125 " and name "HG11") ) 5.000 5.000 0.000 peak 9030 weight 0.10000E+01 volume 0.17170E+01 ppm1 8.494 ppm2 0.973 ASSI ( (segid " " and resid "126 " and name "HN ") )( (segid " " and resid "129 " and name "HN ") OR (segid " " and resid "128 " and name "HN ") ) 6.000 6.000 0.000 peak 9031 weight 0.10000E+01 volume 0.26200E+00 ppm1 8.497 ppm2 8.273 ASSI ( (segid " " and resid "126 " and name "HN ") )( (segid " " and resid "127 " and name "HA ") OR (segid " " and resid "123 " and name "HA ") ) 5.000 5.000 0.000 peak 9032 weight 0.10000E+01 volume 0.74900E+00 ppm1 8.496 ppm2 4.333 ASSI ( (segid " " and resid "127 " and name "HN ") )( (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "159 " and name "HG21") OR (segid " " and resid "128 " and name "HD23") OR (segid " " and resid "128 " and name "HD22") OR (segid " " and resid "128 " and name "HD21") OR (segid " " and resid "89 " and name "HD13") OR (segid " " and resid "89 " and name "HD12") OR (segid " " and resid "89 " and name "HD11") ) 5.000 5.000 0.000 peak 9037 weight 0.10000E+01 volume 0.88700E+00 ppm1 7.430 ppm2 0.858 ASSI ( (segid " " and resid "127 " and name "HN ") )( (segid " " and resid "125 " and name "HG13") OR (segid " " and resid "125 " and name "HG12") OR (segid " " and resid "125 " and name "HG11") OR (segid " " and resid "124 " and name "HG23") OR (segid " " and resid "124 " and name "HG22") OR (segid " " and resid "124 " and name "HG21") OR (segid " " and resid "124 " and name "HG13") OR (segid " " and resid "124 " and name "HG12") OR (segid " " and resid "124 " and name "HG11") ) 5.000 5.000 0.000 peak 9038 weight 0.10000E+01 volume 0.83700E+00 ppm1 7.426 ppm2 0.950 ASSI ( (segid " " and resid "127 " and name "HN ") )( (segid " " and resid "89 " and name "HD23") OR (segid " " and resid "89 " and name "HD22") OR (segid " " and resid "89 " and name "HD21") ) 5.000 5.000 0.000 peak 9039 weight 0.10000E+01 volume 0.43200E+00 ppm1 7.433 ppm2 0.595 ASSI ( (segid " " and resid "128 " and name "HN ") )( (segid " " and resid "125 " and name "HG13") OR (segid " " and resid "125 " and name "HG12") OR (segid " " and resid "125 " and name "HG11") OR (segid " " and resid "124 " and name "HG22") OR (segid " " and resid "124 " and name "HG13") OR (segid " " and resid "124 " and name "HG12") OR (segid " " and resid "124 " and name "HG11") OR (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") ) 5.000 5.000 0.000 peak 9048 weight 0.10000E+01 volume 0.11430E+01 ppm1 8.230 ppm2 0.954 ASSI ( (segid " " and resid "128 " and name "HN ") )( (segid " " and resid "160 " and name "HD11") OR (segid " " and resid "89 " and name "HD23") OR (segid " " and resid "89 " and name "HD22") OR (segid " " and resid "89 " and name "HD21") ) 6.000 6.000 0.000 peak 9049 weight 0.10000E+01 volume 0.16500E+00 ppm1 8.231 ppm2 0.615 ASSI ( (segid " " and resid "128 " and name "HN ") )( (segid " " and resid "131 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB1 ") OR (segid " " and resid "113 " and name "HG11") OR (segid " " and resid "84 " and name "HB2 ") OR (segid " " and resid "84 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9050 weight 0.10000E+01 volume 0.10800E+00 ppm1 8.234 ppm2 1.457 ASSI ( (segid " " and resid "128 " and name "HN ") )( (segid " " and resid "129 " and name "HA ") OR (segid " " and resid "124 " and name "HA ") ) 6.000 6.000 0.000 peak 9051 weight 0.10000E+01 volume 0.24800E+00 ppm1 8.230 ppm2 3.744 ASSI ( (segid " " and resid "128 " and name "HN ") )( (segid " " and resid "126 " and name "HA ") OR (segid " " and resid "84 " and name "HA ") ) 6.000 6.000 0.000 peak 9052 weight 0.10000E+01 volume 0.12300E+00 ppm1 8.234 ppm2 4.004 ASSI ( (segid " " and resid "128 " and name "HN ") )( (segid " " and resid "125 " and name "HN ") ) 5.000 5.000 0.000 peak 9053 weight 0.10000E+01 volume 0.12540E+01 ppm1 8.231 ppm2 8.126 ASSI ( (segid " " and resid "128 " and name "HN ") )( (segid " " and resid "129 " and name "HB3 ") OR (segid " " and resid "129 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB1 ") OR (segid " " and resid "96 " and name "HG13") OR (segid " " and resid "96 " and name "HG11") ) 5.000 5.000 0.000 peak 9054 weight 0.10000E+01 volume 0.51100E+00 ppm1 8.227 ppm2 1.133 ASSI ( (segid " " and resid "128 " and name "HN ") )( (segid " " and resid "128 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9055 weight 0.10000E+01 volume 0.58600E+00 ppm1 8.227 ppm2 1.232 ASSI ( (segid " " and resid "129 " and name "HN ") )( (segid " " and resid "159 " and name "HB ") OR (segid " " and resid "134 " and name "HG ") OR (segid " " and resid "130 " and name "HG1 ") OR (segid " " and resid "130 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9066 weight 0.10000E+01 volume 0.18400E+00 ppm1 8.293 ppm2 1.888 ASSI ( (segid " " and resid "129 " and name "HN ") )( (segid " " and resid "127 " and name "HN ") ) 6.000 6.000 0.000 peak 9067 weight 0.10000E+01 volume 0.88000E-01 ppm1 8.291 ppm2 7.422 ASSI ( (segid " " and resid "129 " and name "HN ") )( (segid " " and resid "126 " and name "HN ") ) 6.000 6.000 0.000 peak 9068 weight 0.10000E+01 volume 0.18700E+00 ppm1 8.299 ppm2 8.512 ASSI ( (segid " " and resid "129 " and name "HN ") )( (segid " " and resid "128 " and name "HD23") OR (segid " " and resid "128 " and name "HD22") OR (segid " " and resid "128 " and name "HD21") ) 5.000 5.000 0.000 peak 9069 weight 0.10000E+01 volume 0.58600E+00 ppm1 8.284 ppm2 0.881 ASSI ( (segid " " and resid "129 " and name "HN ") )( (segid " " and resid "127 " and name "HA ") ) 6.000 6.000 0.000 peak 9070 weight 0.10000E+01 volume 0.15400E+00 ppm1 8.295 ppm2 4.290 ASSI ( (segid " " and resid "131 " and name "HN ") )( (segid " " and resid "134 " and name "HD23") OR (segid " " and resid "134 " and name "HD22") OR (segid " " and resid "134 " and name "HD21") OR (segid " " and resid "128 " and name "HD13") OR (segid " " and resid "128 " and name "HD12") OR (segid " " and resid "128 " and name "HD11") ) 6.000 6.000 0.000 peak 9082 weight 0.10000E+01 volume 0.12700E+00 ppm1 6.826 ppm2 0.685 ASSI ( (segid " " and resid "131 " and name "HN ") )( (segid " " and resid "129 " and name "HB3 ") OR (segid " " and resid "129 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB1 ") OR (segid " " and resid "96 " and name "HG22") OR (segid " " and resid "96 " and name "HG13") OR (segid " " and resid "96 " and name "HG12") OR (segid " " and resid "96 " and name "HG11") ) 6.000 6.000 0.000 peak 9083 weight 0.10000E+01 volume 0.21600E+00 ppm1 6.825 ppm2 1.116 ASSI ( (segid " " and resid "131 " and name "HN ") )( (segid " " and resid "134 " and name "HD13") OR (segid " " and resid "134 " and name "HD12") OR (segid " " and resid "134 " and name "HD11") OR (segid " " and resid "128 " and name "HD23") OR (segid " " and resid "128 " and name "HD22") OR (segid " " and resid "128 " and name "HD21") OR (segid " " and resid "102 " and name "HG23") OR (segid " " and resid "102 " and name "HG22") OR (segid " " and resid "102 " and name "HG21") OR (segid " " and resid "102 " and name "HG13") OR (segid " " and resid "102 " and name "HG11") ) 5.000 5.000 0.000 peak 9084 weight 0.10000E+01 volume 0.38500E+00 ppm1 6.828 ppm2 0.883 ASSI ( (segid " " and resid "131 " and name "HN ") )( (segid " " and resid "130 " and name "HD2 ") ) 6.000 6.000 0.000 peak 9085 weight 0.10000E+01 volume 0.18900E+00 ppm1 6.827 ppm2 3.088 ASSI ( (segid " " and resid "131 " and name "HN ") )( (segid " " and resid "130 " and name "HD1 ") ) 5.000 5.000 0.000 peak 9086 weight 0.10000E+01 volume 0.51900E+00 ppm1 6.830 ppm2 3.475 ASSI ( (segid " " and resid "131 " and name "HN ") )( (segid " " and resid "132 " and name "HB2 ") OR (segid " " and resid "132 " and name "HB1 ") OR (segid " " and resid "130 " and name "HD1 ") ) 5.000 5.000 0.000 peak 9087 weight 0.10000E+01 volume 0.52400E+00 ppm1 6.829 ppm2 3.517 ASSI ( (segid " " and resid "131 " and name "HN ") )( (segid " " and resid "128 " and name "HA ") ) 6.000 6.000 0.000 peak 9088 weight 0.10000E+01 volume 0.14500E+00 ppm1 6.829 ppm2 3.885 ASSI ( (segid " " and resid "131 " and name "HN ") )( (segid " " and resid "130 " and name "HG1 ") OR (segid " " and resid "130 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9089 weight 0.10000E+01 volume 0.78700E+00 ppm1 6.827 ppm2 1.873 ASSI ( (segid " " and resid "131 " and name "HN ") )( (segid " " and resid "131 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9091 weight 0.10000E+01 volume 0.12390E+01 ppm1 6.828 ppm2 1.496 ASSI ( (segid " " and resid "132 " and name "HN ") )( (segid " " and resid "129 " and name "HA ") ) 6.000 6.000 0.000 peak 9097 weight 0.10000E+01 volume 0.19300E+00 ppm1 7.012 ppm2 3.760 ASSI ( (segid " " and resid "132 " and name "HN ") )( (segid " " and resid "134 " and name "HD22") OR (segid " " and resid "134 " and name "HD21") OR (segid " " and resid "128 " and name "HD13") OR (segid " " and resid "128 " and name "HD12") OR (segid " " and resid "128 " and name "HD11") OR (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD12") ) 5.000 5.000 0.000 peak 9098 weight 0.10000E+01 volume 0.56300E+00 ppm1 7.015 ppm2 0.713 ASSI ( (segid " " and resid "132 " and name "HN ") )( (segid " " and resid "134 " and name "HD13") OR (segid " " and resid "128 " and name "HD23") OR (segid " " and resid "128 " and name "HD21") OR (segid " " and resid "102 " and name "HG22") OR (segid " " and resid "102 " and name "HG21") OR (segid " " and resid "102 " and name "HG13") OR (segid " " and resid "102 " and name "HG12") OR (segid " " and resid "102 " and name "HG11") ) 5.000 5.000 0.000 peak 9099 weight 0.10000E+01 volume 0.39700E+00 ppm1 7.008 ppm2 0.888 ASSI ( (segid " " and resid "132 " and name "HN ") )( (segid " " and resid "131 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9100 weight 0.10000E+01 volume 0.15400E+00 ppm1 7.015 ppm2 2.277 ASSI ( (segid " " and resid "133 " and name "HN ") )( (segid " " and resid "103 " and name "HD21") ) 6.000 6.000 0.000 peak 9109 weight 0.10000E+01 volume 0.10100E+00 ppm1 8.722 ppm2 7.536 ASSI ( (segid " " and resid "133 " and name "HN ") )( (segid " " and resid "103 " and name "HD22") ) 6.000 6.000 0.000 peak 9110 weight 0.10000E+01 volume 0.17200E+00 ppm1 8.724 ppm2 6.771 ASSI ( (segid " " and resid "133 " and name "HN ") )( (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") ) 6.000 6.000 0.000 peak 9111 weight 0.10000E+01 volume 0.27600E+00 ppm1 8.717 ppm2 1.185 ASSI ( (segid " " and resid "133 " and name "HN ") )( (segid " " and resid "134 " and name "HD23") OR (segid " " and resid "134 " and name "HD22") OR (segid " " and resid "134 " and name "HD21") OR (segid " " and resid "113 " and name "HG22") OR (segid " " and resid "113 " and name "HG21") ) 6.000 6.000 0.000 peak 9112 weight 0.10000E+01 volume 0.16000E+00 ppm1 8.723 ppm2 0.716 ASSI ( (segid " " and resid "133 " and name "HN ") )( (segid " " and resid "128 " and name "HD22") OR (segid " " and resid "112 " and name "HG2 ") OR (segid " " and resid "102 " and name "HG23") OR (segid " " and resid "102 " and name "HG22") OR (segid " " and resid "102 " and name "HG21") OR (segid " " and resid "102 " and name "HG13") OR (segid " " and resid "102 " and name "HG11") ) 6.000 6.000 0.000 peak 9113 weight 0.10000E+01 volume 0.23400E+00 ppm1 8.720 ppm2 0.861 ASSI ( (segid " " and resid "133 " and name "HN ") )( (segid " " and resid "111 " and name "HD23") OR (segid " " and resid "111 " and name "HD22") OR (segid " " and resid "111 " and name "HD21") ) 6.000 6.000 0.000 peak 9114 weight 0.10000E+01 volume 0.22200E+00 ppm1 8.720 ppm2 0.978 ASSI ( (segid " " and resid "134 " and name "HN ") )( (segid " " and resid "136 " and name "HN ") OR (segid " " and resid "103 " and name "HD21") ) 6.000 6.000 0.000 peak 9121 weight 0.10000E+01 volume 0.22600E+00 ppm1 7.964 ppm2 7.558 ASSI ( (segid " " and resid "134 " and name "HN ") )( (segid " " and resid "133 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9122 weight 0.10000E+01 volume 0.24300E+00 ppm1 7.966 ppm2 2.567 ASSI ( (segid " " and resid "135 " and name "HN ") )( (segid " " and resid "143 " and name "HG23") OR (segid " " and resid "143 " and name "HG22") OR (segid " " and resid "143 " and name "HG21") ) 6.000 6.000 0.000 peak 9131 weight 0.10000E+01 volume 0.11300E+00 ppm1 8.050 ppm2 1.251 ASSI ( (segid " " and resid "135 " and name "HN ") )( (segid " " and resid "134 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9132 weight 0.10000E+01 volume 0.23300E+00 ppm1 8.049 ppm2 1.569 ASSI ( (segid " " and resid "136 " and name "HN ") )( (segid " " and resid "143 " and name "HG23") OR (segid " " and resid "143 " and name "HG22") OR (segid " " and resid "143 " and name "HG21") OR (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") ) 5.000 5.000 0.000 peak 9142 weight 0.10000E+01 volume 0.51700E+00 ppm1 7.555 ppm2 1.206 ASSI ( (segid " " and resid "136 " and name "HN ") )( (segid " " and resid "136 " and name "HB2 ") OR (segid " " and resid "135 " and name "HB2 ") ) 3.300 3.300 0.000 peak 9143 weight 0.10000E+01 volume 0.22180E+01 ppm1 7.556 ppm2 3.096 ASSI ( (segid " " and resid "136 " and name "HN ") )( (segid " " and resid "136 " and name "HB1 ") OR (segid " " and resid "135 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9144 weight 0.10000E+01 volume 0.18950E+01 ppm1 7.560 ppm2 3.316 ASSI ( (segid " " and resid "136 " and name "HN ") )( (segid " " and resid "133 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9145 weight 0.10000E+01 volume 0.18400E+00 ppm1 7.555 ppm2 2.921 ASSI ( (segid " " and resid "137 " and name "HN ") )( (segid " " and resid "136 " and name "HN ") ) 5.000 5.000 0.000 peak 9149 weight 0.10000E+01 volume 0.13930E+01 ppm1 7.445 ppm2 7.547 ASSI ( (segid " " and resid "137 " and name "HN ") )( (segid " " and resid "137 " and name "HA ") ) 3.300 3.300 0.000 peak 9152 weight 0.10000E+01 volume 0.22400E+01 ppm1 7.447 ppm2 4.193 ASSI ( (segid " " and resid "138 " and name "HN ") )( (segid " " and resid "138 " and name "HB2 ") OR (segid " " and resid "137 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9158 weight 0.10000E+01 volume 0.11150E+01 ppm1 7.710 ppm2 1.579 ASSI ( (segid " " and resid "138 " and name "HN ") )( (segid " " and resid "144 " and name "HD2 ") OR (segid " " and resid "141 " and name "HA2 ") OR (segid " " and resid "114 " and name "HB1 ") OR (segid " " and resid "110 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9159 weight 0.10000E+01 volume 0.45700E+00 ppm1 7.709 ppm2 3.680 ASSI ( (segid " " and resid "138 " and name "HN ") )( (segid " " and resid "143 " and name "HA ") ) 6.000 6.000 0.000 peak 9160 weight 0.10000E+01 volume 0.46000E-01 ppm1 7.704 ppm2 5.320 ASSI ( (segid " " and resid "138 " and name "HN ") )( (segid " " and resid "114 " and name "HE2 ") ) 5.000 5.000 0.000 peak 9161 weight 0.10000E+01 volume 0.39700E+00 ppm1 7.706 ppm2 11.344 ASSI ( (segid " " and resid "139 " and name "HN ") )( (segid " " and resid "109 " and name "HA1 ") ) 5.000 5.000 0.000 peak 9169 weight 0.10000E+01 volume 0.46900E+00 ppm1 8.303 ppm2 4.321 ASSI ( (segid " " and resid "139 " and name "HN ") )( (segid " " and resid "141 " and name "HN ") OR (segid " " and resid "109 " and name "HN ") ) 6.000 6.000 0.000 peak 9170 weight 0.10000E+01 volume 0.19300E+00 ppm1 8.298 ppm2 8.500 ASSI ( (segid " " and resid "140 " and name "HN ") )( (segid " " and resid "141 " and name "HA1 ") OR (segid " " and resid "109 " and name "HA1 ") ) 5.000 5.000 0.000 peak 9179 weight 0.10000E+01 volume 0.31900E+00 ppm1 8.133 ppm2 4.341 ASSI ( (segid " " and resid "140 " and name "HN ") )( (segid " " and resid "138 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9180 weight 0.10000E+01 volume 0.28100E+00 ppm1 8.129 ppm2 1.548 ASSI ( (segid " " and resid "140 " and name "HN ") )( (segid " " and resid "141 " and name "HA2 ") OR (segid " " and resid "110 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9182 weight 0.10000E+01 volume 0.17100E+00 ppm1 8.142 ppm2 3.668 ASSI ( (segid " " and resid "141 " and name "HN ") )( (segid " " and resid "140 " and name "HB1 ") OR (segid " " and resid "139 " and name "HA ") ) 5.000 5.000 0.000 peak 9189 weight 0.10000E+01 volume 0.46600E+00 ppm1 8.449 ppm2 4.128 ASSI ( (segid " " and resid "141 " and name "HN ") )( (segid " " and resid "140 " and name "HA ") ) 5.000 5.000 0.000 peak 9190 weight 0.10000E+01 volume 0.39300E+00 ppm1 8.450 ppm2 4.510 ASSI ( (segid " " and resid "141 " and name "HN ") )( (segid " " and resid "140 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9191 weight 0.10000E+01 volume 0.27000E+00 ppm1 8.453 ppm2 3.927 ASSI ( (segid " " and resid "142 " and name "HN ") )( (segid " " and resid "140 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9196 weight 0.10000E+01 volume 0.26400E+00 ppm1 8.201 ppm2 4.113 ASSI ( (segid " " and resid "142 " and name "HN ") )( (segid " " and resid "137 " and name "HA ") ) 5.000 5.000 0.000 peak 9197 weight 0.10000E+01 volume 0.40300E+00 ppm1 8.198 ppm2 4.216 ASSI ( (segid " " and resid "142 " and name "HN ") )( (segid " " and resid "138 " and name "HN ") ) 5.000 5.000 0.000 peak 9198 weight 0.10000E+01 volume 0.71300E+00 ppm1 8.203 ppm2 7.693 ASSI ( (segid " " and resid "143 " and name "HN ") )( (segid " " and resid "146 " and name "HB2 ") OR (segid " " and resid "146 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9209 weight 0.10000E+01 volume 0.16380E+01 ppm1 8.545 ppm2 2.141 ASSI ( (segid " " and resid "145 " and name "HN ") )( (segid " " and resid "164 " and name "HB2 ") OR (segid " " and resid "160 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9217 weight 0.10000E+01 volume 0.84400E+00 ppm1 8.794 ppm2 1.901 ASSI ( (segid " " and resid "145 " and name "HN ") )( (segid " " and resid "160 " and name "HD13") OR (segid " " and resid "160 " and name "HD12") OR (segid " " and resid "160 " and name "HD11") ) 5.000 5.000 0.000 peak 9218 weight 0.10000E+01 volume 0.32600E+00 ppm1 8.799 ppm2 0.631 ASSI ( (segid " " and resid "145 " and name "HN ") )( (segid " " and resid "145 " and name "HD23") OR (segid " " and resid "145 " and name "HD22") OR (segid " " and resid "145 " and name "HD21") OR (segid " " and resid "145 " and name "HD13") OR (segid " " and resid "145 " and name "HD12") OR (segid " " and resid "145 " and name "HD11") OR (segid " " and resid "134 " and name "HD13") ) 5.000 5.000 0.000 peak 9219 weight 0.10000E+01 volume 0.62600E+00 ppm1 8.794 ppm2 0.972 ASSI ( (segid " " and resid "145 " and name "HN ") )( (segid " " and resid "144 " and name "HD1 ") ) 6.000 6.000 0.000 peak 9220 weight 0.10000E+01 volume 0.76000E-01 ppm1 8.796 ppm2 4.281 ASSI ( (segid " " and resid "145 " and name "HN ") )( (segid " " and resid "143 " and name "HB ") ) 5.000 5.000 0.000 peak 9221 weight 0.10000E+01 volume 0.40100E+00 ppm1 8.795 ppm2 4.733 ASSI ( (segid " " and resid "145 " and name "HN ") )( (segid " " and resid "160 " and name "HD23") OR (segid " " and resid "160 " and name "HD22") OR (segid " " and resid "160 " and name "HD21") OR (segid " " and resid "134 " and name "HD23") OR (segid " " and resid "134 " and name "HD22") OR (segid " " and resid "134 " and name "HD21") OR (segid " " and resid "117 " and name "HG23") OR (segid " " and resid "117 " and name "HG22") OR (segid " " and resid "117 " and name "HG21") OR (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD12") OR (segid " " and resid "113 " and name "HD11") OR (segid " " and resid "113 " and name "HG23") OR (segid " " and resid "113 " and name "HG22") ) 5.000 5.000 0.000 peak 9222 weight 0.10000E+01 volume 0.34200E+00 ppm1 8.793 ppm2 0.725 ASSI ( (segid " " and resid "145 " and name "HN ") )( (segid " " and resid "144 " and name "HD2 ") OR (segid " " and resid "144 " and name "HA ") ) 5.000 5.000 0.000 peak 9223 weight 0.10000E+01 volume 0.33200E+00 ppm1 8.796 ppm2 3.689 ASSI ( (segid " " and resid "146 " and name "HN ") )( (segid " " and resid "145 " and name "HD23") OR (segid " " and resid "145 " and name "HD22") OR (segid " " and resid "145 " and name "HD21") OR (segid " " and resid "145 " and name "HD13") OR (segid " " and resid "145 " and name "HD12") ) 6.000 6.000 0.000 peak 9230 weight 0.10000E+01 volume 0.26500E+00 ppm1 7.644 ppm2 0.968 ASSI ( (segid " " and resid "146 " and name "HN ") )( (segid " " and resid "149 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9231 weight 0.10000E+01 volume 0.20900E+00 ppm1 7.643 ppm2 1.872 ASSI ( (segid " " and resid "146 " and name "HN ") )( (segid " " and resid "164 " and name "HE3 ") OR (segid " " and resid "164 " and name "HE2 ") OR (segid " " and resid "164 " and name "HE1 ") OR (segid " " and resid "157 " and name "HE3 ") OR (segid " " and resid "157 " and name "HE1 ") OR (segid " " and resid "149 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9232 weight 0.10000E+01 volume 0.39300E+00 ppm1 7.640 ppm2 2.008 ASSI ( (segid " " and resid "147 " and name "HN ") )( (segid " " and resid "143 " and name "HN ") ) 6.000 6.000 0.000 peak 9243 weight 0.10000E+01 volume 0.20000E+00 ppm1 8.755 ppm2 8.563 ASSI ( (segid " " and resid "147 " and name "HN ") )( (segid " " and resid "147 " and name "HG ") OR (segid " " and resid "147 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9244 weight 0.10000E+01 volume 0.16170E+01 ppm1 8.753 ppm2 1.533 ASSI ( (segid " " and resid "147 " and name "HN ") )( (segid " " and resid "142 " and name "HD13") OR (segid " " and resid "142 " and name "HD12") OR (segid " " and resid "142 " and name "HD11") OR (segid " " and resid "117 " and name "HD13") OR (segid " " and resid "117 " and name "HD12") OR (segid " " and resid "117 " and name "HD11") ) 5.000 5.000 0.000 peak 9245 weight 0.10000E+01 volume 0.32800E+00 ppm1 8.758 ppm2 0.909 ASSI ( (segid " " and resid "147 " and name "HN ") )( (segid " " and resid "142 " and name "HD22") OR (segid " " and resid "142 " and name "HD21") ) 5.000 5.000 0.000 peak 9246 weight 0.10000E+01 volume 0.49200E+00 ppm1 8.756 ppm2 0.758 ASSI ( (segid " " and resid "148 " and name "HN ") )( (segid " " and resid "160 " and name "HD13") OR (segid " " and resid "160 " and name "HD12") OR (segid " " and resid "160 " and name "HD11") ) 6.000 6.000 0.000 peak 9255 weight 0.10000E+01 volume 0.16100E+00 ppm1 8.280 ppm2 0.624 ASSI ( (segid " " and resid "148 " and name "HN ") )( (segid " " and resid "160 " and name "HG ") OR (segid " " and resid "149 " and name "HG1 ") OR (segid " " and resid "145 " and name "HB1 ") OR (segid " " and resid "144 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9256 weight 0.10000E+01 volume 0.34100E+00 ppm1 8.273 ppm2 1.744 ASSI ( (segid " " and resid "148 " and name "HN ") )( (segid " " and resid "117 " and name "HG23") OR (segid " " and resid "117 " and name "HG22") OR (segid " " and resid "117 " and name "HG21") ) 5.000 5.000 0.000 peak 9257 weight 0.10000E+01 volume 0.10030E+01 ppm1 8.276 ppm2 0.768 ASSI ( (segid " " and resid "148 " and name "HN ") )( (segid " " and resid "157 " and name "HG2 ") OR (segid " " and resid "157 " and name "HG1 ") OR (segid " " and resid "150 " and name "HG2 ") OR (segid " " and resid "150 " and name "HB1 ") OR (segid " " and resid "146 " and name "HG2 ") ) 6.000 6.000 0.000 peak 9258 weight 0.10000E+01 volume 0.19000E+00 ppm1 8.275 ppm2 2.376 ASSI ( (segid " " and resid "148 " and name "HN ") )( (segid " " and resid "156 " and name "HG ") OR (segid " " and resid "151 " and name "HG1 ") OR (segid " " and resid "149 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9259 weight 0.10000E+01 volume 0.41400E+00 ppm1 8.280 ppm2 1.868 ASSI ( (segid " " and resid "148 " and name "HN ") )( (segid " " and resid "151 " and name "HN ") ) 6.000 6.000 0.000 peak 9260 weight 0.10000E+01 volume 0.49000E-01 ppm1 8.278 ppm2 7.783 ASSI ( (segid " " and resid "148 " and name "HN ") )( (segid " " and resid "117 " and name "HD13") OR (segid " " and resid "117 " and name "HD12") OR (segid " " and resid "117 " and name "HD11") ) 5.000 5.000 0.000 peak 9261 weight 0.10000E+01 volume 0.72300E+00 ppm1 8.275 ppm2 0.882 ASSI ( (segid " " and resid "149 " and name "HN ") )( (segid " " and resid "149 " and name "HD2 ") OR (segid " " and resid "149 " and name "HD1 ") ) 6.000 6.000 0.000 peak 9272 weight 0.10000E+01 volume 0.13000E-01 ppm1 8.556 ppm2 3.257 ASSI ( (segid " " and resid "149 " and name "HN ") )( (segid " " and resid "157 " and name "HB2 ") OR (segid " " and resid "147 " and name "HB1 ") OR (segid " " and resid "146 " and name "HB2 ") OR (segid " " and resid "146 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9273 weight 0.10000E+01 volume 0.53100E+00 ppm1 8.556 ppm2 2.167 ASSI ( (segid " " and resid "149 " and name "HN ") )( (segid " " and resid "157 " and name "HG2 ") OR (segid " " and resid "157 " and name "HG1 ") OR (segid " " and resid "150 " and name "HG2 ") OR (segid " " and resid "150 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9274 weight 0.10000E+01 volume 0.47800E+00 ppm1 8.554 ppm2 2.357 ASSI ( (segid " " and resid "150 " and name "HN ") )( (segid " " and resid "156 " and name "HD11") OR (segid " " and resid "147 " and name "HD23") OR (segid " " and resid "147 " and name "HD22") OR (segid " " and resid "147 " and name "HD21") ) 6.000 6.000 0.000 peak 9285 weight 0.10000E+01 volume 0.19200E+00 ppm1 8.440 ppm2 1.042 ASSI ( (segid " " and resid "150 " and name "HN ") )( (segid " " and resid "148 " and name "HB3 ") OR (segid " " and resid "148 " and name "HB2 ") OR (segid " " and resid "148 " and name "HB1 ") OR (segid " " and resid "147 " and name "HG ") ) 6.000 6.000 0.000 peak 9286 weight 0.10000E+01 volume 0.20800E+00 ppm1 8.432 ppm2 1.479 ASSI ( (segid " " and resid "150 " and name "HN ") )( (segid " " and resid "157 " and name "HA ") OR (segid " " and resid "148 " and name "HA ") ) 6.000 6.000 0.000 peak 9287 weight 0.10000E+01 volume 0.13400E+00 ppm1 8.431 ppm2 3.740 ASSI ( (segid " " and resid "150 " and name "HE21") )( (segid " " and resid "150 " and name "HG1 ") ) 5.000 5.000 0.000 peak 9300 weight 0.10000E+01 volume 0.38400E+00 ppm1 7.589 ppm2 2.560 ASSI ( (segid " " and resid "150 " and name "HE21") )( (segid " " and resid "150 " and name "HE22") ) 2.700 2.700 0.000 peak 9302 weight 0.10000E+01 volume 0.10957E+02 ppm1 7.586 ppm2 6.755 ASSI ( (segid " " and resid "150 " and name "HE22") )( (segid " " and resid "150 " and name "HG1 ") ) 6.000 6.000 0.000 peak 9303 weight 0.10000E+01 volume 0.24600E+00 ppm1 6.759 ppm2 2.561 ASSI ( (segid " " and resid "150 " and name "HE22") )( (segid " " and resid "150 " and name "HE21") ) 2.700 2.700 0.000 peak 9304 weight 0.10000E+01 volume 0.10819E+02 ppm1 6.756 ppm2 7.583 ASSI ( (segid " " and resid "151 " and name "HN ") )( (segid " " and resid "149 " and name "HN ") ) 6.000 6.000 0.000 peak 9306 weight 0.10000E+01 volume 0.23400E+00 ppm1 7.806 ppm2 8.544 ASSI ( (segid " " and resid "151 " and name "HN ") )( (segid " " and resid "151 " and name "HG1 ") OR (segid " " and resid "151 " and name "HB2 ") ) 3.300 3.300 0.000 peak 9307 weight 0.10000E+01 volume 0.33960E+01 ppm1 7.799 ppm2 1.842 ASSI ( (segid " " and resid "151 " and name "HN ") )( (segid " " and resid "151 " and name "HG2 ") OR (segid " " and resid "151 " and name "HB2 ") ) 3.300 3.300 0.000 peak 9308 weight 0.10000E+01 volume 0.29930E+01 ppm1 7.797 ppm2 1.746 ASSI ( (segid " " and resid "152 " and name "HN ") )( (segid " " and resid "151 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9318 weight 0.10000E+01 volume 0.56000E+00 ppm1 7.997 ppm2 1.782 ASSI ( (segid " " and resid "152 " and name "HN ") )( (segid " " and resid "156 " and name "HG ") OR (segid " " and resid "151 " and name "HG1 ") OR (segid " " and resid "149 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9319 weight 0.10000E+01 volume 0.48100E+00 ppm1 7.999 ppm2 1.860 ASSI ( (segid " " and resid "152 " and name "HN ") )( (segid " " and resid "153 " and name "HB3 ") OR (segid " " and resid "153 " and name "HB2 ") OR (segid " " and resid "153 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9320 weight 0.10000E+01 volume 0.28300E+00 ppm1 7.989 ppm2 1.373 ASSI ( (segid " " and resid "152 " and name "HN ") )( (segid " " and resid "151 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9321 weight 0.10000E+01 volume 0.33400E+00 ppm1 7.996 ppm2 2.136 ASSI ( (segid " " and resid "152 " and name "HN ") )( (segid " " and resid "150 " and name "HN ") ) 6.000 6.000 0.000 peak 9323 weight 0.10000E+01 volume 0.11700E+00 ppm1 7.995 ppm2 8.450 ASSI ( (segid " " and resid "153 " and name "HN ") )( (segid " " and resid "157 " and name "HA ") OR (segid " " and resid "148 " and name "HA ") ) 6.000 6.000 0.000 peak 9328 weight 0.10000E+01 volume 0.25100E+00 ppm1 7.831 ppm2 3.762 ASSI ( (segid " " and resid "153 " and name "HN ") )( (segid " " and resid "151 " and name "HA ") ) 5.000 5.000 0.000 peak 9330 weight 0.10000E+01 volume 0.32300E+00 ppm1 7.837 ppm2 4.323 ASSI ( (segid " " and resid "155 " and name "HD22") )( (segid " " and resid "155 " and name "HD21") ) 5.000 5.000 0.000 peak 9335 weight 0.10000E+01 volume 0.56000E+00 ppm1 7.160 ppm2 7.846 ASSI ( (segid " " and resid "156 " and name "HN ") )( (segid " " and resid "153 " and name "HB3 ") OR (segid " " and resid "153 " and name "HB2 ") OR (segid " " and resid "153 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9337 weight 0.10000E+01 volume 0.69000E+00 ppm1 7.138 ppm2 1.365 ASSI ( (segid " " and resid "157 " and name "HN ") )( (segid " " and resid "152 " and name "HA1 ") ) 5.000 5.000 0.000 peak 9347 weight 0.10000E+01 volume 0.57900E+00 ppm1 8.176 ppm2 4.004 ASSI ( (segid " " and resid "157 " and name "HN ") )( (segid " " and resid "156 " and name "HG ") ) 5.000 5.000 0.000 peak 9348 weight 0.10000E+01 volume 0.49400E+00 ppm1 8.181 ppm2 1.891 ASSI ( (segid " " and resid "157 " and name "HN ") )( (segid " " and resid "148 " and name "HB3 ") OR (segid " " and resid "148 " and name "HB2 ") OR (segid " " and resid "148 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9349 weight 0.10000E+01 volume 0.56700E+00 ppm1 8.173 ppm2 1.413 ASSI ( (segid " " and resid "157 " and name "HN ") )( (segid " " and resid "156 " and name "HD22") ) 6.000 6.000 0.000 peak 9350 weight 0.10000E+01 volume 0.17500E+00 ppm1 8.172 ppm2 0.748 ASSI ( (segid " " and resid "158 " and name "HN ") )( (segid " " and resid "161 " and name "HB2 ") OR (segid " " and resid "157 " and name "HE3 ") OR (segid " " and resid "157 " and name "HE2 ") OR (segid " " and resid "157 " and name "HE1 ") OR (segid " " and resid "156 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9361 weight 0.10000E+01 volume 0.62400E+00 ppm1 8.302 ppm2 2.080 ASSI ( (segid " " and resid "158 " and name "HN ") )( (segid " " and resid "156 " and name "HA ") ) 6.000 6.000 0.000 peak 9362 weight 0.10000E+01 volume 0.11200E+00 ppm1 8.302 ppm2 4.137 ASSI ( (segid " " and resid "158 " and name "HN ") )( (segid " " and resid "162 " and name "HA1 ") OR (segid " " and resid "161 " and name "HA ") OR (segid " " and resid "152 " and name "HA1 ") OR (segid " " and resid "126 " and name "HA ") ) 6.000 6.000 0.000 peak 9363 weight 0.10000E+01 volume 0.24300E+00 ppm1 8.307 ppm2 3.988 ASSI ( (segid " " and resid "158 " and name "HN ") )( (segid " " and resid "157 " and name "HG2 ") OR (segid " " and resid "157 " and name "HG1 ") OR (segid " " and resid "157 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9364 weight 0.10000E+01 volume 0.14640E+01 ppm1 8.298 ppm2 2.292 ASSI ( (segid " " and resid "159 " and name "HN ") )( (segid " " and resid "160 " and name "HD23") OR (segid " " and resid "160 " and name "HD22") OR (segid " " and resid "160 " and name "HD21") OR (segid " " and resid "156 " and name "HD22") ) 6.000 6.000 0.000 peak 9375 weight 0.10000E+01 volume 0.29300E+00 ppm1 7.371 ppm2 0.747 ASSI ( (segid " " and resid "159 " and name "HN ") )( (segid " " and resid "158 " and name "HA ") ) 5.000 5.000 0.000 peak 9376 weight 0.10000E+01 volume 0.46300E+00 ppm1 7.382 ppm2 4.333 ASSI ( (segid " " and resid "161 " and name "HN ") )( (segid " " and resid "145 " and name "HD23") OR (segid " " and resid "145 " and name "HD22") OR (segid " " and resid "145 " and name "HD21") OR (segid " " and resid "145 " and name "HD12") ) 5.000 5.000 0.000 peak 9394 weight 0.10000E+01 volume 0.65500E+00 ppm1 8.759 ppm2 0.984 ASSI ( (segid " " and resid "161 " and name "HN ") )( (segid " " and resid "159 " and name "HD12") OR (segid " " and resid "159 " and name "HD11") OR (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "159 " and name "HG21") OR (segid " " and resid "145 " and name "HD13") OR (segid " " and resid "145 " and name "HD12") OR (segid " " and resid "145 " and name "HD11") OR (segid " " and resid "134 " and name "HD13") OR (segid " " and resid "134 " and name "HD12") OR (segid " " and resid "134 " and name "HD11") ) 5.000 5.000 0.000 peak 9395 weight 0.10000E+01 volume 0.60900E+00 ppm1 8.759 ppm2 0.922 ASSI ( (segid " " and resid "161 " and name "HN ") )( (segid " " and resid "159 " and name "HA ") OR (segid " " and resid "157 " and name "HA ") ) 6.000 6.000 0.000 peak 9396 weight 0.10000E+01 volume 0.28600E+00 ppm1 8.764 ppm2 3.718 ASSI ( (segid " " and resid "161 " and name "HE21") )( (segid " " and resid "161 " and name "HB2 ") OR (segid " " and resid "161 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9410 weight 0.10000E+01 volume 0.34300E+00 ppm1 7.192 ppm2 2.163 ASSI ( (segid " " and resid "161 " and name "HE21") )( (segid " " and resid "161 " and name "HE22") ) 2.700 2.700 0.000 peak 9412 weight 0.10000E+01 volume 0.10932E+02 ppm1 7.193 ppm2 6.813 ASSI ( (segid " " and resid "161 " and name "HE22") )( (segid " " and resid "161 " and name "HE21") ) 2.700 2.700 0.000 peak 9413 weight 0.10000E+01 volume 0.13250E+02 ppm1 6.816 ppm2 7.188 ASSI ( (segid " " and resid "163 " and name "HN ") )( (segid " " and resid "164 " and name "HN ") OR (segid " " and resid "162 " and name "HN ") ) 5.000 5.000 0.000 peak 9421 weight 0.10000E+01 volume 0.19360E+01 ppm1 7.474 ppm2 7.591 ASSI ( (segid " " and resid "114 " and name "HD2 ") OR (segid " " and resid "31 " and name "HD2 ") )( (segid " " and resid "144 " and name "HA ") OR (segid " " and resid "114 " and name "HB1 ") OR (segid " " and resid "27 " and name "HA ") ) 5.000 5.000 0.000 peak 9447 weight 0.10000E+01 volume -0.81200E+00 ppm1 6.962 ppm2 3.671 ASSI ( (segid " " and resid "121 " and name "HD2 ") )( (segid " " and resid "117 " and name "HA ") OR (segid " " and resid "85 " and name "HD1 ") ) 6.000 6.000 0.000 peak 9448 weight 0.10000E+01 volume -0.50000E-01 ppm1 7.259 ppm2 3.467 ASSI ( (segid " " and resid "121 " and name "HD2 ") )( (segid " " and resid "124 " and name "HG23") OR (segid " " and resid "124 " and name "HG21") OR (segid " " and resid "124 " and name "HG13") OR (segid " " and resid "124 " and name "HG12") OR (segid " " and resid "124 " and name "HG11") ) 6.000 6.000 0.000 peak 9449 weight 0.10000E+01 volume -0.19800E+00 ppm1 7.265 ppm2 0.964 ASSI ( (segid " " and resid "121 " and name "HD2 ") )( (segid " " and resid "85 " and name "HA ") ) 6.000 6.000 0.000 peak 9450 weight 0.10000E+01 volume -0.12300E+00 ppm1 7.261 ppm2 3.756 ASSI ( (segid " " and resid "121 " and name "HD2 ") )( (segid " " and resid "119 " and name "HA ") ) 6.000 6.000 0.000 peak 9451 weight 0.10000E+01 volume -0.13300E+00 ppm1 7.274 ppm2 4.264 ASSI ( (segid " " and resid "121 " and name "HD2 ") )( (segid " " and resid "119 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9452 weight 0.10000E+01 volume -0.19200E+00 ppm1 7.269 ppm2 2.055 ASSI ( (segid " " and resid "121 " and name "HD2 ") )( (segid " " and resid "123 " and name "HB2 ") OR (segid " " and resid "120 " and name "HA1 ") OR (segid " " and resid "84 " and name "HA ") ) 6.000 6.000 0.000 peak 9453 weight 0.10000E+01 volume -0.77000E-01 ppm1 7.259 ppm2 4.021 ASSI ( (segid " " and resid "121 " and name "HD2 ") )( (segid " " and resid "124 " and name "HB ") OR (segid " " and resid "119 " and name "HG2 ") ) 6.000 6.000 0.000 peak 9454 weight 0.10000E+01 volume -0.13200E+00 ppm1 7.264 ppm2 2.407 ASSI ( (segid " " and resid "127 " and name "HZ ") )( (segid " " and resid "128 " and name "HD23") OR (segid " " and resid "128 " and name "HD22") OR (segid " " and resid "128 " and name "HD21") OR (segid " " and resid "102 " and name "HG23") OR (segid " " and resid "102 " and name "HG13") OR (segid " " and resid "102 " and name "HG12") OR (segid " " and resid "102 " and name "HG11") ) 6.000 6.000 0.000 peak 9457 weight 0.10000E+01 volume -0.13300E+00 ppm1 7.326 ppm2 0.905 ASSI ( (segid " " and resid "53 " and name "HD2 ") OR (segid " " and resid "53 " and name "HD1 ") )( (segid " " and resid "83 " and name "HB3 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "83 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9458 weight 0.10000E+01 volume -0.99500E+00 ppm1 7.197 ppm2 1.326 ASSI ( (segid " " and resid "53 " and name "HD2 ") OR (segid " " and resid "53 " and name "HD1 ") )( (segid " " and resid "91 " and name "HA ") OR (segid " " and resid "83 " and name "HA ") ) 5.000 5.000 0.000 peak 9459 weight 0.10000E+01 volume -0.54300E+00 ppm1 7.201 ppm2 3.792 ASSI ( (segid " " and resid "53 " and name "HD2 ") OR (segid " " and resid "53 " and name "HD1 ") )( (segid " " and resid "51 " and name "HE3 ") OR (segid " " and resid "51 " and name "HE2 ") OR (segid " " and resid "51 " and name "HE1 ") ) 5.000 5.000 0.000 peak 9460 weight 0.10000E+01 volume -0.30400E+00 ppm1 7.197 ppm2 1.686 ASSI ( (segid " " and resid "53 " and name "HZ ") )( (segid " " and resid "79 " and name "HA ") ) 6.000 6.000 0.000 peak 9461 weight 0.10000E+01 volume -0.11000E+00 ppm1 7.459 ppm2 4.738 ASSI ( (segid " " and resid "127 " and name "HE2 ") OR (segid " " and resid "127 " and name "HE1 ") )( (segid " " and resid "93 " and name "HG2 ") OR (segid " " and resid "89 " and name "HD23") OR (segid " " and resid "89 " and name "HD22") OR (segid " " and resid "89 " and name "HD21") ) 6.000 6.000 0.000 peak 9462 weight 0.10000E+01 volume -0.13300E+00 ppm1 7.225 ppm2 0.628 ASSI ( (segid " " and resid "127 " and name "HD2 ") OR (segid " " and resid "127 " and name "HD1 ") )( (segid " " and resid "128 " and name "HD23") OR (segid " " and resid "128 " and name "HD22") OR (segid " " and resid "128 " and name "HD21") ) 5.000 5.000 0.000 peak 9463 weight 0.10000E+01 volume -0.63400E+00 ppm1 7.132 ppm2 0.895 ASSI ( (segid " " and resid "127 " and name "HD2 ") OR (segid " " and resid "127 " and name "HD1 ") )( (segid " " and resid "93 " and name "HB2 ") OR (segid " " and resid "92 " and name "HG ") ) 6.000 6.000 0.000 peak 9464 weight 0.10000E+01 volume -0.84000E-01 ppm1 7.135 ppm2 1.627 ASSI ( (segid " " and resid "127 " and name "HD2 ") OR (segid " " and resid "127 " and name "HD1 ") )( (segid " " and resid "128 " and name "HA ") ) 6.000 6.000 0.000 peak 9465 weight 0.10000E+01 volume -0.78000E-01 ppm1 7.134 ppm2 3.864 ASSI ( (segid " " and resid "127 " and name "HD2 ") OR (segid " " and resid "127 " and name "HD1 ") )( (segid " " and resid "124 " and name "HA ") OR (segid " " and resid "93 " and name "HA ") OR (segid " " and resid "89 " and name "HA ") ) 6.000 6.000 0.000 peak 9466 weight 0.10000E+01 volume -0.12200E+00 ppm1 7.143 ppm2 3.742 ASSI ( (segid " " and resid "53 " and name "HE2 ") OR (segid " " and resid "53 " and name "HE1 ") )( (segid " " and resid "83 " and name "HB3 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "83 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9467 weight 0.10000E+01 volume -0.52700E+00 ppm1 7.325 ppm2 1.328 ASSI ( (segid " " and resid "53 " and name "HE2 ") OR (segid " " and resid "53 " and name "HE1 ") )( (segid " " and resid "82 " and name "HB2 ") OR (segid " " and resid "79 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9468 weight 0.10000E+01 volume -0.23700E+00 ppm1 7.320 ppm2 1.955 ASSI ( (segid " " and resid "53 " and name "HE2 ") OR (segid " " and resid "53 " and name "HE1 ") )( (segid " " and resid "82 " and name "HB1 ") OR (segid " " and resid "51 " and name "HG1 ") ) 6.000 6.000 0.000 peak 9469 weight 0.10000E+01 volume -0.22500E+00 ppm1 7.316 ppm2 2.309 ASSI ( (segid " " and resid "53 " and name "HE2 ") OR (segid " " and resid "53 " and name "HE1 ") )( (segid " " and resid "128 " and name "HD23") OR (segid " " and resid "128 " and name "HD22") OR (segid " " and resid "128 " and name 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and resid "129 " and name "HB1 ") )( (segid " " and resid "126 " and name "HA ") ) 5.000 5.000 0.000 peak 9483 weight 0.10000E+01 volume -0.60200E+00 ppm1 1.131 ppm2 4.007 ASSI ( (segid " " and resid "129 " and name "HB3 ") OR (segid " " and resid "129 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB1 ") )( (segid " " and resid "163 " and name "HD2 ") ) 5.000 5.000 0.000 peak 9487 weight 0.10000E+01 volume -0.71600E+00 ppm1 1.128 ppm2 7.009 ASSI ( (segid " " and resid "129 " and name "HB3 ") OR (segid " " and resid "129 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB1 ") )( (segid " " and resid "130 " and name "HD1 ") ) 5.000 5.000 0.000 peak 9484 weight 0.10000E+01 volume -0.10100E+01 ppm1 1.135 ppm2 3.472 ASSI ( (segid " " and resid "129 " and name "HB3 ") OR (segid " " and resid "129 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB1 ") )( (segid " " and resid "130 " and name "HD2 ") ) 5.000 5.000 0.000 peak 9485 weight 0.10000E+01 volume 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(segid " " and resid "8 " and name "HG13") OR (segid " " and resid "8 " and name "HG12") OR (segid " " and resid "8 " and name "HG11") )( (segid " " and resid "9 " and name "HB2 ") OR (segid " " and resid "9 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9529 weight 0.10000E+01 volume -0.50800E+00 ppm1 0.979 ppm2 3.167 ASSI ( (segid " " and resid "8 " and name "HG13") OR (segid " " and resid "8 " and name "HG12") OR (segid " " and resid "8 " and name "HG11") )( (segid " " and resid "12 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9530 weight 0.10000E+01 volume -0.53300E+00 ppm1 0.972 ppm2 3.007 ASSI ( (segid " " and resid "108 " and name "HG23") OR (segid " " and resid "108 " and name "HG22") OR (segid " " and resid "108 " and name "HG21") OR (segid " " and resid "10 " and name "HG12") OR (segid " " and resid "10 " and name "HG11") )( (segid " " and resid "110 " and name "HB1 ") OR (segid " " and resid "110 " and name "HA ") OR (segid " " and resid "107 " and name "HB2 ") OR (segid " " and resid "107 " and name "HB1 ") OR (segid " " and resid "39 " and name "HA ") ) 5.000 5.000 0.000 peak 10262 weight 0.10000E+01 volume -0.79500E+00 ppm1 1.150 ppm2 4.045 ASSI ( (segid " " and resid "108 " and name "HG23") OR (segid " " and resid "108 " and name "HG22") OR (segid " " and resid "108 " and name "HG21") )( (segid " " and resid "108 " and name "HB ") ) 2.700 2.700 0.000 peak 9531 weight 0.10000E+01 volume -0.46510E+01 ppm1 1.152 ppm2 4.557 ASSI ( (segid " " and resid "10 " and name "HG13") OR (segid " " and resid "10 " and name "HG12") OR (segid " " and resid "10 " and name "HG11") )( (segid " " and resid "36 " and name "HB1 ") OR (segid " " and resid "13 " and name "HD2 ") OR (segid " " and resid "9 " and name "HB2 ") OR (segid " " and resid "9 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9532 weight 0.10000E+01 volume -0.43000E+00 ppm1 1.131 ppm2 3.170 ASSI ( (segid " " and resid "128 " and name "HD23") OR (segid " " and resid "128 " and name "HD22") OR (segid " " and resid "128 " and name "HD21") OR (segid " " and resid "80 " and name "HG23") OR (segid " " and resid "80 " and name "HG22") OR (segid " " and resid "80 " and name "HG21") OR (segid " " and resid "50 " and name "HG13") OR (segid " " and resid "50 " and name "HG11") )( (segid " " and resid "127 " and name "HZ ") OR (segid " " and resid "53 " and name "HE2 ") OR (segid " " and resid "53 " and name "HE1 ") ) 5.000 5.000 0.000 peak 10267 weight 0.10000E+01 volume -0.32100E+00 ppm1 0.872 ppm2 7.331 ASSI ( (segid " " and resid "115 " and name "HD23") OR (segid " " and resid "115 " and name "HD22") OR (segid " " and resid "115 " and name "HD21") )( (segid " " and resid "105 " and name "HD23") OR (segid " " and resid "105 " and name "HD22") OR (segid " " and resid "105 " and name "HD21") ) 5.000 5.000 0.000 peak 9533 weight 0.10000E+01 volume -0.46900E+00 ppm1 0.960 ppm2 0.377 ASSI ( (segid " " and resid "86 " and name "HG23") OR (segid " " and resid "86 " and name "HG22") OR (segid " " and resid "86 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ppm1 0.819 ppm2 2.927 ASSI ( (segid " " and resid "89 " and name "HD13") OR (segid " " and resid "89 " and name "HD12") OR (segid " " and resid "89 " and name "HD11") )( (segid " " and resid "127 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9564 weight 0.10000E+01 volume -0.36500E+00 ppm1 0.819 ppm2 3.408 ASSI ( (segid " " and resid "89 " and name "HD13") OR (segid " " and resid "89 " and name "HD12") OR (segid " " and resid "89 " and name "HD11") )( (segid " " and resid "127 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9565 weight 0.10000E+01 volume -0.32600E+00 ppm1 0.840 ppm2 2.944 ASSI ( (segid " " and resid "30 " and name "HG ") )( (segid " " and resid "30 " and name "HA ") ) 5.000 5.000 0.000 peak 9566 weight 0.10000E+01 volume -0.41000E+00 ppm1 1.967 ppm2 4.224 ASSI ( (segid " " and resid "69 " and name "HG1 ") )( (segid " " and resid "100 " and name "HA ") ) 5.000 5.000 0.000 peak 9567 weight 0.10000E+01 volume -0.37900E+00 ppm1 2.127 ppm2 4.227 ASSI ( (segid " " and resid "69 " 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ppm2 3.379 ASSI ( (segid " " and resid "128 " and name "HD13") OR (segid " " and resid "128 " and name "HD12") OR (segid " " and resid "128 " and name "HD11") )( (segid " " and resid "132 " and name "HB2 ") OR (segid " " and resid "132 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9572 weight 0.10000E+01 volume -0.23900E+00 ppm1 0.714 ppm2 3.519 ASSI ( (segid " " and resid "145 " and name "HD13") OR (segid " " and resid "145 " and name "HD12") OR (segid " " and resid "145 " and name "HD11") )( (segid " " and resid "161 " and name "HG1 ") ) 5.000 5.000 0.000 peak 9573 weight 0.10000E+01 volume -0.59900E+00 ppm1 0.952 ppm2 2.539 ASSI ( (segid " " and resid "142 " and name "HG ") )( (segid " " and resid "140 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9574 weight 0.10000E+01 volume -0.21000E+00 ppm1 1.513 ppm2 3.913 ASSI ( (segid " " and resid "128 " and name "HD13") OR (segid " " and resid "128 " and name "HD12") OR (segid " " and resid "128 " and name "HD11") )( (segid " " and resid "105 " and name "HD23") OR (segid " " and resid "105 " and name "HD22") OR (segid " " and resid "105 " and name "HD21") ) 6.000 6.000 0.000 peak 9575 weight 0.10000E+01 volume -0.29600E+00 ppm1 0.704 ppm2 0.363 ASSI ( (segid " " and resid "95 " and name "HD12") OR (segid " " and resid "95 " and name "HD11") )( (segid " " and resid "79 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9576 weight 0.10000E+01 volume -0.53900E+00 ppm1 0.766 ppm2 2.447 ASSI ( (segid " " and resid "134 " and name "HD13") OR (segid " " and resid "134 " and name "HD12") OR (segid " " and resid "134 " and name "HD11") )( (segid " " and resid "164 " and name "HG1 ") ) 5.000 5.000 0.000 peak 9577 weight 0.10000E+01 volume -0.12070E+01 ppm1 0.926 ppm2 2.714 ASSI ( (segid " " and resid "134 " and name "HD13") OR (segid " " and resid "134 " and name "HD12") OR (segid " " and resid "134 " and name "HD11") )( (segid " " and resid "163 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9578 weight 0.10000E+01 volume -0.46000E+00 ppm1 0.926 ppm2 3.274 ASSI ( (segid " " and resid "134 " and name "HD13") OR (segid " " and resid "134 " and name "HD12") OR (segid " " and resid "134 " and name "HD11") )( (segid " " and resid "132 " and name "HB1 ") OR (segid " " and resid "130 " and name "HD1 ") ) 5.000 5.000 0.000 peak 9579 weight 0.10000E+01 volume -0.35200E+00 ppm1 0.926 ppm2 3.514 ASSI ( (segid " " and resid "142 " and name "HD13") OR (segid " " and resid "142 " and name "HD12") OR (segid " " and resid "142 " and name "HD11") )( (segid " " and resid "150 " and name "HG1 ") ) 6.000 6.000 0.000 peak 10463 weight 0.10000E+01 volume -0.29600E+00 ppm1 0.899 ppm2 2.554 ASSI ( (segid " " and resid "29 " and name "HD13") OR (segid " " and resid "29 " and name "HD12") OR (segid " " and resid "29 " and name "HD11") )( (segid " " and resid "14 " and name "HA ") ) 5.000 5.000 0.000 peak 9580 weight 0.10000E+01 volume -0.18110E+01 ppm1 0.771 ppm2 4.078 ASSI ( (segid " " and resid "29 " and name "HD13") OR (segid " " and resid "29 " and name "HD12") OR (segid " " and resid "29 " and name "HD11") )( (segid " " and resid "13 " and name "HD2 ") OR (segid " " and resid "13 " and name "HD1 ") ) 6.000 6.000 0.000 peak 9581 weight 0.10000E+01 volume -0.19700E+00 ppm1 0.772 ppm2 3.172 ASSI ( (segid " " and resid "92 " and name "HG ") )( (segid " " and resid "127 " and name "HE2 ") OR (segid " " and resid "127 " and name "HE1 ") ) 5.000 5.000 0.000 peak 9582 weight 0.10000E+01 volume -0.35600E+00 ppm1 1.620 ppm2 7.197 ASSI ( (segid " " and resid "149 " and name "HG2 ") OR (segid " " and resid "60 " and name "HG ") )( (segid " " and resid "150 " and name "HA ") OR (segid " " and resid "64 " and name "HA ") OR (segid " " and resid "57 " and name "HA ") ) 5.000 5.000 0.000 peak 9583 weight 0.10000E+01 volume -0.11150E+01 ppm1 1.532 ppm2 4.088 ASSI ( (segid " " and resid "63 " and name "HD13") OR (segid " " and resid "63 " and name "HD12") OR (segid " " and resid "63 " and name "HD11") )( (segid " " and resid "59 " and name "HB3 ") OR (segid " " and resid "59 " and name "HB2 ") OR (segid " " and resid "59 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9584 weight 0.10000E+01 volume -0.17620E+01 ppm1 0.658 ppm2 1.310 ASSI ( (segid " " and resid "63 " and name "HD13") OR (segid " " and resid "63 " and name "HD12") OR (segid " " and resid "63 " and name "HD11") )( (segid " " and resid "98 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9585 weight 0.10000E+01 volume -0.31600E+00 ppm1 0.659 ppm2 2.847 ASSI ( (segid " " and resid "92 " and name "HG ") OR (segid " " and resid "63 " and name "HG ") )( (segid " " and resid "96 " and name "HA ") OR (segid " " and resid "93 " and name "HA ") OR (segid " " and resid "89 " and name "HA ") OR (segid " " and resid "80 " and name "HA ") OR (segid " " and resid "59 " and name "HA ") ) 5.000 5.000 0.000 peak 9586 weight 0.10000E+01 volume -0.12330E+01 ppm1 1.620 ppm2 3.728 ASSI ( (segid " " and resid "92 " and name "HG ") )( (segid " " and resid "127 " and name "HE2 ") OR (segid " " and resid "127 " and name "HE1 ") ) 5.000 5.000 0.000 peak 9587 weight 0.10000E+01 volume -0.40000E+00 ppm1 1.646 ppm2 7.224 ASSI ( (segid " " and resid "63 " and name "HD13") OR (segid " " and resid "63 " and name "HD12") OR (segid " " and resid "63 " and name "HD11") )( (segid " " and resid "95 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9588 weight 0.10000E+01 volume -0.40300E+00 ppm1 0.659 ppm2 2.265 ASSI ( (segid " " and resid "37 " and name "HG2 ") )( (segid " " and resid "67 " and name "HA ") ) 5.000 5.000 0.000 peak 9589 weight 0.10000E+01 volume -0.73300E+00 ppm1 1.396 ppm2 4.016 ASSI ( (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") )( (segid " " and resid "132 " and name "HB2 ") OR (segid " " and resid "132 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9590 weight 0.10000E+01 volume -0.66700E+00 ppm1 1.193 ppm2 3.528 ASSI ( (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") )( (segid " " and resid "144 " and name "HD1 ") OR (segid " " and resid "112 " and name "HD1 ") ) 5.000 5.000 0.000 peak 9591 weight 0.10000E+01 volume -0.60600E+00 ppm1 1.197 ppm2 4.276 ASSI ( (segid " " and resid "30 " and name "HD13") OR (segid " " and resid "30 " and name "HD12") OR (segid " " and resid "30 " and name "HD11") )( (segid " " and resid "31 " and name "HD2 ") ) 6.000 6.000 0.000 peak 9592 weight 0.10000E+01 volume -0.11600E+00 ppm1 0.666 ppm2 6.945 ASSI ( (segid " " and resid "30 " and name "HD13") OR (segid " " and resid "30 " and name "HD12") OR (segid " " and resid "30 " and name "HD11") )( (segid " " and resid "62 " and name "HA ") ) 5.000 5.000 0.000 peak 9593 weight 0.10000E+01 volume -0.12560E+01 ppm1 0.668 ppm2 3.780 ASSI ( (segid " " and resid "30 " and name "HD13") OR (segid " " and resid "30 " and name "HD12") )( (segid " " and resid "65 " and name "HG2 ") OR (segid " " and resid "61 " and name "HG1 ") ) 5.000 5.000 0.000 peak 9594 weight 0.10000E+01 volume -0.61700E+00 ppm1 0.663 ppm2 2.455 ASSI ( (segid " " and resid "30 " and name "HD13") OR (segid " " and resid "30 " and name "HD12") OR (segid " " and resid "30 " and name "HD11") )( (segid " " and resid "65 " and name "HG1 ") ) 5.000 5.000 0.000 peak 9595 weight 0.10000E+01 volume -0.36900E+00 ppm1 0.659 ppm2 2.580 ASSI ( (segid " " and resid "48 " and name "HD13") OR (segid " " and resid "48 " and name "HD11") )( (segid " " and resid "79 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9596 weight 0.10000E+01 volume -0.21900E+00 ppm1 0.819 ppm2 2.449 ASSI ( (segid " " and resid "48 " and name "HD13") OR (segid " " and resid "48 " and name "HD12") )( (segid " " and resid "63 " and name "HA ") ) 5.000 5.000 0.000 peak 9597 weight 0.10000E+01 volume -0.50800E+00 ppm1 0.817 ppm2 3.911 ASSI ( (segid " " and resid "24 " and name "HB1 ") )( (segid " " and resid "23 " and name "HG22") OR (segid " " and resid "23 " and name "HG21") OR (segid " " and resid "23 " and name "HG13") OR (segid " " and resid "23 " and name "HG12") OR (segid " " and resid "23 " and name "HG11") ) 5.000 5.000 0.000 peak 9598 weight 0.10000E+01 volume -0.40300E+00 ppm1 2.235 ppm2 0.916 ASSI ( (segid " " and resid "156 " and name "HD13") OR (segid " " and resid "156 " and name "HD12") OR (segid " " and resid "156 " and name "HD11") )( (segid " " and resid "120 " and name "HA2 ") OR (segid " " and resid "117 " and name "HA ") ) 3.300 3.300 0.000 peak 9599 weight 0.10000E+01 volume -0.22960E+01 ppm1 0.997 ppm2 3.519 ASSI ( (segid " " and resid "20 " and name "HG2 ") )( (segid " " and resid "20 " and name "HD1 ") ) 5.000 5.000 0.000 peak 10539 weight 0.10000E+01 volume -0.11800E+01 ppm1 1.765 ppm2 3.353 ASSI ( (segid " " and resid "156 " and name "HD13") OR (segid " " and resid "156 " and name "HD12") OR (segid " " and resid "156 " and name "HD11") OR (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") OR (segid " " and resid "92 " and name "HD11") )( (segid " " and resid "154 " and name "HA ") OR (segid " " and resid "151 " and name "HA ") OR (segid " " and resid "149 " and name "HA ") OR (segid " " and resid "127 " and name "HA ") OR (segid " " and resid "123 " and name "HA ") OR (segid " " and resid "112 " and name "HD1 ") OR (segid " " and resid "90 " and name "HA ") OR (segid " " and resid "86 " and name "HA ") ) 5.000 5.000 0.000 peak 9600 weight 0.10000E+01 volume -0.35900E+00 ppm1 0.957 ppm2 4.307 ASSI ( (segid " " and resid "20 " and name "HG2 ") )( (segid " " and resid "20 " and name "HA ") ) 5.000 5.000 0.000 peak 10540 weight 0.10000E+01 volume -0.55000E+00 ppm1 1.765 ppm2 4.516 ASSI ( (segid " " and resid "20 " and name "HG1 ") )( (segid " " and resid "20 " and name "HA ") ) 5.000 5.000 0.000 peak 10541 weight 0.10000E+01 volume -0.56000E+00 ppm1 1.926 ppm2 4.505 ASSI ( (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") OR (segid " " and resid "92 " and name "HD11") )( (segid " " and resid "127 " and name "HB1 ") OR (segid " " and resid "88 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9601 weight 0.10000E+01 volume -0.49100E+00 ppm1 0.955 ppm2 3.421 ASSI ( (segid " " and resid "147 " and name "HD13") OR (segid " " and resid "147 " and name "HD12") OR (segid " " and resid "147 " and name "HD11") )( (segid " " and resid "114 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9602 weight 0.10000E+01 volume -0.61200E+00 ppm1 1.193 ppm2 3.514 ASSI ( (segid " " and resid "147 " and name "HD13") OR (segid " " and resid "147 " and name "HD12") OR (segid " " and resid "147 " and name "HD11") )( (segid " " and resid "114 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9603 weight 0.10000E+01 volume -0.12090E+01 ppm1 1.193 ppm2 3.675 ASSI ( (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") OR (segid " " and resid "92 " and name "HD11") )( (segid " " and resid "127 " and name "HD2 ") OR (segid " " and resid "127 " and name "HD1 ") ) 5.000 5.000 0.000 peak 9604 weight 0.10000E+01 volume -0.10220E+01 ppm1 0.952 ppm2 7.117 ASSI ( (segid " " and resid "144 " and name "HG2 ") )( (segid " " and resid "144 " and name "HG1 ") OR (segid " " and resid "134 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9605 weight 0.10000E+01 volume -0.25700E+00 ppm1 0.547 ppm2 1.678 ASSI ( (segid " " and resid "144 " and name "HG2 ") )( (segid " " and resid "144 " and name "HD2 ") OR (segid " " and resid "144 " and name "HA ") ) 6.000 6.000 0.000 peak 9606 weight 0.10000E+01 volume -0.14500E+00 ppm1 0.535 ppm2 3.714 ASSI ( (segid " " and resid "159 " and name "HG12") OR (segid " " and resid "147 " and name "HD13") OR (segid " " and resid "147 " and name "HD12") OR (segid " " and resid "147 " and name "HD11") )( (segid " " and resid "160 " and name "HD13") OR (segid " " and resid "160 " and name "HD12") OR (segid " " and resid "160 " and name "HD11") OR (segid " " and resid "134 " and name "HD22") OR (segid " " and resid "134 " and name "HD21") ) 5.000 5.000 0.000 peak 10549 weight 0.10000E+01 volume -0.60200E+00 ppm1 1.176 ppm2 0.659 ASSI ( (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") OR (segid " " and resid "92 " and name "HD11") )( (segid " " and resid "127 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9607 weight 0.10000E+01 volume -0.14400E+00 ppm1 0.952 ppm2 2.951 ASSI ( (segid " " and resid "112 " and name "HG2 ") )( (segid " " and resid "112 " and name "HD2 ") ) 5.000 5.000 0.000 peak 12979 weight 0.10000E+01 volume -0.30700E+00 ppm1 0.855 ppm2 3.969 ASSI ( (segid " " and resid "159 " and name "HG11") )( (segid " " and resid "126 " and name "HB2 ") OR (segid " " and resid "126 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9608 weight 0.10000E+01 volume -0.57100E+00 ppm1 1.913 ppm2 3.888 ASSI ( (segid " " and resid "159 " and name "HG11") OR (segid " " and resid "118 " and name "HG1 ") OR (segid " " and resid "42 " and name "HB1 ") )( (segid " " and resid "162 " and name "HA1 ") OR (segid " " and resid "152 " and name "HA1 ") OR (segid " " and resid "126 " and name "HA ") OR (segid " " and resid "123 " and name "HB1 ") OR (segid " " and resid "120 " and name "HA1 ") OR (segid " " and resid "114 " and name "HA ") OR (segid " " and resid "39 " and name "HA ") OR (segid " " and resid "15 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9609 weight 0.10000E+01 volume -0.72600E+00 ppm1 1.940 ppm2 4.012 ASSI ( (segid " " and resid "150 " and name "HB1 ") )( (segid " " and resid "147 " and name "HA ") ) 5.000 5.000 0.000 peak 9610 weight 0.10000E+01 volume -0.55100E+00 ppm1 2.410 ppm2 4.206 ASSI ( (segid " " and resid "150 " and name "HB2 ") )( (segid " " and resid "147 " and name "HA ") ) 5.000 5.000 0.000 peak 9611 weight 0.10000E+01 volume -0.76400E+00 ppm1 2.233 ppm2 4.208 ASSI ( (segid " " and resid "33 " and name "HB2 ") )( (segid " " and resid "29 " and name "HA ") ) 5.000 5.000 0.000 peak 9612 weight 0.10000E+01 volume -0.52100E+00 ppm1 2.322 ppm2 3.889 ASSI ( (segid " " and resid "61 " and name "HB1 ") )( (segid " " and resid "58 " and name "HA ") OR (segid " " and resid "23 " and name "HA ") ) 5.000 5.000 0.000 peak 9613 weight 0.10000E+01 volume -0.46700E+00 ppm1 1.954 ppm2 3.413 ASSI ( (segid " " and resid "64 " and name "HD2 ") OR (segid " " and resid "64 " and name "HD1 ") )( (segid " " and resid "61 " and name "HA ") ) 5.000 5.000 0.000 peak 9614 weight 0.10000E+01 volume -0.37900E+00 ppm1 1.692 ppm2 3.875 ASSI ( (segid " " and resid "121 " and name "HB1 ") )( (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB1 ") OR (segid " " and resid "84 " and name "HB3 ") ) 6.000 6.000 0.000 peak 9615 weight 0.10000E+01 volume -0.21000E+00 ppm1 3.141 ppm2 1.486 ASSI ( (segid " " and resid "93 " and name "HD2 ") OR (segid " " and resid "93 " and name "HD1 ") )( (segid " " and resid "90 " and name "HA ") ) 5.000 5.000 0.000 peak 9616 weight 0.10000E+01 volume -0.86400E+00 ppm1 1.453 ppm2 4.251 ASSI ( (segid " " and resid "146 " and name "HB2 ") OR (segid " " and resid "146 " and name "HB1 ") )( (segid " " and resid "142 " and name "HA ") ) 6.000 6.000 0.000 peak 9617 weight 0.10000E+01 volume -0.18600E+00 ppm1 2.127 ppm2 4.955 ASSI ( (segid " " and resid "146 " and name "HB2 ") OR (segid " " and resid "146 " and name "HB1 ") )( (segid " " and resid "142 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9619 weight 0.10000E+01 volume -0.11040E+01 ppm1 2.143 ppm2 1.355 ASSI ( (segid " " and resid "119 " and name "HB2 ") )( (segid " " and resid "121 " and name "HD2 ") ) 6.000 6.000 0.000 peak 9620 weight 0.10000E+01 volume -0.29800E+00 ppm1 1.553 ppm2 7.250 ASSI ( (segid " " and resid "119 " and name "HB1 ") )( (segid " " and resid "121 " and name "HD2 ") ) 6.000 6.000 0.000 peak 9622 weight 0.10000E+01 volume -0.19000E+00 ppm1 2.056 ppm2 7.252 ASSI ( (segid " " and resid "51 " and name "HG2 ") )( (segid " " and resid "48 " and name "HA ") ) 6.000 6.000 0.000 peak 9623 weight 0.10000E+01 volume -0.29200E+00 ppm1 1.180 ppm2 3.778 ASSI ( (segid " " and resid "121 " and name "HB2 ") )( (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9624 weight 0.10000E+01 volume -0.27300E+00 ppm1 3.022 ppm2 1.487 ASSI ( (segid " " and resid "51 " and name "HG1 ") )( (segid " " and resid "48 " and name "HA ") ) 5.000 5.000 0.000 peak 9625 weight 0.10000E+01 volume -0.31300E+00 ppm1 2.327 ppm2 3.788 ASSI ( (segid " " and resid "28 " and name "HB2 ") OR (segid " " and resid "28 " and name "HB1 ") )( (segid " " and resid "28 " and name "HD2 ") ) 5.000 5.000 0.000 peak 10685 weight 0.10000E+01 volume -0.10940E+01 ppm1 1.967 ppm2 3.037 ASSI ( (segid " " and resid "130 " and name "HB1 ") OR (segid " " and resid "125 " and name "HB ") OR (segid " " and resid "10 " and name "HB ") )( (segid " " and resid "129 " and name "HA ") OR (segid " " and resid "124 " and name "HA ") OR (segid " " and resid "35 " and name "HA ") OR (segid " " and resid "11 " and name "HA2 ") ) 5.000 5.000 0.000 peak 9626 weight 0.10000E+01 volume -0.12130E+01 ppm1 2.252 ppm2 3.780 ASSI ( (segid " " and resid "81 " and name "HB2 ") )( (segid " " and resid "77 " and name "HG23") OR (segid " " and resid "77 " and name "HG22") OR (segid " " and resid "77 " and name "HG21") ) 5.000 5.000 0.000 peak 9627 weight 0.10000E+01 volume -0.10870E+01 ppm1 3.274 ppm2 1.235 ASSI ( (segid " " and resid "114 " and name "HB2 ") )( (segid " " and resid "147 " and name "HD13") OR (segid " " and resid "147 " and name "HD12") OR (segid " " and resid "147 " and name "HD11") ) 6.000 6.000 0.000 peak 9628 weight 0.10000E+01 volume -0.14300E+00 ppm1 3.514 ppm2 1.193 ASSI ( (segid " " and resid "36 " and name "HB2 ") )( (segid " " and resid "39 " and name "HB3 ") OR (segid " " and resid "39 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9629 weight 0.10000E+01 volume -0.26300E+00 ppm1 2.876 ppm2 1.398 ASSI ( (segid " " and resid "36 " and name "HB1 ") )( (segid " " and resid "39 " and name "HB3 ") OR (segid " " and resid "39 " and name "HB2 ") OR (segid " " and resid "39 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9630 weight 0.10000E+01 volume -0.21900E+00 ppm1 3.194 ppm2 1.397 ASSI ( (segid " " and resid "137 " and name "HB2 ") )( (segid " " and resid "144 " and name "HD2 ") OR (segid " " and resid "141 " and name "HA2 ") ) 6.000 6.000 0.000 peak 9631 weight 0.10000E+01 volume -0.22300E+00 ppm1 1.273 ppm2 3.701 ASSI ( (segid " " and resid "37 " and name "HB2 ") )( (segid " " and resid "67 " and name "HA ") ) 5.000 5.000 0.000 peak 9632 weight 0.10000E+01 volume -0.11160E+01 ppm1 1.690 ppm2 4.033 ASSI ( (segid " " and resid "69 " and name "HB1 ") OR (segid " " and resid "64 " and name "HB2 ") )( (segid " " and resid "99 " and name "HA2 ") OR (segid " " and resid "61 " and name "HA ") ) 5.000 5.000 0.000 peak 9633 weight 0.10000E+01 volume -0.87100E+00 ppm1 1.902 ppm2 3.881 ASSI ( (segid " " and resid "136 " and name "HB2 ") )( (segid " " and resid "133 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9634 weight 0.10000E+01 volume -0.88000E-01 ppm1 3.034 ppm2 2.537 ASSI ( (segid " " and resid "96 " and name "HB ") )( (segid " " and resid "127 " and name "HE2 ") OR (segid " " and resid "127 " and name "HE1 ") ) 5.000 5.000 0.000 peak 9635 weight 0.10000E+01 volume -0.36900E+00 ppm1 2.340 ppm2 7.217 ASSI ( (segid " " and resid "136 " and name "HB1 ") )( (segid " " and resid "111 " and name "HD23") OR (segid " " and resid "111 " and name "HD22") OR (segid " " and resid "111 " and name "HD21") ) 6.000 6.000 0.000 peak 9636 weight 0.10000E+01 volume -0.25800E+00 ppm1 3.285 ppm2 0.935 ASSI ( (segid " " and resid "79 " and name "HB2 ") OR (segid " " and resid "69 " and name "HB1 ") OR (segid " " and resid "37 " and name "HB1 ") )( (segid " " and resid "100 " and name "HB3 ") OR (segid " " and resid "100 " and name "HB2 ") OR (segid " " and resid "100 " and name "HB1 ") OR (segid " " and resid "95 " and name "HB2 ") OR (segid " " and resid "67 " and name "HB3 ") OR (segid " " and resid "67 " and name "HB2 ") OR (segid " " and resid "67 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9637 weight 0.10000E+01 volume -0.16610E+01 ppm1 1.947 ppm2 1.137 ASSI ( (segid " " and resid "136 " and name "HB1 ") )( (segid " " and resid "133 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9638 weight 0.10000E+01 volume -0.14300E+00 ppm1 3.274 ppm2 2.554 ASSI ( (segid " " and resid "79 " and name "HB2 ") )( (segid " " and resid "53 " and name "HE2 ") OR (segid " " and resid "53 " and name "HE1 ") ) 6.000 6.000 0.000 peak 9639 weight 0.10000E+01 volume -0.93000E-01 ppm1 1.940 ppm2 7.304 ASSI ( (segid " " and resid "79 " and name "HB1 ") )( (segid " " and resid "53 " and name "HE2 ") OR (segid " " and resid "53 " and name "HE1 ") ) 6.000 6.000 0.000 peak 9640 weight 0.10000E+01 volume -0.20200E+00 ppm1 2.440 ppm2 7.319 ASSI ( (segid " " and resid "96 " and name "HB ") )( (segid " " and resid "127 " and name "HZ ") ) 5.000 5.000 0.000 peak 9641 weight 0.10000E+01 volume -0.41100E+00 ppm1 2.340 ppm2 7.331 ASSI ( (segid " " and resid "79 " and name "HB1 ") )( (segid " " and resid "69 " and name "HB2 ") OR (segid " " and resid "51 " and name "HE3 ") OR (segid " " and resid "51 " and name "HE2 ") OR (segid " " and resid "48 " and name "HG ") ) 5.000 5.000 0.000 peak 9642 weight 0.10000E+01 volume -0.38100E+00 ppm1 2.447 ppm2 1.714 ASSI ( (segid " " and resid "136 " and name "HB1 ") )( (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") ) 5.000 5.000 0.000 peak 9643 weight 0.10000E+01 volume -0.53500E+00 ppm1 3.290 ppm2 1.200 ASSI ( (segid " " and resid "164 " and name "HG1 ") )( (segid " " and resid "134 " and name "HD23") OR (segid " " and resid "134 " and name "HD22") OR (segid " " and resid "134 " and name "HD21") ) 6.000 6.000 0.000 peak 9645 weight 0.10000E+01 volume -0.17400E+00 ppm1 2.701 ppm2 0.712 ASSI ( (segid " " and resid "110 " and name "HA ") )( (segid " " and resid "144 " and name "HD1 ") OR (segid " " and resid "141 " and name "HA1 ") OR (segid " " and resid "112 " and name "HD1 ") OR (segid " " and resid "109 " and name "HA1 ") ) 5.000 5.000 0.000 peak 9646 weight 0.10000E+01 volume -0.48800E+00 ppm1 4.119 ppm2 4.325 ASSI ( (segid " " and resid "157 " and name "HB1 ") )( (segid " " and resid "148 " and name "HB3 ") OR (segid " " and resid "148 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9647 weight 0.10000E+01 volume 0.34000E+00 ppm1 2.284 ppm2 1.433 ASSI ( (segid " " and resid "110 " and name "HA ") OR (segid " " and resid "64 " and name "HA ") OR (segid " " and resid "13 " and name "HA ") )( (segid " " and resid "115 " and name "HD23") OR (segid " " and resid "115 " and name "HD22") OR (segid " " and resid "115 " and name "HD21") OR (segid " " and resid "111 " and name "HD23") OR (segid " " and resid "111 " and name "HD22") OR (segid " " and resid "111 " and name "HD21") OR (segid " " and resid "60 " and name "HD23") OR (segid " " and resid "60 " and name "HD22") OR (segid " " and resid "60 " and name "HD21") OR (segid " " and resid "60 " and name "HD13") OR (segid " " and resid "60 " and name "HD12") OR (segid " " and resid "35 " and name "HG23") OR (segid " " and resid "35 " and name "HG21") OR (segid " " and resid "35 " and name "HG13") OR (segid " " and resid "35 " and name "HG11") ) 5.000 5.000 0.000 peak 9649 weight 0.10000E+01 volume -0.90500E+00 ppm1 4.110 ppm2 0.959 ASSI ( (segid " " and resid "64 " and name "HA ") OR (segid " " and resid "13 " and name "HA ") )( (segid " " and resid "67 " and name "HB3 ") OR (segid " " and resid "67 " and name "HB1 ") OR (segid " " and resid "10 " and name "HG22") OR (segid " " and resid "10 " and name "HG21") OR (segid " " and resid "10 " and name "HG13") OR (segid " " and resid "10 " and name "HG12") OR (segid " " and resid "10 " and name "HG11") ) 6.000 6.000 0.000 peak 9650 weight 0.10000E+01 volume -0.22100E+00 ppm1 4.128 ppm2 1.113 ASSI ( (segid " " and resid "149 " and name "HA ") )( (segid " " and resid "157 " and name "HG2 ") OR (segid " " and resid "157 " and name "HG1 ") ) 5.000 5.000 0.000 peak 9652 weight 0.10000E+01 volume -0.58800E+00 ppm1 4.333 ppm2 2.345 ASSI ( (segid " " and resid "13 " and name "HA ") )( (segid " " and resid "13 " and name "HD1 ") ) 5.000 5.000 0.000 peak 9653 weight 0.10000E+01 volume -0.66600E+00 ppm1 4.128 ppm2 3.167 ASSI ( (segid " " and resid "110 " and name "HA ") OR (segid " " and resid "64 " and name "HA ") OR (segid " " and resid "13 " and name "HA ") )( (segid " " and resid "140 " and name "HB2 ") OR (segid " " and resid "63 " and name "HA ") OR (segid " " and resid "61 " and name "HA ") OR (segid " " and resid "10 " and name "HA ") ) 5.000 5.000 0.000 peak 9654 weight 0.10000E+01 volume -0.13720E+01 ppm1 4.116 ppm2 3.888 ASSI ( (segid " " and resid "51 " and name "HB2 ") )( (segid " " and resid "62 " and name "HD13") OR (segid " " and resid "62 " and name "HD12") OR (segid " " and resid "62 " and name "HD11") ) 6.000 6.000 0.000 peak 9655 weight 0.10000E+01 volume 0.86000E-01 ppm1 1.450 ppm2 0.689 ASSI ( (segid " " and resid "157 " and name "HB2 ") )( (segid " " and resid "161 " and name "HA ") OR (segid " " and resid "152 " and name "HA1 ") OR (segid " " and resid "146 " and name "HA ") ) 5.000 5.000 0.000 peak 9656 weight 0.10000E+01 volume 0.40500E+00 ppm1 2.174 ppm2 4.008 ASSI ( (segid " " and resid "51 " and name "HB1 ") )( (segid " " and resid "48 " and name "HA ") ) 5.000 5.000 0.000 peak 9657 weight 0.10000E+01 volume 0.30500E+00 ppm1 1.969 ppm2 3.795 ASSI ( (segid " " and resid "51 " and name "HB2 ") )( (segid " " and resid "62 " and name "HD23") OR (segid " " and resid "62 " and name "HD22") OR (segid " " and resid "58 " and name "HG13") OR (segid " " and resid "58 " and name "HG12") OR (segid " " and resid "58 " and name "HG11") OR (segid " " and resid "50 " and name "HG22") OR (segid " " and resid "50 " and name "HG21") ) 5.000 5.000 0.000 peak 9658 weight 0.10000E+01 volume 0.45100E+00 ppm1 1.451 ppm2 0.955 ASSI ( (segid " " and resid "51 " and name "HB1 ") )( (segid " " and resid "62 " and name "HD23") OR (segid " " and resid "62 " and name "HD22") OR (segid " " and resid "62 " and name "HD21") OR (segid " " and resid "58 " and name "HG13") OR (segid " " and resid "58 " and name "HG12") OR (segid " " and resid "58 " and name "HG11") OR (segid " " and resid "50 " and name "HG23") OR (segid " " and resid "50 " and name "HG22") OR (segid " " and resid "50 " and name "HG21") ) 5.000 5.000 0.000 peak 9659 weight 0.10000E+01 volume 0.13380E+01 ppm1 1.961 ppm2 0.941 ASSI ( (segid " " and resid "51 " and name "HB1 ") )( (segid " " and resid "18 " and name "HB3 ") OR (segid " " and resid "18 " and name "HB2 ") OR (segid " " and resid "18 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9660 weight 0.10000E+01 volume 0.79500E+00 ppm1 1.962 ppm2 1.322 ASSI ( (segid " " and resid "157 " and name "HB1 ") )( (segid " " and resid "145 " and name "HD23") OR (segid " " and resid "145 " and name "HD21") ) 5.000 5.000 0.000 peak 9661 weight 0.10000E+01 volume 0.95900E+00 ppm1 2.275 ppm2 0.995 ASSI ( (segid " " and resid "157 " and name "HB1 ") )( (segid " " and resid "152 " and name "HA1 ") ) 5.000 5.000 0.000 peak 9662 weight 0.10000E+01 volume 0.42200E+00 ppm1 2.295 ppm2 4.014 ASSI ( (segid " " and resid "51 " and name "HB2 ") )( (segid " " and resid "51 " and name "HE3 ") OR (segid " " and resid "51 " and name "HE2 ") OR (segid " " and resid "51 " and name "HE1 ") ) 6.000 6.000 0.000 peak 9663 weight 0.10000E+01 volume 0.17700E+00 ppm1 1.456 ppm2 1.679 ASSI ( (segid " " and resid "157 " and name "HB2 ") )( (segid " " and resid "148 " and name "HB3 ") OR (segid " " and resid "148 " and name "HB2 ") OR (segid " " and resid "148 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9664 weight 0.10000E+01 volume 0.40400E+00 ppm1 2.169 ppm2 1.432 ASSI ( (segid " " and resid "51 " and name "HB2 ") )( (segid " " and resid "18 " and name "HB2 ") OR (segid " " and resid "18 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9665 weight 0.10000E+01 volume 0.76000E+00 ppm1 1.449 ppm2 1.326 ASSI ( (segid " " and resid "51 " and name "HB2 ") )( (segid " " and resid "48 " and name "HA ") ) 6.000 6.000 0.000 peak 9666 weight 0.10000E+01 volume 0.14700E+00 ppm1 1.460 ppm2 3.805 ASSI ( (segid " " and resid "110 " and name "HA ") )( (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") OR (segid " " and resid "108 " and name "HG23") OR (segid " " and resid "108 " and name "HG22") OR (segid " " and resid "108 " and name "HG21") ) 6.000 6.000 0.000 peak 9667 weight 0.10000E+01 volume -0.25700E+00 ppm1 4.083 ppm2 1.193 ASSI ( (segid " " and resid "110 " and name "HA ") )( (segid " " and resid "138 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9668 weight 0.10000E+01 volume -0.19800E+00 ppm1 4.089 ppm2 2.865 ASSI ( (segid " " and resid "110 " and name "HA ") )( (segid " " and resid "114 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9669 weight 0.10000E+01 volume -0.34000E+00 ppm1 4.090 ppm2 3.506 ASSI ( (segid " " and resid "110 " and name "HA ") )( (segid " " and resid "138 " and name "HA ") ) 6.000 6.000 0.000 peak 9670 weight 0.10000E+01 volume -0.19400E+00 ppm1 4.075 ppm2 4.582 ASSI ( (segid " " and resid "28 " and name "HA ") )( (segid " " and resid "33 " and name "HG1 ") OR (segid " " and resid "33 " and name "HB2 ") OR (segid " " and resid "25 " and name "HG1 ") ) 6.000 6.000 0.000 peak 9672 weight 0.10000E+01 volume -0.26900E+00 ppm1 3.994 ppm2 2.328 ASSI ( (segid " " and resid "28 " and name "HA ") )( (segid " " and resid "31 " and name "HB2 ") OR (segid " " and resid "31 " and name "HB1 ") OR (segid " " and resid "27 " and name "HD1 ") ) 6.000 6.000 0.000 peak 9673 weight 0.10000E+01 volume -0.25300E+00 ppm1 3.994 ppm2 3.110 ASSI ( (segid " " and resid "157 " and name "HA ") )( (segid " " and resid "160 " and name "HD13") OR (segid " " and resid "160 " and name "HD12") OR (segid " " and resid "160 " and name "HD11") ) 5.000 5.000 0.000 peak 9674 weight 0.10000E+01 volume -0.94900E+00 ppm1 3.701 ppm2 0.632 ASSI ( (segid " " and resid "157 " and name "HA ") OR (segid " " and resid "118 " and name "HA ") )( (segid " " and resid "160 " and name "HD23") OR (segid " " and resid "160 " and name "HD22") OR (segid " " and resid "160 " and name "HD21") OR (segid " " and resid "156 " and name "HD23") OR (segid " " and resid "117 " and name "HG23") OR (segid " " and resid "117 " and name "HG22") OR (segid " " and resid "117 " and name "HG21") ) 5.000 5.000 0.000 peak 9675 weight 0.10000E+01 volume -0.10080E+01 ppm1 3.696 ppm2 0.764 ASSI ( (segid " " and resid "157 " and name "HA ") OR (segid " " and resid "118 " and name "HA ") OR (segid " " and resid "27 " and name "HA ") )( (segid " " and resid "147 " and name "HD23") OR (segid " " and resid "147 " and name "HD22") OR (segid " " and resid "145 " and name "HD23") OR (segid " " and resid "145 " and name "HD22") OR (segid " " and resid "145 " and name "HD21") OR (segid " " and resid "30 " and name "HB2 ") ) 3.300 3.300 0.000 peak 9676 weight 0.10000E+01 volume -0.22620E+01 ppm1 3.701 ppm2 1.006 ASSI ( (segid " " and resid "157 " and name "HA ") )( (segid " " and resid "148 " and name "HB3 ") OR (segid " " and resid "148 " and name "HB2 ") OR (segid " " and resid "148 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9677 weight 0.10000E+01 volume -0.12430E+01 ppm1 3.701 ppm2 1.433 ASSI ( (segid " " and resid "28 " and name "HA ") )( (segid " " and resid "28 " and name "HG2 ") ) 5.000 5.000 0.000 peak 9678 weight 0.10000E+01 volume -0.11350E+01 ppm1 3.994 ppm2 1.527 ASSI ( (segid " " and resid "143 " and name "HA ") )( (segid " " and resid "137 " and name "HG1 ") ) 6.000 6.000 0.000 peak 9679 weight 0.10000E+01 volume -0.13400E+00 ppm1 5.382 ppm2 1.673 ASSI ( (segid " " and resid "28 " and name "HA ") )( (segid " " and resid "32 " and name "HG2 ") OR (segid " " and resid "28 " and name "HG1 ") ) 5.000 5.000 0.000 peak 9680 weight 0.10000E+01 volume -0.16490E+01 ppm1 3.995 ppm2 1.700 ASSI ( (segid " " and resid "28 " and name "HA ") )( (segid " " and resid "32 " and name "HG1 ") ) 5.000 5.000 0.000 peak 9681 weight 0.10000E+01 volume -0.10040E+01 ppm1 3.995 ppm2 1.833 ASSI ( (segid " " and resid "28 " and name "HA ") )( (segid " " and resid "32 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9682 weight 0.10000E+01 volume -0.66800E+00 ppm1 3.995 ppm2 2.207 ASSI ( (segid " " and resid "28 " and name "HA ") )( (segid " " and resid "61 " and name "HG1 ") OR (segid " " and resid "33 " and name "HB1 ") OR (segid " " and resid "24 " and name "HG2 ") ) 6.000 6.000 0.000 peak 9683 weight 0.10000E+01 volume -0.17000E+00 ppm1 3.990 ppm2 2.448 ASSI ( (segid " " and resid "28 " and name "HA ") )( (segid " " and resid "32 " and name "HD2 ") OR (segid " " and resid "32 " and name "HD1 ") ) 6.000 6.000 0.000 peak 9684 weight 0.10000E+01 volume -0.23600E+00 ppm1 3.995 ppm2 3.248 ASSI ( (segid " " and resid "143 " and name "HA ") )( (segid " " and resid "144 " and name "HD2 ") ) 5.000 5.000 0.000 peak 9685 weight 0.10000E+01 volume -0.30100E+00 ppm1 5.382 ppm2 3.715 ASSI ( (segid " " and resid "157 " and name "HA ") OR (segid " " and resid "118 " and name "HA ") OR (segid " " and resid "27 " and name "HA ") )( (segid " " and resid "161 " and name "HA ") OR (segid " " and resid "152 " and name "HA1 ") OR (segid " " and resid "150 " and name "HA ") OR (segid " " and resid "146 " and name "HA ") OR (segid " " and resid "120 " and name "HA1 ") OR (segid " " and resid "114 " and name "HA ") OR (segid " " and resid "28 " and name "HA ") OR (segid " " and resid "24 " and name "HA ") ) 5.000 5.000 0.000 peak 9686 weight 0.10000E+01 volume -0.51700E+00 ppm1 3.705 ppm2 3.997 ASSI ( (segid " " and resid "28 " and name "HA ") )( (segid " " and resid "32 " and name "HA ") OR (segid " " and resid "31 " and name "HA ") OR (segid " " and resid "25 " and name "HA ") ) 6.000 6.000 0.000 peak 9687 weight 0.10000E+01 volume -0.15500E+00 ppm1 3.995 ppm2 4.635 ASSI ( (segid " " and resid "71 " and name "HA ") )( (segid " " and resid "72 " and name "HA ") ) 6.000 6.000 0.000 peak 9688 weight 0.10000E+01 volume -0.90000E-01 ppm1 4.319 ppm2 4.995 ASSI ( (segid " " and resid "157 " and name "HA ") OR (segid " " and resid "118 " and name "HA ") )( (segid " " and resid "160 " and name "HG ") OR (segid " " and resid "151 " and name "HG2 ") OR (segid " " and resid "151 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9689 weight 0.10000E+01 volume -0.13290E+01 ppm1 3.706 ppm2 1.779 ASSI ( (segid " " and resid "157 " and name "HA ") OR (segid " " and resid "118 " and name "HA ") OR (segid " " and resid "27 " and name "HA ") )( (segid " " and resid "161 " and name "HG1 ") OR (segid " " and resid "150 " and name "HG1 ") OR (segid " " and resid "24 " and name "HG1 ") ) 5.000 5.000 0.000 peak 9690 weight 0.10000E+01 volume -0.32700E+00 ppm1 3.709 ppm2 2.516 ASSI ( (segid " " and resid "157 " and name "HA ") OR (segid " " and resid "118 " and name "HA ") )( (segid " " and resid "156 " and name "HB2 ") OR (segid " " and resid "147 " and name "HD13") OR (segid " " and resid "147 " and name "HD12") OR (segid " " and resid "147 " and name "HD11") ) 5.000 5.000 0.000 peak 9691 weight 0.10000E+01 volume -0.48600E+00 ppm1 3.684 ppm2 1.181 ASSI ( (segid " " and resid "154 " and name "HG2 ") OR (segid " " and resid "154 " and name "HG1 ") OR (segid " " and resid "65 " and name "HG2 ") )( (segid " " and resid "159 " and name "HG12") OR (segid " " and resid "156 " and name "HB2 ") OR (segid " " and resid "67 " and name "HB3 ") OR (segid " " and resid "67 " and name "HB2 ") OR (segid " " and resid "67 " and name "HB1 ") OR (segid " " and resid "62 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9692 weight 0.10000E+01 volume 0.11600E+00 ppm1 2.449 ppm2 1.146 ASSI ( (segid " " and resid "157 " and name "HA ") OR (segid " " and resid "118 " and name "HA ") OR (segid " " and resid "27 " and name "HA ") )( (segid " " and resid "159 " and name "HD13") OR (segid " " and resid "159 " and name "HD12") OR (segid " " and resid "159 " and name "HD11") OR (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "145 " and name "HD12") OR (segid " " and resid "145 " and name "HD11") OR (segid " " and resid "125 " and name "HG23") OR (segid " " and resid "125 " and name "HG22") OR (segid " " and resid "125 " and name "HG21") OR (segid " " and resid "117 " and name "HD13") OR (segid " " and resid "117 " and name "HD12") OR (segid " " and resid "117 " and name "HD11") OR (segid " " and resid "62 " and name "HD22") OR (segid " " and resid "58 " and name "HG11") OR (segid " " and resid "26 " and name "HG13") OR (segid " " and resid "26 " and name "HG12") OR (segid " " and resid "26 " and name "HG11") OR (segid " " and resid "23 " and name "HG23") OR (segid " " and resid "23 " and name "HG22") OR (segid " " and resid "23 " and name "HG21") OR (segid " " and resid "23 " and name "HG13") OR (segid " " and resid "23 " and name "HG12") OR (segid " " and resid "23 " and name "HG11") ) 5.000 5.000 0.000 peak 9693 weight 0.10000E+01 volume -0.90900E+00 ppm1 3.696 ppm2 0.908 ASSI ( (segid " " and resid "71 " and name "HB ") )( (segid " " and resid "46 " and name "HG23") OR (segid " " and resid "46 " and name "HG22") OR (segid " " and resid "46 " and name "HG21") ) 5.000 5.000 0.000 peak 9694 weight 0.10000E+01 volume 0.40100E+00 ppm1 2.052 ppm2 1.204 ASSI ( (segid " " and resid "72 " and name "HB1 ") )( (segid " " and resid "76 " and name "HA2 ") ) 5.000 5.000 0.000 peak 9695 weight 0.10000E+01 volume 0.38400E+00 ppm1 1.984 ppm2 3.786 ASSI ( (segid " " and resid "71 " and name "HA ") )( (segid " " and resid "46 " and name "HG23") OR (segid " " and resid "46 " and name "HG22") OR (segid " " and resid "46 " and name "HG21") ) 6.000 6.000 0.000 peak 9696 weight 0.10000E+01 volume -0.12800E+00 ppm1 4.323 ppm2 1.181 ASSI ( (segid " " and resid "72 " and name "HB2 ") )( (segid " " and resid "76 " and name "HA2 ") ) 6.000 6.000 0.000 peak 9697 weight 0.10000E+01 volume 0.22000E+00 ppm1 1.836 ppm2 3.788 ASSI ( (segid " " and resid "154 " and name "HG2 ") OR (segid " " and resid "154 " and name "HG1 ") OR (segid " " and resid "65 " and name "HG2 ") )( (segid " " and resid "156 " and name "HA ") OR (segid " " and resid "37 " and name "HA ") ) 6.000 6.000 0.000 peak 9698 weight 0.10000E+01 volume 0.21800E+00 ppm1 2.443 ppm2 4.121 ASSI ( (segid " " and resid "65 " and name "HG1 ") )( (segid " " and resid "30 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9699 weight 0.10000E+01 volume 0.21400E+00 ppm1 2.573 ppm2 1.564 ASSI ( (segid " " and resid "27 " and name "HA ") )( (segid " " and resid "61 " and name "HG1 ") ) 5.000 5.000 0.000 peak 9700 weight 0.10000E+01 volume -0.61200E+00 ppm1 3.662 ppm2 2.452 ASSI ( (segid " " and resid "65 " and name "HG1 ") )( (segid " " and resid "37 " and name "HG1 ") OR (segid " " and resid "37 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9701 weight 0.10000E+01 volume 0.35600E+00 ppm1 2.577 ppm2 1.682 ASSI ( (segid " " and resid "71 " and name "HA ") )( (segid " " and resid "72 " and name "HG2 ") OR (segid " " and resid "72 " and name "HG1 ") ) 6.000 6.000 0.000 peak 9702 weight 0.10000E+01 volume -0.26900E+00 ppm1 4.332 ppm2 2.255 ASSI ( (segid " " and resid "65 " and name "HG2 ") )( (segid " " and resid "30 " and name "HA ") ) 6.000 6.000 0.000 peak 9703 weight 0.10000E+01 volume 0.17100E+00 ppm1 2.441 ppm2 4.236 ASSI ( (segid " " and resid "65 " and name "HG1 ") )( (segid " " and resid "37 " and name "HA ") OR (segid " " and resid "34 " and name "HA ") ) 5.000 5.000 0.000 peak 9704 weight 0.10000E+01 volume 0.30600E+00 ppm1 2.579 ppm2 4.071 ASSI ( (segid " " and resid "154 " and name "HG2 ") OR (segid " " and resid "154 " and name "HG1 ") )( (segid " " and resid "154 " and name "HA ") ) 6.000 6.000 0.000 peak 9705 weight 0.10000E+01 volume 0.19700E+00 ppm1 2.436 ppm2 4.366 ASSI ( (segid " " and resid "72 " and name "HB1 ") )( (segid " " and resid "72 " and name "HB2 ") ) 2.700 2.700 0.000 peak 9706 weight 0.10000E+01 volume 0.48430E+01 ppm1 1.970 ppm2 1.834 ASSI ( (segid " " and resid "72 " and name "HB1 ") )( (segid " " and resid "78 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9707 weight 0.10000E+01 volume 0.18000E+00 ppm1 1.969 ppm2 4.479 ASSI ( (segid " " and resid "65 " and name "HG2 ") )( (segid " " and resid "37 " and name "HG1 ") OR (segid " " and resid "37 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9708 weight 0.10000E+01 volume 0.41600E+00 ppm1 2.453 ppm2 1.697 ASSI ( (segid " " and resid "127 " and name "HA ") )( (segid " " and resid "126 " and name "HA ") OR (segid " " and resid "123 " and name "HB2 ") OR (segid " " and resid "123 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9709 weight 0.10000E+01 volume -0.14760E+01 ppm1 4.304 ppm2 4.005 ASSI ( (segid " " and resid "127 " and name "HA ") )( (segid " " and resid "129 " and name "HB3 ") OR (segid " " and resid "129 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB1 ") OR (segid " " and resid "96 " and name "HG22") OR (segid " " and resid "93 " and name "HG1 ") ) 6.000 6.000 0.000 peak 9710 weight 0.10000E+01 volume -0.18400E+00 ppm1 4.300 ppm2 1.129 ASSI ( (segid " " and resid "127 " and name "HA ") )( (segid " " and resid "127 " and name "HE2 ") OR (segid " " and resid "127 " and name "HE1 ") ) 5.000 5.000 0.000 peak 9712 weight 0.10000E+01 volume -0.11180E+01 ppm1 4.303 ppm2 7.213 ASSI ( (segid " " and resid "150 " and name "HG1 ") )( (segid " " and resid "151 " and name "HG2 ") OR (segid " " and resid "151 " and name "HG1 ") ) 6.000 6.000 0.000 peak 9713 weight 0.10000E+01 volume 0.25600E+00 ppm1 2.547 ppm2 1.811 ASSI ( (segid " " and resid "72 " and name "HG2 ") OR (segid " " and resid "72 " and name "HG1 ") )( (segid " " and resid "77 " and name "HA ") OR (segid " " and resid "76 " and name "HA2 ") ) 6.000 6.000 0.000 peak 9714 weight 0.10000E+01 volume 0.17400E+00 ppm1 2.244 ppm2 3.784 ASSI ( (segid " " and resid "150 " and name "HG1 ") )( (segid " " and resid "142 " and name "HD23") OR (segid " " and resid "142 " and name "HD21") OR (segid " " and resid "117 " and name "HG23") OR (segid " " and resid "117 " and name "HG22") OR (segid " " and resid "117 " and name "HG21") ) 5.000 5.000 0.000 peak 9715 weight 0.10000E+01 volume 0.31900E+00 ppm1 2.557 ppm2 0.753 ASSI ( (segid " " and resid "150 " and name "HG2 ") )( (segid " " and resid "147 " and name "HA ") ) 5.000 5.000 0.000 peak 9716 weight 0.10000E+01 volume 0.32500E+00 ppm1 2.331 ppm2 4.200 ASSI ( (segid " " and resid "164 " and name "HB2 ") )( (segid " " and resid "161 " and name "HA ") ) 5.000 5.000 0.000 peak 9717 weight 0.10000E+01 volume 0.52700E+00 ppm1 1.943 ppm2 4.017 ASSI ( (segid " " and resid "150 " and name "HG1 ") )( (segid " " and resid "147 " and name "HD23") OR (segid " " and resid "147 " and name "HD22") OR (segid " " and resid "147 " and name "HD21") ) 5.000 5.000 0.000 peak 9718 weight 0.10000E+01 volume 0.35600E+00 ppm1 2.552 ppm2 1.031 ASSI ( (segid " " and resid "150 " and name "HG1 ") )( (segid " " and resid "147 " and name "HA ") ) 6.000 6.000 0.000 peak 9719 weight 0.10000E+01 volume 0.20600E+00 ppm1 2.551 ppm2 4.227 ASSI ( (segid " " and resid "164 " and name "HB1 ") OR (segid " " and resid "150 " and name "HG2 ") )( (segid " " and resid "166 " and name "HG23") OR (segid " " and resid "166 " and name "HG22") OR (segid " " and resid "166 " and name "HG21") OR (segid " " and resid "147 " and name "HD23") OR (segid " " and resid "147 " and name "HD22") OR (segid " " and resid "147 " and name "HD21") ) 5.000 5.000 0.000 peak 9720 weight 0.10000E+01 volume 0.51700E+00 ppm1 2.341 ppm2 1.036 ASSI ( (segid " " and resid "25 " and name "HG1 ") )( (segid " " and resid "29 " and name "HD13") OR (segid " " and resid "29 " and name "HD12") OR (segid " " and resid "29 " and name "HD11") ) 5.000 5.000 0.000 peak 9721 weight 0.10000E+01 volume 0.55500E+00 ppm1 2.348 ppm2 0.765 ASSI ( (segid " " and resid "150 " and name "HG1 ") )( (segid " " and resid "142 " and name "HD13") OR (segid " " and resid "142 " and name "HD12") OR (segid " " and resid "142 " and name "HD11") ) 5.000 5.000 0.000 peak 9722 weight 0.10000E+01 volume 0.44400E+00 ppm1 2.549 ppm2 0.887 ASSI ( (segid " " and resid "25 " and name "HG2 ") )( (segid " " and resid "29 " and name "HD23") OR (segid " " and resid "29 " and name "HD13") OR (segid " " and resid "29 " and name "HD11") ) 5.000 5.000 0.000 peak 9723 weight 0.10000E+01 volume 0.49200E+00 ppm1 2.152 ppm2 0.768 ASSI ( (segid " " and resid "164 " and name "HB1 ") OR (segid " " and resid "25 " and name "HG1 ") )( (segid " " and resid "166 " and name "HG11") OR (segid " " and resid "17 " and name "HB3 ") OR (segid " " and resid "17 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9724 weight 0.10000E+01 volume 0.13770E+01 ppm1 2.356 ppm2 1.516 ASSI ( (segid " " and resid "25 " and name "HG2 ") )( (segid " " and resid "17 " and name "HB3 ") OR (segid " " and resid "17 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9725 weight 0.10000E+01 volume 0.10140E+01 ppm1 2.147 ppm2 1.517 ASSI ( (segid " " and resid "25 " and name "HG1 ") )( (segid " " and resid "25 " and name "HA ") ) 6.000 6.000 0.000 peak 9726 weight 0.10000E+01 volume 0.24700E+00 ppm1 2.340 ppm2 4.635 ASSI ( (segid " " and resid "25 " and name "HG2 ") )( (segid " " and resid "17 " and name "HA ") OR (segid " " and resid "14 " and name "HA ") ) 6.000 6.000 0.000 peak 9727 weight 0.10000E+01 volume 0.16700E+00 ppm1 2.131 ppm2 4.127 ASSI ( (segid " " and resid "123 " and name "HA ") )( (segid " " and resid "89 " and name "HD13") OR (segid " " and resid "89 " and name "HD12") OR (segid " " and resid "89 " and name "HD11") ) 5.000 5.000 0.000 peak 9728 weight 0.10000E+01 volume -0.34200E+00 ppm1 4.342 ppm2 0.819 ASSI ( (segid " " and resid "107 " and name "HA ") )( (segid " " and resid "108 " and name "HG23") OR (segid " " and resid "108 " and name "HG22") OR (segid " " and resid "108 " and name "HG21") ) 6.000 6.000 0.000 peak 9729 weight 0.10000E+01 volume -0.17400E+00 ppm1 4.288 ppm2 1.166 ASSI ( (segid " " and resid "107 " and name "HA ") )( (segid " " and resid "109 " and name "HA2 ") OR (segid " " and resid "77 " and name "HA ") OR (segid " " and resid "76 " and name "HA2 ") ) 5.000 5.000 0.000 peak 9730 weight 0.10000E+01 volume -0.41300E+00 ppm1 4.288 ppm2 3.781 ASSI ( (segid " " and resid "107 " and name "HA ") )( (segid " " and resid "108 " and name "HA ") ) 6.000 6.000 0.000 peak 9731 weight 0.10000E+01 volume -0.12900E+00 ppm1 4.288 ppm2 4.609 ASSI ( (segid " " and resid "161 " and name "HG2 ") )( (segid " " and resid "158 " and name "HA ") ) 6.000 6.000 0.000 peak 9732 weight 0.10000E+01 volume 0.17400E+00 ppm1 2.376 ppm2 4.335 ASSI ( (segid " " and resid "161 " and name "HG2 ") )( (segid " " and resid "145 " and name "HD23") OR (segid " " and resid "145 " and name "HD21") OR (segid " " and resid "145 " and name "HD13") OR (segid " " and resid "145 " and name "HD12") OR (segid " " and resid "145 " and name "HD11") ) 5.000 5.000 0.000 peak 9733 weight 0.10000E+01 volume 0.10660E+01 ppm1 2.368 ppm2 0.977 ASSI ( (segid " " and resid "161 " and name "HG1 ") )( (segid " " and resid "145 " and name "HD23") OR (segid " " and resid "145 " and name "HD22") OR (segid " " and resid "145 " and name "HD21") ) 5.000 5.000 0.000 peak 9734 weight 0.10000E+01 volume 0.89800E+00 ppm1 2.543 ppm2 0.990 ASSI ( (segid " " and resid "161 " and name "HG1 ") )( (segid " " and resid "164 " and name "HE3 ") OR (segid " " and resid "164 " and name "HE2 ") OR (segid " " and resid "164 " and name "HE1 ") OR (segid " " and resid "160 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9735 weight 0.10000E+01 volume 0.42600E+00 ppm1 2.542 ppm2 1.982 ASSI ( (segid " " and resid "53 " and name "HA ") )( (segid " " and resid "95 " and name "HD23") OR (segid " " and resid "95 " and name "HD22") OR (segid " " and resid "95 " and name "HD21") OR (segid " " and resid "58 " and name "HG13") OR (segid " " and resid "58 " and name "HG12") OR (segid " " and resid "58 " and name "HG11") ) 5.000 5.000 0.000 peak 9736 weight 0.10000E+01 volume -0.73000E+00 ppm1 3.908 ppm2 0.914 ASSI ( (segid " " and resid "53 " and name "HA ") )( (segid " " and resid "83 " and name "HB3 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "59 " and name "HB3 ") OR (segid " " and resid "59 " and name "HB2 ") OR (segid " " and resid "59 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9737 weight 0.10000E+01 volume -0.38300E+00 ppm1 3.915 ppm2 1.326 ASSI ( (segid " " and resid "53 " and name "HA ") )( (segid " " and resid "51 " and name "HB1 ") OR (segid " " and resid "20 " and name "HG1 ") OR (segid " " and resid "20 " and name "HB2 ") OR (segid " " and resid "20 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9738 weight 0.10000E+01 volume -0.18000E+00 ppm1 3.902 ppm2 1.952 ASSI ( (segid " " and resid "131 " and name "HG2 ") )( (segid " " and resid "102 " and name "HG23") OR (segid " " and resid "102 " and name "HG22") OR (segid " " and resid "102 " and name "HG21") OR (segid " " and resid "102 " and name "HG11") ) 5.000 5.000 0.000 peak 9739 weight 0.10000E+01 volume 0.52700E+00 ppm1 1.961 ppm2 0.875 ASSI ( (segid " " and resid "131 " and name "HG1 ") )( (segid " " and resid "96 " and name "HG13") OR (segid " " and resid "96 " and name "HG12") OR (segid " " and resid "96 " and name "HG11") ) 6.000 6.000 0.000 peak 9740 weight 0.10000E+01 volume 0.16300E+00 ppm1 2.070 ppm2 1.118 ASSI ( (segid " " and resid "131 " and name "HG2 ") )( (segid " " and resid "130 " and name "HG2 ") ) 5.000 5.000 0.000 peak 9741 weight 0.10000E+01 volume 0.43300E+00 ppm1 1.968 ppm2 1.756 ASSI ( (segid " " and resid "131 " and name "HG1 ") )( (segid " " and resid "102 " and name "HG23") OR (segid " " and resid "102 " and name "HG22") OR (segid " " and resid "102 " and name "HG21") OR (segid " " and resid "102 " and name "HG12") ) 5.000 5.000 0.000 peak 9742 weight 0.10000E+01 volume 0.63800E+00 ppm1 2.079 ppm2 0.874 ASSI ( (segid " " and resid "131 " and name "HG2 ") )( (segid " " and resid "96 " and name "HG22") OR (segid " " and resid "96 " and name "HG13") OR (segid " " and resid "96 " and name "HG12") OR (segid " " and resid "96 " and name "HG11") ) 6.000 6.000 0.000 peak 9743 weight 0.10000E+01 volume 0.18800E+00 ppm1 1.967 ppm2 1.124 ASSI ( (segid " " and resid "86 " and name "HA ") )( (segid " " and resid "88 " and name "HE2 ") OR (segid " " and resid "88 " and name "HE1 ") OR (segid " " and resid "53 " and name "HE2 ") ) 6.000 6.000 0.000 peak 9744 weight 0.10000E+01 volume -0.18400E+00 ppm1 4.315 ppm2 7.357 ASSI ( (segid " " and resid "155 " and name "HB2 ") )( (segid " " and resid "159 " and name "HD13") OR (segid " " and resid "159 " and name "HD12") OR (segid " " and resid "159 " and name "HD11") ) 6.000 6.000 0.000 peak 9745 weight 0.10000E+01 volume 0.11600E+00 ppm1 2.873 ppm2 0.905 ASSI ( (segid " " and resid "61 " and name "HG1 ") )( (segid " " and resid "57 " and name "HB3 ") OR (segid " " and resid "27 " and name "HG2 ") ) 6.000 6.000 0.000 peak 9746 weight 0.10000E+01 volume 0.26800E+00 ppm1 2.457 ppm2 1.473 ASSI ( (segid " " and resid "155 " and name "HB2 ") )( (segid " " and resid "158 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9747 weight 0.10000E+01 volume 0.19100E+00 ppm1 2.871 ppm2 2.662 ASSI ( (segid " " and resid "61 " and name "HG2 ") )( (segid " " and resid "57 " and name "HB2 ") OR (segid " " and resid "27 " and name "HG2 ") ) 5.000 5.000 0.000 peak 9748 weight 0.10000E+01 volume 0.46000E+00 ppm1 2.085 ppm2 1.475 ASSI ( (segid " " and resid "61 " and name "HG1 ") )( (segid " " and resid "26 " and name "HG13") OR (segid " " and resid "26 " and name "HG12") OR (segid " " and resid "26 " and name "HG11") ) 5.000 5.000 0.000 peak 9749 weight 0.10000E+01 volume 0.54300E+00 ppm1 2.447 ppm2 0.933 ASSI ( (segid " " and resid "61 " and name "HG1 ") )( (segid " " and resid "30 " and name "HD13") OR (segid " " and resid "30 " and name "HD12") OR (segid " " and resid "30 " and name "HD11") ) 6.000 6.000 0.000 peak 9750 weight 0.10000E+01 volume 0.13700E+00 ppm1 2.444 ppm2 0.675 ASSI ( (segid " " and resid "61 " and name "HG1 ") )( (segid " " and resid "26 " and name "HG23") OR (segid " " and resid "26 " and name "HG22") OR (segid " " and resid "26 " and name "HG21") ) 6.000 6.000 0.000 peak 9751 weight 0.10000E+01 volume 0.24100E+00 ppm1 2.447 ppm2 0.810 ASSI ( (segid " " and resid "61 " and name "HG2 ") )( (segid " " and resid "26 " and name "HG13") OR (segid " " and resid "26 " and name "HG12") OR (segid " " and resid "26 " and name "HG11") OR (segid " " and resid "23 " and name "HG21") OR (segid " " and resid "23 " and name "HG13") ) 5.000 5.000 0.000 peak 9752 weight 0.10000E+01 volume 0.79600E+00 ppm1 2.089 ppm2 0.926 ASSI ( (segid " " and resid "61 " and name "HG2 ") )( (segid " " and resid "30 " and name "HD12") OR (segid " " and resid "30 " and name "HD11") ) 6.000 6.000 0.000 peak 9753 weight 0.10000E+01 volume 0.21000E+00 ppm1 2.098 ppm2 0.675 ASSI ( (segid " " and resid "61 " and name "HG2 ") )( (segid " " and resid "26 " and name "HG23") OR (segid " " and resid "26 " and name "HG21") ) 5.000 5.000 0.000 peak 9754 weight 0.10000E+01 volume 0.30900E+00 ppm1 2.092 ppm2 0.823 ASSI ( (segid " " and resid "126 " and name "HA ") OR (segid " " and resid "107 " and name "HB2 ") OR (segid " " and resid "107 " and name "HB1 ") OR (segid " " and resid "55 " and name "HB1 ") )( (segid " " and resid "148 " and name "HB3 ") OR (segid " " and resid "148 " and name "HB2 ") OR (segid " " and resid "139 " and name "HB2 ") OR (segid " " and resid "139 " and name "HB1 ") OR (segid " " and resid "115 " and name "HB2 ") OR (segid " " and resid "113 " and name "HG11") OR (segid " " and resid "57 " and name "HB3 ") OR (segid " " and resid "57 " and name "HB2 ") OR (segid " " and resid "57 " and name "HB1 ") OR (segid " " and resid "51 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9755 weight 0.10000E+01 volume -0.22300E+00 ppm1 3.986 ppm2 1.439 ASSI ( (segid " " and resid "110 " and name "HB2 ") OR (segid " " and resid "55 " and name "HB2 ") )( (segid " " and resid "112 " and name "HG1 ") OR (segid " " and resid "105 " and name "HB1 ") OR (segid " " and resid "60 " and name "HB1 ") OR (segid " " and resid "52 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9757 weight 0.10000E+01 volume -0.20500E+00 ppm1 3.684 ppm2 1.842 ASSI ( (segid " " and resid "126 " and name "HA ") )( (segid " " and resid "159 " and name "HB ") ) 5.000 5.000 0.000 peak 9758 weight 0.10000E+01 volume -0.66200E+00 ppm1 3.994 ppm2 1.870 ASSI ( (segid " " and resid "126 " and name "HA ") OR (segid " " and resid "107 " and name "HB2 ") OR (segid " " and resid "107 " and name "HB1 ") OR (segid " " and resid "55 " and name "HB1 ") )( (segid " " and resid "165 " and name "HE3 ") OR (segid " " and resid "165 " and name "HE2 ") OR (segid " " and resid "165 " and name "HE1 ") OR (segid " " and resid "115 " and name "HB1 ") OR (segid " " and resid "26 " and name "HB ") ) 5.000 5.000 0.000 peak 9759 weight 0.10000E+01 volume -0.34200E+00 ppm1 3.995 ppm2 2.180 ASSI ( (segid " " and resid "55 " and name "HB2 ") )( (segid " " and resid "58 " and name "HB ") ) 5.000 5.000 0.000 peak 9760 weight 0.10000E+01 volume -0.36300E+00 ppm1 3.694 ppm2 2.313 ASSI ( (segid " " and resid "35 " and name "HA ") )( (segid " " and resid "36 " and name "HB1 ") OR (segid " " and resid "13 " and name "HD2 ") OR (segid " " and resid "13 " and name "HD1 ") ) 6.000 6.000 0.000 peak 9762 weight 0.10000E+01 volume -0.12100E+00 ppm1 3.781 ppm2 3.221 ASSI ( (segid " " and resid "55 " and name "HB2 ") )( (segid " " and resid "56 " and name "HD2 ") ) 5.000 5.000 0.000 peak 9763 weight 0.10000E+01 volume -0.30600E+00 ppm1 3.688 ppm2 3.370 ASSI ( (segid " " and resid "55 " and name "HB2 ") )( (segid " " and resid "57 " and name "HB3 ") OR (segid " " and resid "57 " and name "HB2 ") OR (segid " " and resid "57 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9764 weight 0.10000E+01 volume -0.14800E+00 ppm1 3.685 ppm2 1.460 ASSI ( (segid " " and resid "35 " and name "HA ") )( (segid " " and resid "36 " and name "HA ") ) 6.000 6.000 0.000 peak 9765 weight 0.10000E+01 volume -0.18400E+00 ppm1 3.789 ppm2 4.357 ASSI ( (segid " " and resid "55 " and name "HB1 ") )( (segid " " and resid "56 " and name "HD2 ") ) 5.000 5.000 0.000 peak 9766 weight 0.10000E+01 volume -0.55100E+00 ppm1 3.994 ppm2 3.366 ASSI ( (segid " " and resid "35 " and name "HA ") )( (segid " " and resid "33 " and name "HG2 ") OR (segid " " and resid "33 " and name "HG1 ") OR (segid " " and resid "10 " and name "HB ") ) 5.000 5.000 0.000 peak 9767 weight 0.10000E+01 volume -0.11690E+01 ppm1 3.790 ppm2 2.245 ASSI ( (segid " " and resid "107 " and name "HB2 ") OR (segid " " and resid "107 " and name "HB1 ") )( (segid " " and resid "108 " and name "HG23") OR (segid " " and resid "108 " and name "HG22") OR (segid " " and resid "108 " and name "HG21") ) 5.000 5.000 0.000 peak 9769 weight 0.10000E+01 volume -0.12470E+01 ppm1 4.001 ppm2 1.145 ASSI ( (segid " " and resid "110 " and name "HB2 ") )( (segid " " and resid "147 " and name "HD12") OR (segid " " and resid "108 " and name "HG23") OR (segid " " and resid "108 " and name "HG22") OR (segid " " and resid "108 " and name "HG21") ) 5.000 5.000 0.000 peak 9770 weight 0.10000E+01 volume -0.38000E+00 ppm1 3.701 ppm2 1.166 ASSI ( (segid " " and resid "35 " and name "HA ") )( (segid " " and resid "14 " and name "HB1 ") OR (segid " " and resid "3 " and name "HE3 ") ) 5.000 5.000 0.000 peak 9771 weight 0.10000E+01 volume -0.39100E+00 ppm1 3.790 ppm2 2.068 ASSI ( (segid " " and resid "8 " and name "HA ") )( (segid " " and resid "41 " and name "HA ") OR (segid " " and resid "2 " and name "HA ") ) 6.000 6.000 0.000 peak 9772 weight 0.10000E+01 volume -0.21600E+00 ppm1 4.182 ppm2 4.529 ASSI ( (segid " " and resid "33 " and name "HG2 ") )( (segid " " and resid "29 " and name "HA ") ) 5.000 5.000 0.000 peak 9773 weight 0.10000E+01 volume 0.77600E+00 ppm1 2.193 ppm2 3.892 ASSI ( (segid " " and resid "33 " and name "HG1 ") )( (segid " " and resid "29 " and name "HA ") ) 5.000 5.000 0.000 peak 9774 weight 0.10000E+01 volume 0.72200E+00 ppm1 2.287 ppm2 3.892 ASSI ( (segid " " and resid "33 " and name "HG2 ") )( (segid " " and resid "29 " and name "HD23") OR (segid " " and resid "29 " and name "HD22") OR (segid " " and resid "29 " and name "HD21") ) 5.000 5.000 0.000 peak 9775 weight 0.10000E+01 volume 0.82900E+00 ppm1 2.190 ppm2 0.772 ASSI ( (segid " " and resid "33 " and name "HG2 ") OR (segid " " and resid "6 " and name "HG2 ") )( (segid " " and resid "35 " and name "HG23") OR (segid " " and resid "35 " and name "HG22") OR (segid " " and resid "35 " and name "HG21") OR (segid " " and resid "35 " and name "HG13") OR (segid " " and resid "35 " and name "HG12") OR (segid " " and resid "8 " and name "HG23") OR (segid " " and resid "8 " and name "HG13") OR (segid " " and resid "8 " and name "HG11") ) 5.000 5.000 0.000 peak 9776 weight 0.10000E+01 volume 0.10590E+01 ppm1 2.188 ppm2 0.948 ASSI ( (segid " " and resid "33 " and name "HG1 ") OR (segid " " and resid "6 " and name "HG1 ") )( (segid " " and resid "29 " and name "HB2 ") OR (segid " " and resid "10 " and name "HG23") OR (segid " " and resid "10 " and name "HG22") OR (segid " " and resid "10 " and name "HG21") OR (segid " " and resid "10 " and name "HG13") OR (segid " " and resid "10 " and name "HG12") OR (segid " " and resid "10 " and name "HG11") ) 6.000 6.000 0.000 peak 9777 weight 0.10000E+01 volume 0.28000E+00 ppm1 2.296 ppm2 1.109 ASSI ( (segid " " and resid "33 " and name "HG2 ") )( (segid " " and resid "28 " and name "HG1 ") OR (segid " " and resid "13 " and name "HG2 ") ) 5.000 5.000 0.000 peak 9778 weight 0.10000E+01 volume 0.68500E+00 ppm1 2.193 ppm2 1.683 ASSI ( (segid " " and resid "33 " and name "HG1 ") )( (segid " " and resid "13 " and name "HG1 ") ) 5.000 5.000 0.000 peak 9779 weight 0.10000E+01 volume 0.16790E+01 ppm1 2.284 ppm2 1.844 ASSI ( (segid " " and resid "33 " and name "HG1 ") OR (segid " " and resid "7 " and name "HG1 ") OR (segid " " and resid "6 " and name "HG1 ") )( (segid " " and resid "35 " and name "HG23") OR (segid " " and resid "35 " and name "HG22") OR (segid " " and resid "35 " and name "HG21") OR (segid " " and resid "35 " and name "HG12") OR (segid " " and resid "8 " and name "HG23") OR (segid " " and resid "8 " and name "HG22") OR (segid " " and resid "8 " and name "HG21") OR (segid " " and resid "8 " and name "HG13") OR (segid " " and resid "4 " and name "HD12") ) 5.000 5.000 0.000 peak 9780 weight 0.10000E+01 volume 0.84000E+00 ppm1 2.292 ppm2 0.953 ASSI ( (segid " " and resid "107 " and name "HB2 ") OR (segid " " and resid "107 " and name "HB1 ") )( (segid " " and resid "108 " and name "HA ") OR (segid " " and resid "75 " and name "HA ") ) 5.000 5.000 0.000 peak 9781 weight 0.10000E+01 volume -0.47300E+00 ppm1 4.021 ppm2 4.647 ASSI ( (segid " " and resid "33 " and name "HG2 ") OR (segid " " and resid "7 " and name "HG2 ") OR (segid " " and resid "6 " and name "HG2 ") )( (segid " " and resid "29 " and name "HB2 ") OR (segid " " and resid "10 " and name "HG23") OR (segid " " and resid "10 " and name "HG22") OR (segid " " and resid "10 " and name "HG21") OR (segid " " and resid "10 " and name "HG13") OR (segid " " and resid "10 " and name "HG12") OR (segid " " and resid "10 " and name "HG11") ) 5.000 5.000 0.000 peak 9782 weight 0.10000E+01 volume 0.32500E+00 ppm1 2.192 ppm2 1.106 ASSI ( (segid " " and resid "33 " and name "HG1 ") )( (segid " " and resid "29 " and name "HD23") OR (segid " " and resid "29 " and name "HD22") OR (segid " " and resid "29 " and name "HD21") ) 5.000 5.000 0.000 peak 9783 weight 0.10000E+01 volume 0.11990E+01 ppm1 2.298 ppm2 0.770 ASSI ( (segid " " and resid "33 " and name "HG2 ") )( (segid " " and resid "35 " and name "HB ") OR (segid " " and resid "28 " and name "HG2 ") ) 5.000 5.000 0.000 peak 9784 weight 0.10000E+01 volume 0.53600E+00 ppm1 2.192 ppm2 1.571 ASSI ( (segid " " and resid "97 " and name "HG2 ") )( (segid " " and resid "95 " and name "HA ") OR (segid " " and resid "92 " and name "HA ") ) 6.000 6.000 0.000 peak 9785 weight 0.10000E+01 volume 0.17500E+00 ppm1 2.083 ppm2 3.871 ASSI ( (segid " " and resid "97 " and name "HG1 ") )( (segid " " and resid "93 " and name "HG1 ") ) 6.000 6.000 0.000 peak 9786 weight 0.10000E+01 volume 0.27400E+00 ppm1 2.409 ppm2 1.121 ASSI ( (segid " " and resid "8 " and name "HA ") )( (segid " " and resid "42 " and name "HG1 ") OR (segid " " and resid "40 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9787 weight 0.10000E+01 volume -0.25500E+00 ppm1 4.182 ppm2 1.246 ASSI ( (segid " " and resid "102 " and name "HA ") )( (segid " " and resid "104 " and name "HB3 ") OR (segid " " and resid "104 " and name "HB2 ") OR (segid " " and resid "104 " and name "HB1 ") OR (segid " " and resid "83 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9788 weight 0.10000E+01 volume -0.48900E+00 ppm1 3.888 ppm2 1.326 ASSI ( (segid " " and resid "102 " and name "HA ") )( (segid " " and resid "112 " and name "HG1 ") ) 5.000 5.000 0.000 peak 9789 weight 0.10000E+01 volume -0.73900E+00 ppm1 3.888 ppm2 1.820 ASSI ( (segid " " and resid "102 " and name "HA ") )( (segid " " and resid "112 " and name "HB2 ") OR (segid " " and resid "80 " and name "HB ") ) 5.000 5.000 0.000 peak 9790 weight 0.10000E+01 volume -0.66800E+00 ppm1 3.890 ppm2 1.915 ASSI ( (segid " " and resid "102 " and name "HA ") OR (segid " " and resid "15 " and name "HA ") )( (segid " " and resid "128 " and name "HB1 ") OR (segid " " and resid "113 " and name "HB ") OR (segid " " and resid "105 " and name "HG ") OR (segid " " and resid "69 " and name "HB2 ") OR (segid " " and resid "62 " and name "HG ") OR (segid " " and resid "51 " and name "HE2 ") OR (segid " " and resid "51 " and name "HE1 ") OR (segid " " and resid "42 " and name "HB2 ") OR (segid " " and resid "37 " and name "HB2 ") OR (segid " " and resid "13 " and name "HG2 ") ) 6.000 6.000 0.000 peak 9791 weight 0.10000E+01 volume -0.24700E+00 ppm1 3.897 ppm2 1.692 ASSI ( (segid " " and resid "69 " and name "HA ") )( (segid " " and resid "48 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9792 weight 0.10000E+01 volume -0.17200E+00 ppm1 4.404 ppm2 1.417 ASSI ( (segid " " and resid "49 " and name "HG1 ") )( (segid " " and resid "50 " and name "HG13") OR (segid " " and resid "50 " and name "HG12") OR (segid " " and resid "50 " and name "HG11") ) 5.000 5.000 0.000 peak 9793 weight 0.10000E+01 volume 0.38500E+00 ppm1 2.710 ppm2 0.846 ASSI ( (segid " " and resid "69 " and name "HA ") )( (segid " " and resid "95 " and name "HD23") OR (segid " " and resid "95 " and name "HD22") OR (segid " " and resid "95 " and name "HD21") OR (segid " " and resid "71 " and name "HG23") OR (segid " " and resid "71 " and name "HG22") OR (segid " " and resid "71 " and name "HG21") ) 5.000 5.000 0.000 peak 9794 weight 0.10000E+01 volume -0.10570E+01 ppm1 4.411 ppm2 0.942 ASSI ( (segid " " and resid "69 " and name "HA ") )( (segid " " and resid "48 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9795 weight 0.10000E+01 volume -0.34600E+00 ppm1 4.406 ppm2 1.577 ASSI ( (segid " " and resid "146 " and name "HG1 ") )( (segid " " and resid "143 " and name "HG23") OR (segid " " and resid "143 " and name "HG22") OR (segid " " and resid "143 " and name "HG21") ) 6.000 6.000 0.000 peak 9796 weight 0.10000E+01 volume 0.14600E+00 ppm1 2.420 ppm2 1.228 ASSI ( (segid " " and resid "146 " and name "HG2 ") )( (segid " " and resid "142 " and name "HD23") OR (segid " " and resid "142 " and name "HD22") ) 5.000 5.000 0.000 peak 9797 weight 0.10000E+01 volume 0.38500E+00 ppm1 2.333 ppm2 0.741 ASSI ( (segid " " and resid "146 " and name "HG1 ") )( (segid " " and resid "142 " and name "HD23") OR (segid " " and resid "142 " and name "HD22") OR (segid " " and resid "142 " and name "HD21") ) 5.000 5.000 0.000 peak 9798 weight 0.10000E+01 volume 0.30100E+00 ppm1 2.419 ppm2 0.740 ASSI ( (segid " " and resid "140 " and name "HB1 ") )( (segid " " and resid "142 " and name "HD13") OR (segid " " and resid "142 " and name "HD12") OR (segid " " and resid "142 " and name "HD11") ) 5.000 5.000 0.000 peak 9799 weight 0.10000E+01 volume -0.10460E+01 ppm1 4.102 ppm2 0.894 ASSI ( (segid " " and resid "140 " and name "HB1 ") )( (segid " " and resid "142 " and name "HD23") OR (segid " " and resid "142 " and name "HD22") OR (segid " " and resid "142 " and name "HD21") ) 5.000 5.000 0.000 peak 9800 weight 0.10000E+01 volume -0.33900E+00 ppm1 4.101 ppm2 0.749 ASSI ( (segid " " and resid "140 " and name "HB2 ") )( (segid " " and resid "138 " and name "HA ") OR (segid " " and resid "108 " and name "HA ") ) 5.000 5.000 0.000 peak 9801 weight 0.10000E+01 volume -0.38900E+00 ppm1 3.905 ppm2 4.625 ASSI ( (segid " " and resid "15 " and name "HB2 ") OR (segid " " and resid "15 " and name "HB1 ") )( (segid " " and resid "40 " and name "HG ") ) 6.000 6.000 0.000 peak 9802 weight 0.10000E+01 volume -0.26500E+00 ppm1 3.968 ppm2 1.780 ASSI ( (segid " " and resid "81 " and name "HA ") OR (segid " " and resid "2 " and name "HB1 ") )( (segid " " and resid "115 " and name "HG ") OR (segid " " and resid "112 " and name "HB1 ") OR (segid " " and resid "3 " and name "HE2 ") ) 5.000 5.000 0.000 peak 9803 weight 0.10000E+01 volume -0.88800E+00 ppm1 3.888 ppm2 2.047 ASSI ( (segid " " and resid "114 " and name "HA ") OR (segid " " and resid "15 " and name "HB2 ") OR (segid " " and resid "15 " and name "HB1 ") )( (segid " " and resid "150 " and name "HB2 ") OR (segid " " and resid "125 " and name "HB ") OR (segid " " and resid "115 " and name "HB1 ") OR (segid " " and resid "49 " and name "HG2 ") OR (segid " " and resid "10 " and name "HB ") ) 6.000 6.000 0.000 peak 9804 weight 0.10000E+01 volume -0.19700E+00 ppm1 3.968 ppm2 2.265 ASSI ( (segid " " and resid "45 " and name "HB1 ") )( (segid " " and resid "45 " and name "HG2 ") OR (segid " " and resid "45 " and name "HG1 ") ) 5.000 5.000 0.000 peak 9805 weight 0.10000E+01 volume 0.62600E+00 ppm1 1.910 ppm2 1.363 ASSI ( (segid " " and resid "114 " and name "HA ") OR (segid " " and resid "15 " and name "HB2 ") OR (segid " " and resid "15 " and name "HB1 ") )( (segid " " and resid "118 " and name "HG1 ") OR (segid " " and resid "112 " and name "HB2 ") OR (segid " " and resid "111 " and name "HG ") OR (segid " " and resid "51 " and name "HB1 ") OR (segid " " and resid "45 " and name "HB1 ") OR (segid " " and resid "42 " and name "HB1 ") OR (segid " " and resid "20 " and name "HG1 ") OR (segid " " and resid "13 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9806 weight 0.10000E+01 volume -0.56000E+00 ppm1 3.968 ppm2 1.926 ASSI ( (segid " " and resid "81 " and name "HA ") )( (segid " " and resid "112 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9807 weight 0.10000E+01 volume -0.84800E+00 ppm1 3.887 ppm2 1.984 ASSI ( (segid " " and resid "114 " and name "HA ") )( (segid " " and resid "117 " and name "HG11") OR (segid " " and resid "117 " and name "HB ") ) 5.000 5.000 0.000 peak 9808 weight 0.10000E+01 volume -0.12050E+01 ppm1 3.968 ppm2 2.064 ASSI ( (segid " " and resid "81 " and name "HA ") )( (segid " " and resid "112 " and name "HG1 ") ) 5.000 5.000 0.000 peak 9809 weight 0.10000E+01 volume -0.34400E+00 ppm1 3.888 ppm2 1.818 ASSI ( (segid " " and resid "77 " and name "HA ") )( (segid " " and resid "112 " and name "HG2 ") OR (segid " " and resid "105 " and name "HD11") OR (segid " " and resid "80 " and name "HG13") OR (segid " " and resid "80 " and name "HG12") OR (segid " " and resid "80 " and name "HG11") OR (segid " " and resid "71 " and name "HG23") OR (segid " " and resid "71 " and name "HG22") OR (segid " " and resid "71 " and name "HG21") OR (segid " " and resid "71 " and name "HG12") OR (segid " " and resid "71 " and name "HG11") ) 5.000 5.000 0.000 peak 9810 weight 0.10000E+01 volume -0.50500E+00 ppm1 3.769 ppm2 0.884 ASSI ( (segid " " and resid "81 " and name "HA ") )( (segid " " and resid "84 " and name "HB2 ") OR (segid " " and resid "84 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9811 weight 0.10000E+01 volume -0.76200E+00 ppm1 3.888 ppm2 1.446 ASSI ( (segid " " and resid "81 " and name "HA ") )( (segid " " and resid "115 " and name "HD13") OR (segid " " and resid "115 " and name "HD12") OR (segid " " and resid "115 " and name "HD11") ) 3.300 3.300 0.000 peak 9812 weight 0.10000E+01 volume -0.20900E+01 ppm1 3.888 ppm2 1.233 ASSI ( (segid " " and resid "81 " and name "HA ") OR (segid " " and resid "2 " and name "HB2 ") OR (segid " " and resid "2 " and name "HB1 ") )( (segid " " and resid "115 " and name "HB1 ") OR (segid " " and resid "102 " and name "HB ") OR (segid " " and resid "82 " and name "HB1 ") OR (segid " " and resid "7 " and name "HG1 ") OR (segid " " and resid "6 " and name "HG2 ") OR (segid " " and resid "6 " and name "HG1 ") ) 6.000 6.000 0.000 peak 9813 weight 0.10000E+01 volume -0.16100E+00 ppm1 3.887 ppm2 2.254 ASSI ( (segid " " and resid "77 " and name "HA ") )( (segid " " and resid "81 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9814 weight 0.10000E+01 volume -0.29300E+00 ppm1 3.776 ppm2 3.269 ASSI ( (segid " " and resid "81 " and name "HA ") )( (segid " " and resid "112 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9815 weight 0.10000E+01 volume -0.53000E+00 ppm1 3.887 ppm2 1.921 ASSI ( (segid " " and resid "88 " and name "HB2 ") )( (segid " " and resid "83 " and name "HA ") ) 6.000 6.000 0.000 peak 9816 weight 0.10000E+01 volume 0.10000E+00 ppm1 2.551 ppm2 3.816 ASSI ( (segid " " and resid "77 " and name "HA ") )( (segid " " and resid "106 " and name "HB2 ") OR (segid " " and resid "104 " and name "HB3 ") ) 5.000 5.000 0.000 peak 9817 weight 0.10000E+01 volume -0.57000E+00 ppm1 3.773 ppm2 1.370 ASSI ( (segid " " and resid "77 " and name "HA ") )( (segid " " and resid "106 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9818 weight 0.10000E+01 volume -0.24700E+00 ppm1 3.769 ppm2 2.892 ASSI ( (segid " " and resid "75 " and name "HB2 ") )( (segid " " and resid "77 " and name "HB ") OR (segid " " and resid "76 " and name "HA1 ") OR (segid " " and resid "74 " and name "HA ") ) 5.000 5.000 0.000 peak 9819 weight 0.10000E+01 volume -0.11500E+01 ppm1 4.021 ppm2 4.235 ASSI ( (segid " " and resid "77 " and name "HA ") )( (segid " " and resid "106 " and name "HA ") OR (segid " " and resid "105 " and name "HA ") ) 6.000 6.000 0.000 peak 9820 weight 0.10000E+01 volume -0.17200E+00 ppm1 3.781 ppm2 4.929 ASSI ( (segid " " and resid "77 " and name "HA ") )( (segid " " and resid "81 " and name "HE1 ") ) 6.000 6.000 0.000 peak 9821 weight 0.10000E+01 volume -0.12000E+00 ppm1 3.781 ppm2 7.464 ASSI ( (segid " " and resid "45 " and name "HB2 ") )( (segid " " and resid "50 " and name "HG13") OR (segid " " and resid "50 " and name "HG12") OR (segid " " and resid "50 " and name "HG11") ) 5.000 5.000 0.000 peak 9822 weight 0.10000E+01 volume 0.34600E+00 ppm1 1.515 ppm2 0.845 ASSI ( (segid " " and resid "88 " and name "HB2 ") )( (segid " " and resid "91 " and name "HB ") ) 6.000 6.000 0.000 peak 9823 weight 0.10000E+01 volume 0.22000E+00 ppm1 2.531 ppm2 4.213 ASSI ( (segid " " and resid "88 " and name "HB2 ") )( (segid " " and resid "86 " and name "HG21") OR (segid " " and resid "83 " and name "HB3 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "83 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9824 weight 0.10000E+01 volume 0.11000E+00 ppm1 2.535 ppm2 1.323 ASSI ( (segid " " and resid "114 " and name "HD2 ") OR (segid " " and resid "31 " and name "HD2 ") )( (segid " " and resid "160 " and name "HD13") OR (segid " " and resid "160 " and name "HD12") OR (segid " " and resid "160 " and name "HD11") OR (segid " " and resid "30 " and name "HD13") OR (segid " " and resid "30 " and name "HD12") OR (segid " " and resid "30 " and name "HD11") ) 6.000 6.000 0.000 peak 9825 weight 0.10000E+01 volume -0.12500E+00 ppm1 6.961 ppm2 0.664 ASSI ( (segid " " and resid "88 " and name "HB1 ") )( (segid " " and resid "91 " and name "HB ") ) 6.000 6.000 0.000 peak 9826 weight 0.10000E+01 volume 0.13700E+00 ppm1 3.448 ppm2 4.209 ASSI ( (segid " " and resid "113 " and name "HB ") )( (segid " " and resid "128 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9827 weight 0.10000E+01 volume 0.48900E+00 ppm1 1.734 ppm2 1.203 ASSI ( (segid " " and resid "114 " and name "HD2 ") )( (segid " " and resid "142 " and name "HD13") OR (segid " " and resid "117 " and name "HD13") OR (segid " " and resid "117 " and name "HD12") OR (segid " " and resid "117 " and name "HD11") ) 6.000 6.000 0.000 peak 9828 weight 0.10000E+01 volume -0.20400E+00 ppm1 6.957 ppm2 0.899 ASSI ( (segid " " and resid "75 " and name "HB1 ") OR (segid " " and resid "37 " and name "HA ") )( (segid " " and resid "77 " and name "HA ") OR (segid " " and resid "76 " and name "HA2 ") OR (segid " " and resid "62 " and name "HA ") ) 5.000 5.000 0.000 peak 9829 weight 0.10000E+01 volume -0.51600E+00 ppm1 4.102 ppm2 3.781 ASSI ( (segid " " and resid "113 " and name "HB ") )( (segid " " and resid "128 " and name "HD23") OR (segid " " and resid "128 " and name "HD22") OR (segid " " and resid "128 " and name "HD21") ) 5.000 5.000 0.000 peak 9830 weight 0.10000E+01 volume 0.91600E+00 ppm1 1.727 ppm2 0.891 ASSI ( (segid " " and resid "37 " and name "HA ") )( (segid " " and resid "62 " and name "HD13") OR (segid " " and resid "62 " and name "HD12") OR (segid " " and resid "30 " and name "HD13") OR (segid " " and resid "30 " and name "HD12") OR (segid " " and resid "30 " and name "HD11") ) 5.000 5.000 0.000 peak 9831 weight 0.10000E+01 volume -0.77200E+00 ppm1 4.102 ppm2 0.673 ASSI ( (segid " " and resid "37 " and name "HA ") )( (segid " " and resid "14 " and name "HG ") ) 5.000 5.000 0.000 peak 9832 weight 0.10000E+01 volume -0.64400E+00 ppm1 4.101 ppm2 1.580 ASSI ( (segid " " and resid "114 " and name "HD2 ") )( (segid " " and resid "113 " and name "HG23") OR (segid " " and resid "113 " and name "HG22") OR (segid " " and resid "113 " and name "HG21") ) 6.000 6.000 0.000 peak 9833 weight 0.10000E+01 volume -0.15700E+00 ppm1 6.957 ppm2 0.756 ASSI ( (segid " " and resid "114 " and name "HD2 ") )( (segid " " and resid "142 " and name "HD13") OR (segid " " and resid "117 " and name "HD13") OR (segid " " and resid "117 " and name "HD12") OR (segid " " and resid "117 " and name "HD11") ) 6.000 6.000 0.000 peak 9834 weight 0.10000E+01 volume -0.26100E+00 ppm1 6.957 ppm2 0.910 ASSI ( (segid " " and resid "37 " and name "HA ") )( (segid " " and resid "37 " and name "HD1 ") ) 6.000 6.000 0.000 peak 9835 weight 0.10000E+01 volume -0.17100E+00 ppm1 4.102 ppm2 3.301 ASSI ( (segid " " and resid "117 " and name "HA ") )( (segid " " and resid "120 " and name "HA1 ") OR (segid " " and resid "114 " and name "HA ") ) 6.000 6.000 0.000 peak 9836 weight 0.10000E+01 volume -0.11200E+00 ppm1 3.515 ppm2 4.009 ASSI ( (segid " " and resid "159 " and name "HA ") )( (segid " " and resid "160 " and name "HD23") OR (segid " " and resid "160 " and name "HD22") OR (segid " " and resid "160 " and name "HD21") OR (segid " " and resid "156 " and name "HD23") OR (segid " " and resid "156 " and name "HD22") ) 5.000 5.000 0.000 peak 9837 weight 0.10000E+01 volume -0.32100E+00 ppm1 3.763 ppm2 0.743 ASSI ( (segid " " and resid "159 " and name "HA ") )( (segid " " and resid "162 " and name "HA1 ") OR (segid " " and resid "126 " and name "HA ") ) 5.000 5.000 0.000 peak 9838 weight 0.10000E+01 volume -0.32700E+00 ppm1 3.761 ppm2 4.007 ASSI ( (segid " " and resid "56 " and name "HA ") )( (segid " " and resid "93 " and name "HB2 ") OR (segid " " and resid "51 " and name "HE3 ") OR (segid " " and resid "51 " and name "HE2 ") OR (segid " " and resid "51 " and name "HE1 ") ) 6.000 6.000 0.000 peak 9839 weight 0.10000E+01 volume -0.29700E+00 ppm1 4.315 ppm2 1.687 ASSI ( (segid " " and resid "56 " and name "HA ") )( (segid " " and resid "94 " and name "HA ") OR (segid " " and resid "57 " and name "HA ") ) 5.000 5.000 0.000 peak 9840 weight 0.10000E+01 volume -0.71500E+00 ppm1 4.312 ppm2 4.091 ASSI ( (segid " " and resid "117 " and name "HA ") )( (segid " " and resid "148 " and name "HB2 ") OR (segid " " and resid "148 " and name "HB1 ") OR (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB1 ") OR (segid " " and resid "113 " and name "HG11") ) 5.000 5.000 0.000 peak 9841 weight 0.10000E+01 volume -0.30600E+00 ppm1 3.514 ppm2 1.469 ASSI ( (segid " " and resid "117 " and name "HA ") )( (segid " " and resid "156 " and name "HD13") OR (segid " " and resid "156 " and name "HD12") OR (segid " " and resid "156 " and name "HD11") OR (segid " " and resid "125 " and name "HG13") OR (segid " " and resid "125 " and name "HG12") OR (segid " " and resid "125 " and name "HG11") ) 3.300 3.300 0.000 peak 9842 weight 0.10000E+01 volume -0.25860E+01 ppm1 3.514 ppm2 1.006 ASSI ( (segid " " and resid "56 " and name "HA ") )( (segid " " and resid "94 " and name "HG13") OR (segid " " and resid "94 " and name "HG11") OR (segid " " and resid "91 " and name "HG23") OR (segid " " and resid "91 " and name "HG22") OR (segid " " and resid "91 " and name "HG21") ) 5.000 5.000 0.000 peak 9843 weight 0.10000E+01 volume -0.11110E+01 ppm1 4.309 ppm2 1.157 ASSI ( (segid " " and resid "117 " and name "HA ") )( (segid " " and resid "153 " and name "HB3 ") OR (segid " " and resid "153 " and name "HB2 ") OR (segid " " and resid "153 " and name "HB1 ") OR (segid " " and resid "113 " and name "HG12") ) 6.000 6.000 0.000 peak 9844 weight 0.10000E+01 volume -0.15800E+00 ppm1 3.514 ppm2 1.353 ASSI ( (segid " " and resid "117 " and name "HA ") )( (segid " " and resid "156 " and name "HG ") OR (segid " " and resid "151 " and name "HG1 ") OR (segid " " and resid "118 " and name "HG1 ") ) 6.000 6.000 0.000 peak 9846 weight 0.10000E+01 volume -0.17800E+00 ppm1 3.514 ppm2 1.886 ASSI ( (segid " " and resid "117 " and name "HA ") )( (segid " " and resid "157 " and name "HA ") OR (segid " " and resid "148 " and name "HA ") OR (segid " " and resid "85 " and name "HA ") ) 6.000 6.000 0.000 peak 9847 weight 0.10000E+01 volume -0.18000E+00 ppm1 3.514 ppm2 3.755 ASSI ( (segid " " and resid "117 " and name "HB ") )( (segid " " and resid "114 " and name "HA ") ) 5.000 5.000 0.000 peak 9848 weight 0.10000E+01 volume 0.79000E+00 ppm1 2.058 ppm2 3.982 ASSI ( (segid " " and resid "117 " and name "HB ") )( (segid " " and resid "156 " and name "HD13") OR (segid " " and resid "147 " and name "HD23") OR (segid " " and resid "147 " and name "HD22") OR (segid " " and resid "147 " and name "HD21") OR (segid " " and resid "125 " and name "HG13") OR (segid " " and resid "125 " and name "HG12") OR (segid " " and resid "125 " and name "HG11") ) 5.000 5.000 0.000 peak 9849 weight 0.10000E+01 volume 0.81800E+00 ppm1 2.068 ppm2 1.002 ASSI ( (segid " " and resid "117 " and name "HB ") )( (segid " " and resid "147 " and name "HD13") OR (segid " " and resid "147 " and name "HD12") OR (segid " " and resid "147 " and name "HD11") ) 5.000 5.000 0.000 peak 9850 weight 0.10000E+01 volume 0.65100E+00 ppm1 2.070 ppm2 1.189 ASSI ( (segid " " and resid "117 " and name "HB ") )( (segid " " and resid "160 " and name "HG ") OR (segid " " and resid "151 " and name "HG2 ") OR (segid " " and resid "144 " and name "HG1 ") OR (segid " " and resid "144 " and name "HB2 ") OR (segid " " and resid "128 " and name "HB1 ") OR (segid " " and resid "113 " and name "HB ") ) 6.000 6.000 0.000 peak 9851 weight 0.10000E+01 volume 0.22300E+00 ppm1 2.104 ppm2 1.732 ASSI ( (segid " " and resid "53 " and name "HB2 ") )( (segid " " and resid "88 " and name "HD2 ") OR (segid " " and resid "88 " and name "HD1 ") ) 6.000 6.000 0.000 peak 9852 weight 0.10000E+01 volume 0.15000E+00 ppm1 2.724 ppm2 7.434 ASSI ( (segid " " and resid "53 " and name "HB1 ") )( (segid " " and resid "88 " and name "HD2 ") OR (segid " " and resid "88 " and name "HD1 ") ) 6.000 6.000 0.000 peak 9853 weight 0.10000E+01 volume 0.13500E+00 ppm1 2.830 ppm2 7.437 ASSI ( (segid " " and resid "53 " and name "HB2 ") )( (segid " " and resid "92 " and name "HB2 ") OR (segid " " and resid "86 " and name "HG21") OR (segid " " and resid "83 " and name "HB3 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "83 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9854 weight 0.10000E+01 volume 0.19700E+00 ppm1 2.732 ppm2 1.337 ASSI ( (segid " " and resid "130 " and name "HA ") )( (segid " " and resid "129 " and name "HB3 ") OR (segid " " and resid "129 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9855 weight 0.10000E+01 volume -0.20700E+00 ppm1 4.162 ppm2 1.130 ASSI ( (segid " " and resid "130 " and name "HA ") )( (segid " " and resid "163 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9856 weight 0.10000E+01 volume -0.15300E+00 ppm1 4.170 ppm2 3.274 ASSI ( (segid " " and resid "130 " and name "HA ") )( (segid " " and resid "167 " and name "HD2 ") OR (segid " " and resid "129 " and name "HA ") ) 6.000 6.000 0.000 peak 9857 weight 0.10000E+01 volume -0.15200E+00 ppm1 4.155 ppm2 3.755 ASSI ( (segid " " and resid "130 " and name "HA ") )( (segid " " and resid "167 " and name "HD1 ") OR (segid " " and resid "160 " and name "HA ") OR (segid " " and resid "134 " and name "HA ") ) 5.000 5.000 0.000 peak 9858 weight 0.10000E+01 volume -0.37000E+00 ppm1 4.154 ppm2 3.928 ASSI ( (segid " " and resid "43 " and name "HB1 ") )( (segid " " and resid "42 " and name "HD2 ") OR (segid " " and resid "42 " and name "HD1 ") ) 6.000 6.000 0.000 peak 9859 weight 0.10000E+01 volume 0.13700E+00 ppm1 3.540 ppm2 2.959 ASSI ( (segid " " and resid "166 " and name "HB ") )( (segid " " and resid "167 " and name "HD2 ") ) 6.000 6.000 0.000 peak 9860 weight 0.10000E+01 volume 0.27100E+00 ppm1 1.911 ppm2 3.735 ASSI ( (segid " " and resid "166 " and name "HB ") )( (segid " " and resid "167 " and name "HD1 ") OR (segid " " and resid "162 " and name "HA1 ") ) 6.000 6.000 0.000 peak 9861 weight 0.10000E+01 volume 0.20000E+00 ppm1 1.909 ppm2 3.942 ASSI ( (segid " " and resid "78 " and name "HB2 ") )( (segid " " and resid "104 " and name "HB3 ") OR (segid " " and resid "104 " and name "HB2 ") OR (segid " " and resid "104 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9862 weight 0.10000E+01 volume -0.24600E+00 ppm1 4.288 ppm2 1.334 ASSI ( (segid " " and resid "133 " and name "HB2 ") OR (segid " " and resid "103 " and name "HB2 ") )( (segid " " and resid "111 " and name "HD23") OR (segid " " and resid "111 " and name "HD22") OR (segid " " and resid "111 " and name "HD21") ) 5.000 5.000 0.000 peak 9863 weight 0.10000E+01 volume 0.43200E+00 ppm1 2.574 ppm2 0.956 ASSI ( (segid " " and resid "133 " and name "HB1 ") OR (segid " " and resid "103 " and name "HB1 ") )( (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") ) 6.000 6.000 0.000 peak 9864 weight 0.10000E+01 volume 0.28200E+00 ppm1 2.925 ppm2 1.190 ASSI ( (segid " " and resid "133 " and name "HB1 ") OR (segid " " and resid "103 " and name "HB1 ") )( (segid " " and resid "112 " and name "HG2 ") OR (segid " " and resid "105 " and name "HD13") OR (segid " " and resid "105 " and name "HD12") OR (segid " " and resid "105 " and name "HD11") OR (segid " " and resid "102 " and name "HG23") OR (segid " " and resid "102 " and name "HG22") OR (segid " " and resid "102 " and name "HG21") OR (segid " " and resid "102 " and name "HG13") OR (segid " " and resid "102 " and name "HG12") OR (segid " " and resid "102 " and name "HG11") ) 6.000 6.000 0.000 peak 9865 weight 0.10000E+01 volume 0.16000E+00 ppm1 2.944 ppm2 0.848 ASSI ( (segid " " and resid "133 " and name "HB2 ") OR (segid " " and resid "103 " and name "HB2 ") )( (segid " " and resid "133 " and name "HB1 ") OR (segid " " and resid "103 " and name "HB1 ") ) 2.700 2.700 0.000 peak 9866 weight 0.10000E+01 volume 0.47490E+01 ppm1 2.573 ppm2 2.938 ASSI ( (segid " " and resid "133 " and name "HB1 ") OR (segid " " and resid "103 " and name "HB1 ") )( (segid " " and resid "133 " and name "HB2 ") OR (segid " " and resid "103 " and name "HB2 ") ) 2.700 2.700 0.000 peak 9867 weight 0.10000E+01 volume 0.42180E+01 ppm1 2.945 ppm2 2.570 ASSI ( (segid " " and resid "133 " and name "HB1 ") OR (segid " " and resid "103 " and name "HB1 ") )( (segid " " and resid "111 " and name "HD23") OR (segid " " and resid "111 " and name "HD22") OR (segid " " and resid "111 " and name "HD21") ) 5.000 5.000 0.000 peak 9868 weight 0.10000E+01 volume 0.56700E+00 ppm1 2.951 ppm2 0.962 ASSI ( (segid " " and resid "78 " and name "HB1 ") )( (segid " " and resid "112 " and name "HB2 ") OR (segid " " and resid "80 " and name "HB ") OR (segid " " and resid "69 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9869 weight 0.10000E+01 volume -0.18900E+00 ppm1 4.448 ppm2 1.913 ASSI ( (segid " " and resid "78 " and name "HB1 ") )( (segid " " and resid "79 " and name "HG2 ") OR (segid " " and resid "79 " and name "HG1 ") OR (segid " " and resid "71 " and name "HB ") ) 6.000 6.000 0.000 peak 9870 weight 0.10000E+01 volume -0.29100E+00 ppm1 4.448 ppm2 2.020 ASSI ( (segid " " and resid "78 " and name "HB1 ") )( (segid " " and resid "69 " and name "HG1 ") OR (segid " " and resid "49 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9871 weight 0.10000E+01 volume -0.19800E+00 ppm1 4.448 ppm2 2.100 ASSI ( (segid " " and resid "78 " and name "HB2 ") )( (segid " " and resid "72 " and name "HA ") ) 6.000 6.000 0.000 peak 9872 weight 0.10000E+01 volume -0.15900E+00 ppm1 4.288 ppm2 5.009 ASSI ( (segid " " and resid "78 " and name "HB2 ") )( (segid " " and resid "81 " and name "HE1 ") OR (segid " " and resid "53 " and name "HZ ") ) 6.000 6.000 0.000 peak 9873 weight 0.10000E+01 volume -0.89000E-01 ppm1 4.288 ppm2 7.464 ASSI ( (segid " " and resid "78 " and name "HB2 ") )( (segid " " and resid "79 " and name "HG2 ") OR (segid " " and resid "79 " and name "HG1 ") ) 5.000 5.000 0.000 peak 9874 weight 0.10000E+01 volume -0.33700E+00 ppm1 4.279 ppm2 2.023 ASSI ( (segid " " and resid "133 " and name "HB2 ") OR (segid " " and resid "103 " and name "HB2 ") )( (segid " " and resid "112 " and name "HG2 ") OR (segid " " and resid "105 " and name "HD13") OR (segid " " and resid "105 " and name "HD12") OR (segid " " and resid "105 " and name "HD11") OR (segid " " and resid "102 " and name "HG23") OR (segid " " and resid "102 " and name "HG22") OR (segid " " and resid "102 " and name "HG21") OR (segid " " and resid "102 " and name "HG13") OR (segid " " and resid "102 " and name "HG12") OR (segid " " and resid "102 " and name "HG11") ) 6.000 6.000 0.000 peak 9875 weight 0.10000E+01 volume 0.16400E+00 ppm1 2.564 ppm2 0.843 ASSI ( (segid " " and resid "133 " and name "HB2 ") )( (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") ) 6.000 6.000 0.000 peak 9876 weight 0.10000E+01 volume 0.28500E+00 ppm1 2.586 ppm2 1.196 ASSI ( (segid " " and resid "10 " and name "HA ") )( (segid " " and resid "13 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9877 weight 0.10000E+01 volume -0.15230E+01 ppm1 3.888 ppm2 1.913 ASSI ( (segid " " and resid "10 " and name "HA ") )( (segid " " and resid "13 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9878 weight 0.10000E+01 volume -0.14840E+01 ppm1 3.888 ppm2 1.967 ASSI ( (segid " " and resid "132 " and name "HB2 ") OR (segid " " and resid "132 " and name "HB1 ") )( (segid " " and resid "128 " and name "HD13") OR (segid " " and resid "128 " and name "HD12") OR (segid " " and resid "128 " and name "HD11") OR (segid " " and resid "113 " and name "HD12") OR (segid " " and resid "113 " and name "HD11") OR (segid " " and resid "113 " and name "HG23") OR (segid " " and resid "113 " and name "HG22") OR (segid " " and resid "113 " and name "HG21") ) 5.000 5.000 0.000 peak 9880 weight 0.10000E+01 volume -0.16010E+01 ppm1 3.514 ppm2 0.712 ASSI ( (segid " " and resid "132 " and name "HB2 ") OR (segid " " and resid "132 " and name "HB1 ") )( (segid " " and resid "102 " and name "HG23") OR (segid " " and resid "102 " and name "HG22") OR (segid " " and resid "102 " and name "HG21") OR (segid " " and resid "102 " and name "HG13") OR (segid " " and resid "102 " and name "HG11") ) 5.000 5.000 0.000 peak 9881 weight 0.10000E+01 volume -0.61100E+00 ppm1 3.514 ppm2 0.899 ASSI ( (segid " " and resid "132 " and name "HB2 ") OR (segid " " and resid "132 " and name "HB1 ") )( (segid " " and resid "128 " and name "HB1 ") OR (segid " " and resid "113 " and name "HB ") ) 6.000 6.000 0.000 peak 9882 weight 0.10000E+01 volume -0.16800E+00 ppm1 3.514 ppm2 1.700 ASSI ( (segid " " and resid "159 " and name "HB ") )( (segid " " and resid "156 " and name "HA ") ) 5.000 5.000 0.000 peak 9883 weight 0.10000E+01 volume 0.47000E+00 ppm1 1.865 ppm2 4.149 ASSI ( (segid " " and resid "124 " and name "HA ") )( (segid " " and resid "127 " and name "HD2 ") OR (segid " " and resid "127 " and name "HD1 ") ) 6.000 6.000 0.000 peak 9884 weight 0.10000E+01 volume -0.20900E+00 ppm1 3.755 ppm2 7.144 ASSI ( (segid " " and resid "159 " and name "HB ") )( (segid " " and resid "126 " and name "HB2 ") OR (segid " " and resid "126 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9885 weight 0.10000E+01 volume 0.18000E+00 ppm1 1.855 ppm2 3.889 ASSI ( (segid " " and resid "159 " and name "HB ") )( (segid " " and resid "160 " and name "HD23") OR (segid " " and resid "160 " and name "HD22") OR (segid " " and resid "160 " and name "HD21") OR (segid " " and resid "156 " and name "HD22") ) 5.000 5.000 0.000 peak 9886 weight 0.10000E+01 volume 0.53700E+00 ppm1 1.866 ppm2 0.746 ASSI ( (segid " " and resid "124 " and name "HA ") OR (segid " " and resid "91 " and name "HA ") )( (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB1 ") OR (segid " " and resid "93 " and name "HD2 ") OR (segid " " and resid "93 " and name "HD1 ") OR (segid " " and resid "84 " and name "HB2 ") OR (segid " " and resid "84 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9887 weight 0.10000E+01 volume -0.12320E+01 ppm1 3.752 ppm2 1.459 ASSI ( (segid " " and resid "124 " and name "HA ") )( (segid " " and resid "127 " and name "HD2 ") OR (segid " " and resid "127 " and name "HD1 ") ) 6.000 6.000 0.000 peak 9888 weight 0.10000E+01 volume -0.20900E+00 ppm1 3.752 ppm2 7.135 ASSI ( (segid " " and resid "124 " and name "HA ") )( (segid " " and resid "89 " and name "HD23") OR (segid " " and resid "89 " and name "HD22") OR (segid " " and resid "89 " and name "HD21") ) 5.000 5.000 0.000 peak 9889 weight 0.10000E+01 volume -0.16870E+01 ppm1 3.753 ppm2 0.611 ASSI ( (segid " " and resid "124 " and name "HA ") OR (segid " " and resid "91 " and name "HA ") )( (segid " " and resid "89 " and name "HG ") OR (segid " " and resid "59 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9890 weight 0.10000E+01 volume -0.18220E+01 ppm1 3.765 ppm2 1.320 ASSI ( (segid " " and resid "124 " and name "HA ") OR (segid " " and resid "91 " and name "HA ") )( (segid " " and resid "128 " and name "HB1 ") OR (segid " " and resid "93 " and name "HB2 ") OR (segid " " and resid "51 " and name "HE3 ") OR (segid " " and resid "51 " and name "HE2 ") OR (segid " " and resid "51 " and name "HE1 ") ) 5.000 5.000 0.000 peak 9891 weight 0.10000E+01 volume -0.67600E+00 ppm1 3.757 ppm2 1.684 ASSI ( (segid " " and resid "124 " and name "HA ") OR (segid " " and resid "91 " and name "HA ") )( (segid " " and resid "121 " and name "HB1 ") OR (segid " " and resid "54 " and name "HA2 ") ) 6.000 6.000 0.000 peak 9892 weight 0.10000E+01 volume -0.17900E+00 ppm1 3.750 ppm2 3.127 ASSI ( (segid " " and resid "94 " and name "HA ") )( (segid " " and resid "93 " and name "HG2 ") OR (segid " " and resid "63 " and name "HD13") OR (segid " " and resid "63 " and name "HD12") OR (segid " " and resid "63 " and name "HD11") ) 6.000 6.000 0.000 peak 9893 weight 0.10000E+01 volume -0.18900E+00 ppm1 4.048 ppm2 0.659 ASSI ( (segid " " and resid "94 " and name "HA ") )( (segid " " and resid "93 " and name "HB2 ") OR (segid " " and resid "92 " and name "HG ") ) 6.000 6.000 0.000 peak 9894 weight 0.10000E+01 volume -0.20400E+00 ppm1 4.048 ppm2 1.673 ASSI ( (segid " " and resid "94 " and name "HA ") )( (segid " " and resid "95 " and name "HG ") OR (segid " " and resid "93 " and name "HB1 ") OR (segid " " and resid "60 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9895 weight 0.10000E+01 volume -0.27500E+00 ppm1 4.035 ppm2 1.753 ASSI ( (segid " " and resid "132 " and name "HB2 ") OR (segid " " and resid "132 " and name "HB1 ") )( (segid " " and resid "111 " and name "HG ") OR (segid " " and resid "111 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9896 weight 0.10000E+01 volume -0.24500E+00 ppm1 3.514 ppm2 1.940 ASSI ( (segid " " and resid "94 " and name "HA ") )( (segid " " and resid "97 " and name "HB2 ") OR (segid " " and resid "56 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9897 weight 0.10000E+01 volume -0.13400E+01 ppm1 4.045 ppm2 2.032 ASSI ( (segid " " and resid "91 " and name "HA ") )( (segid " " and resid "94 " and name "HB ") ) 5.000 5.000 0.000 peak 9899 weight 0.10000E+01 volume -0.93100E+00 ppm1 3.758 ppm2 2.266 ASSI ( (segid " " and resid "94 " and name "HA ") )( (segid " " and resid "97 " and name "HG1 ") ) 5.000 5.000 0.000 peak 9900 weight 0.10000E+01 volume -0.38100E+00 ppm1 4.048 ppm2 2.394 ASSI ( (segid " " and resid "124 " and name "HA ") OR (segid " " and resid "91 " and name "HA ") )( (segid " " and resid "93 " and name "HE2 ") OR (segid " " and resid "90 " and name "HB2 ") OR (segid " " and resid "87 " and name "HA2 ") ) 6.000 6.000 0.000 peak 9901 weight 0.10000E+01 volume -0.13000E+00 ppm1 3.755 ppm2 2.607 ASSI ( (segid " " and resid "124 " and name "HA ") OR (segid " " and resid "91 " and name "HA ") )( (segid " " and resid "93 " and name "HE1 ") OR (segid " " and resid "90 " and name "HB1 ") OR (segid " " and resid "87 " and name "HA1 ") OR (segid " " and resid "53 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9902 weight 0.10000E+01 volume -0.90000E-01 ppm1 3.754 ppm2 2.754 ASSI ( (segid " " and resid "94 " and name "HA ") )( (segid " " and resid "96 " and name "HA ") OR (segid " " and resid "91 " and name "HA ") ) 5.000 5.000 0.000 peak 9903 weight 0.10000E+01 volume -0.34800E+00 ppm1 4.048 ppm2 3.781 ASSI ( (segid " " and resid "124 " and name "HA ") OR (segid " " and resid "91 " and name "HA ") )( (segid " " and resid "123 " and name "HB2 ") OR (segid " " and resid "123 " and name "HB1 ") OR (segid " " and resid "94 " and name "HA ") OR (segid " " and resid "84 " and name "HA ") OR (segid " " and resid "56 " and name "HD1 ") ) 5.000 5.000 0.000 peak 9904 weight 0.10000E+01 volume -0.64300E+00 ppm1 3.755 ppm2 4.021 ASSI ( (segid " " and resid "63 " and name "HB1 ") )( (segid " " and resid "60 " and name "HA ") ) 6.000 6.000 0.000 peak 9906 weight 0.10000E+01 volume 0.22500E+00 ppm1 1.219 ppm2 3.637 ASSI ( (segid " " and resid "79 " and name "HA ") )( (segid " " and resid "82 " and name "HB1 ") OR (segid " " and resid "51 " and name "HG1 ") ) 5.000 5.000 0.000 peak 9907 weight 0.10000E+01 volume -0.54500E+00 ppm1 4.746 ppm2 2.315 ASSI ( (segid " " and resid "79 " and name "HA ") )( (segid " " and resid "53 " and name "HZ ") ) 5.000 5.000 0.000 peak 9908 weight 0.10000E+01 volume -0.61500E+00 ppm1 4.731 ppm2 7.447 ASSI ( (segid " " and resid "158 " and name "HB2 ") )( (segid " " and resid "155 " and name "HA ") ) 6.000 6.000 0.000 peak 9909 weight 0.10000E+01 volume 0.27900E+00 ppm1 2.671 ppm2 4.483 ASSI ( (segid " " and resid "63 " and name "HB1 ") )( (segid " " and resid "63 " and name "HD13") OR (segid " " and resid "63 " and name "HD12") OR (segid " " and resid "63 " and name "HD11") ) 5.000 5.000 0.000 peak 9910 weight 0.10000E+01 volume 0.54300E+00 ppm1 1.225 ppm2 0.642 ASSI ( (segid " " and resid "63 " and name "HB1 ") )( (segid " " and resid "94 " and name "HG23") OR (segid " " and resid "94 " and name "HG22") OR (segid " " and resid "94 " and name "HG21") OR (segid " " and resid "62 " and name "HD22") OR (segid " " and resid "60 " and name "HD23") OR (segid " " and resid "60 " and name "HD22") OR (segid " " and resid "60 " and name "HD21") OR (segid " " and resid "60 " and name "HD13") OR (segid " " and resid "60 " and name "HD12") ) 5.000 5.000 0.000 peak 9911 weight 0.10000E+01 volume 0.45100E+00 ppm1 1.217 ppm2 0.957 ASSI ( (segid " " and resid "63 " and name "HB2 ") )( (segid " " and resid "63 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9912 weight 0.10000E+01 volume 0.36500E+00 ppm1 0.874 ppm2 1.225 ASSI ( (segid " " and resid "63 " and name "HB2 ") )( (segid " " and resid "60 " and name "HA ") ) 6.000 6.000 0.000 peak 9913 weight 0.10000E+01 volume 0.17500E+00 ppm1 0.875 ppm2 3.639 ASSI ( (segid " " and resid "144 " and name "HA ") )( (segid " " and resid "144 " and name "HG1 ") ) 5.000 5.000 0.000 peak 9914 weight 0.10000E+01 volume -0.65900E+00 ppm1 3.690 ppm2 1.667 ASSI ( (segid " " and resid "144 " and name "HA ") )( (segid " " and resid "164 " and name "HB2 ") OR (segid " " and resid "160 " and name "HB1 ") OR (segid " " and resid "156 " and name "HG ") OR (segid " " and resid "149 " and name "HB2 ") OR (segid " " and resid "118 " and name "HG1 ") ) 5.000 5.000 0.000 peak 9915 weight 0.10000E+01 volume -0.81100E+00 ppm1 3.680 ppm2 1.908 ASSI ( (segid " " and resid "144 " and name "HA ") )( (segid " " and resid "147 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9916 weight 0.10000E+01 volume -0.42100E+00 ppm1 3.675 ppm2 1.536 ASSI ( (segid " " and resid "144 " and name "HA ") )( (segid " " and resid "144 " and name "HG2 ") ) 5.000 5.000 0.000 peak 9917 weight 0.10000E+01 volume -0.53100E+00 ppm1 3.689 ppm2 0.537 ASSI ( (segid " " and resid "144 " and name "HA ") )( (segid " " and resid "117 " and name "HG22") OR (segid " " and resid "117 " and name "HG21") OR (segid " " and resid "117 " and name "HG12") OR (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD12") OR (segid " " and resid "113 " and name "HD11") OR (segid " " and resid "113 " and name "HG23") OR (segid " " and resid "113 " and name "HG22") OR (segid " " and resid "113 " and name "HG21") ) 5.000 5.000 0.000 peak 9918 weight 0.10000E+01 volume -0.13280E+01 ppm1 3.689 ppm2 0.759 ASSI ( (segid " " and resid "144 " and name "HA ") )( (segid " " and resid "117 " and name "HD13") OR (segid " " and resid "117 " and name "HD12") OR (segid " " and resid "117 " and name "HD11") ) 3.300 3.300 0.000 peak 9919 weight 0.10000E+01 volume -0.20420E+01 ppm1 3.687 ppm2 0.897 ASSI ( (segid " " and resid "112 " and name "HA ") )( (segid " " and resid "128 " and name "HD13") OR (segid " " and resid "128 " and name "HD12") OR (segid " " and resid "128 " and name "HD11") OR (segid " " and resid "113 " and name "HG23") OR (segid " " and resid "113 " and name "HG21") ) 6.000 6.000 0.000 peak 9920 weight 0.10000E+01 volume -0.24000E+00 ppm1 4.146 ppm2 0.710 ASSI ( (segid " " and resid "112 " and name "HA ") )( (segid " " and resid "128 " and name "HD23") OR (segid " " and resid "128 " and name "HD21") OR (segid " " and resid "112 " and name "HG2 ") OR (segid " " and resid "80 " and name "HG23") OR (segid " " and resid "80 " and name "HG22") OR (segid " " and resid "80 " and name "HG21") OR (segid " " and resid "80 " and name "HG13") OR (segid " " and resid "80 " and name "HG11") ) 5.000 5.000 0.000 peak 9921 weight 0.10000E+01 volume -0.67100E+00 ppm1 4.131 ppm2 0.853 ASSI ( (segid " " and resid "158 " and name "HB1 ") )( (segid " " and resid "155 " and name "HA ") ) 6.000 6.000 0.000 peak 9922 weight 0.10000E+01 volume 0.25600E+00 ppm1 2.800 ppm2 4.473 ASSI ( (segid " " and resid "112 " and name "HA ") )( (segid " " and resid "115 " and name "HD13") OR (segid " " and resid "115 " and name "HD12") OR (segid " " and resid "115 " and name "HD11") ) 5.000 5.000 0.000 peak 9923 weight 0.10000E+01 volume -0.83700E+00 ppm1 4.138 ppm2 1.232 ASSI ( (segid " " and resid "127 " and name "HB1 ") )( (segid " " and resid "124 " and name "HA ") ) 6.000 6.000 0.000 peak 9924 weight 0.10000E+01 volume 0.94000E-01 ppm1 3.414 ppm2 3.752 ASSI ( (segid " " and resid "127 " and name "HB2 ") OR (segid " " and resid "106 " and name "HB1 ") )( (segid " " and resid "124 " and name "HA ") OR (segid " " and resid "77 " and name "HA ") OR (segid " " and resid "76 " and name "HA2 ") ) 5.000 5.000 0.000 peak 9925 weight 0.10000E+01 volume 0.37900E+00 ppm1 2.932 ppm2 3.753 ASSI ( (segid " " and resid "127 " and name "HB2 ") )( (segid " " and resid "89 " and name "HD13") OR (segid " " and resid "89 " and name "HD12") OR (segid " " and resid "89 " and name "HD11") ) 6.000 6.000 0.000 peak 9926 weight 0.10000E+01 volume 0.14200E+00 ppm1 2.952 ppm2 0.827 ASSI ( (segid " " and resid "127 " and name "HB2 ") )( (segid " " and resid "128 " and name "HD23") OR (segid " " and resid "128 " and name "HD22") OR (segid " " and resid "128 " and name "HD21") OR (segid " " and resid "124 " and name "HG23") OR (segid " " and resid "124 " and name "HG22") OR (segid " " and resid "124 " and name "HG21") OR (segid " " and resid "124 " and name "HG13") OR (segid " " and resid "124 " and name "HG12") OR (segid " " and resid "124 " and name "HG11") OR (segid " " and resid "92 " and name "HD12") OR (segid " " and resid "92 " and name "HD11") ) 5.000 5.000 0.000 peak 9927 weight 0.10000E+01 volume 0.35500E+00 ppm1 2.952 ppm2 0.946 ASSI ( (segid " " and resid "127 " and name "HB1 ") )( (segid " " and resid "127 " and name "HE2 ") OR (segid " " and resid "127 " and name "HE1 ") ) 6.000 6.000 0.000 peak 9928 weight 0.10000E+01 volume 0.20200E+00 ppm1 3.413 ppm2 7.222 ASSI ( (segid " " and resid "96 " and name "HA ") )( (segid " " and resid "102 " and name "HG23") OR (segid " " and resid "102 " and name "HG22") OR (segid " " and resid "102 " and name "HG13") OR (segid " " and resid "102 " and name "HG12") OR (segid " " and resid "102 " and name "HG11") OR (segid " " and resid "80 " and name "HG13") ) 5.000 5.000 0.000 peak 9929 weight 0.10000E+01 volume -0.14140E+01 ppm1 3.762 ppm2 0.883 ASSI ( (segid " " and resid "106 " and name "HB2 ") )( (segid " " and resid "77 " and name "HA ") OR (segid " " and resid "76 " and name "HA2 ") ) 5.000 5.000 0.000 peak 9930 weight 0.10000E+01 volume 0.32800E+00 ppm1 1.380 ppm2 3.774 ASSI ( (segid " " and resid "96 " and name "HA ") )( (segid " " and resid "131 " and name "HG1 ") OR (segid " " and resid "128 " and name "HG ") OR (segid " " and resid "97 " and name "HG2 ") OR (segid " " and resid "97 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9931 weight 0.10000E+01 volume -0.22900E+00 ppm1 3.761 ppm2 2.053 ASSI ( (segid " " and resid "106 " and name "HB1 ") )( (segid " " and resid "77 " and name "HA ") OR (segid " " and resid "76 " and name "HA2 ") ) 5.000 5.000 0.000 peak 9932 weight 0.10000E+01 volume 0.41100E+00 ppm1 2.878 ppm2 3.755 ASSI ( (segid " " and resid "96 " and name "HA ") )( (segid " " and resid "95 " and name "HG ") OR (segid " " and resid "69 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9933 weight 0.10000E+01 volume -0.30600E+00 ppm1 3.756 ppm2 1.707 ASSI ( (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD12") OR (segid " " and resid "113 " and name "HD11") )( (segid " " and resid "129 " and name "HB3 ") OR (segid " " and resid "129 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9934 weight 0.10000E+01 volume -0.18950E+01 ppm1 0.739 ppm2 1.123 ASSI ( (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD12") OR (segid " " and resid "113 " and name "HD11") )( (segid " " and resid "128 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9935 weight 0.10000E+01 volume -0.16560E+01 ppm1 0.741 ppm2 1.216 ASSI ( (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD12") OR (segid " " and resid "113 " and name "HD11") )( (segid " " and resid "160 " and name "HB1 ") OR (segid " " and resid "134 " and name "HG ") OR (segid " " and resid "112 " and name "HB2 ") OR (segid " " and resid "111 " and name "HG ") OR (segid " " and resid "111 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9936 weight 0.10000E+01 volume -0.78300E+00 ppm1 0.739 ppm2 1.954 ASSI ( (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD12") OR (segid " " and resid "113 " and name "HD11") )( (segid " " and resid "128 " and name "HG ") OR (segid " " and resid "117 " and name "HG11") OR (segid " " and resid "117 " and name "HB ") ) 5.000 5.000 0.000 peak 9937 weight 0.10000E+01 volume -0.64100E+00 ppm1 0.741 ppm2 2.019 ASSI ( (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD12") OR (segid " " and resid "113 " and name "HD11") )( (segid " " and resid "125 " and name "HB ") ) 6.000 6.000 0.000 peak 9938 weight 0.10000E+01 volume -0.19800E+00 ppm1 0.746 ppm2 2.236 ASSI ( (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD12") OR (segid " " and resid "113 " and name "HD11") )( (segid " " and resid "125 " and name "HA ") ) 5.000 5.000 0.000 peak 9939 weight 0.10000E+01 volume -0.62200E+00 ppm1 0.743 ppm2 3.375 ASSI ( (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD12") OR (segid " " and resid "113 " and name "HD11") )( (segid " " and resid "132 " and name "HB2 ") OR (segid " " and resid "132 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9940 weight 0.10000E+01 volume -0.73600E+00 ppm1 0.739 ppm2 3.515 ASSI ( (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD12") OR (segid " " and resid "113 " and name "HD11") )( (segid " " and resid "126 " and name "HA ") OR (segid " " and resid "114 " and name "HA ") ) 5.000 5.000 0.000 peak 9941 weight 0.10000E+01 volume -0.33300E+00 ppm1 0.739 ppm2 3.984 ASSI ( (segid " " and resid "12 " and name "HB2 ") )( (segid " " and resid "8 " and name "HG13") OR (segid " " and resid "8 " and name "HG12") ) 6.000 6.000 0.000 peak 9942 weight 0.10000E+01 volume 0.29600E+00 ppm1 2.602 ppm2 0.964 ASSI ( (segid " " and resid "12 " and name "HB1 ") )( (segid " " and resid "8 " and name "HG22") OR (segid " " and resid "8 " and name "HG21") OR (segid " " and resid "8 " and name "HG13") OR (segid " " and resid "8 " and name "HG12") OR (segid " " and resid "8 " and name "HG11") ) 6.000 6.000 0.000 peak 9943 weight 0.10000E+01 volume 0.27400E+00 ppm1 3.025 ppm2 0.965 ASSI ( (segid " " and resid "12 " and name "HB1 ") )( (segid " " and resid "40 " and name "HA ") OR (segid " " and resid "7 " and name "HA ") OR (segid " " and resid "6 " and name "HA ") ) 6.000 6.000 0.000 peak 9944 weight 0.10000E+01 volume 0.22800E+00 ppm1 3.031 ppm2 4.317 ASSI ( (segid " " and resid "156 " and name "HB1 ") )( (segid " " and resid "159 " and name "HD13") OR (segid " " and resid "159 " and name "HD12") OR (segid " " and resid "159 " and name "HD11") ) 5.000 5.000 0.000 peak 9945 weight 0.10000E+01 volume 0.76200E+00 ppm1 2.099 ppm2 0.876 ASSI ( (segid " " and resid "159 " and name "HD13") OR (segid " " and resid "159 " and name "HD12") OR (segid " " and resid "159 " and name "HD11") )( (segid " " and resid "160 " and name "HD13") OR (segid " " and resid "160 " and name "HD12") OR (segid " " and resid "160 " and name "HD11") ) 5.000 5.000 0.000 peak 9946 weight 0.10000E+01 volume -0.39400E+00 ppm1 0.910 ppm2 0.588 ASSI ( (segid " " and resid "156 " and name "HB2 ") )( (segid " " and resid "153 " and name "HB3 ") OR (segid " " and resid "153 " and name "HB2 ") OR (segid " " and resid "153 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9947 weight 0.10000E+01 volume 0.77700E+00 ppm1 1.160 ppm2 1.378 ASSI ( (segid " " and resid "101 " and name "HB2 ") )( (segid " " and resid "79 " and name "HD2 ") OR (segid " " and resid "79 " and name "HD1 ") OR (segid " " and resid "78 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9948 weight 0.10000E+01 volume 0.28000E+00 ppm1 2.615 ppm2 4.314 ASSI ( (segid " " and resid "138 " and name "HB1 ") )( (segid " " and resid "110 " and name "HB1 ") OR (segid " " and resid "110 " and name "HA ") ) 6.000 6.000 0.000 peak 9949 weight 0.10000E+01 volume 0.23200E+00 ppm1 2.840 ppm2 4.104 ASSI ( (segid " " and resid "138 " and name "HB2 ") )( (segid " " and resid "110 " and name "HB1 ") OR (segid " " and resid "110 " and name "HA ") ) 6.000 6.000 0.000 peak 9950 weight 0.10000E+01 volume 0.26100E+00 ppm1 1.590 ppm2 4.084 ASSI ( (segid " " and resid "159 " and name "HD13") OR (segid " " and resid "159 " and name "HD12") OR (segid " " and resid "159 " and name "HD11") )( (segid " " and resid "148 " and name "HB3 ") OR (segid " " and resid "148 " and name "HB2 ") OR (segid " " and resid "148 " and name "HB1 ") OR (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB1 ") OR (segid " " and resid "113 " and name "HG11") ) 6.000 6.000 0.000 peak 9951 weight 0.10000E+01 volume -0.21100E+00 ppm1 0.899 ppm2 1.459 ASSI ( (segid " " and resid "159 " and name "HD13") OR (segid " " and resid "159 " and name "HD12") )( (segid " " and resid "156 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9952 weight 0.10000E+01 volume -0.52700E+00 ppm1 0.905 ppm2 2.092 ASSI ( (segid " " and resid "159 " and name "HD13") OR (segid " " and resid "159 " and name "HD12") OR (segid " " and resid "159 " and name "HD11") )( (segid " " and resid "154 " and name "HB1 ") OR (segid " " and resid "125 " and name "HB ") ) 5.000 5.000 0.000 peak 9953 weight 0.10000E+01 volume -0.53600E+00 ppm1 0.899 ppm2 2.233 ASSI ( (segid " " and resid "159 " and name "HD13") OR (segid " " and resid "159 " and name "HD12") OR (segid " " and resid "159 " and name "HD11") )( (segid " " and resid "154 " and name "HG2 ") OR (segid " " and resid "154 " and name "HG1 ") ) 6.000 6.000 0.000 peak 9954 weight 0.10000E+01 volume -0.18400E+00 ppm1 0.899 ppm2 2.394 ASSI ( (segid " " and resid "159 " and name "HD13") OR (segid " " and resid "159 " and name "HD12") OR (segid " " and resid "159 " and name "HD11") )( (segid " " and resid "155 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9955 weight 0.10000E+01 volume -0.20700E+00 ppm1 0.908 ppm2 2.890 ASSI ( (segid " " and resid "159 " and name "HD13") OR (segid " " and resid "159 " and name "HD12") OR (segid " " and resid "159 " and name "HD11") )( (segid " " and resid "156 " and name "HA ") ) 5.000 5.000 0.000 peak 9956 weight 0.10000E+01 volume -0.12060E+01 ppm1 0.914 ppm2 4.155 ASSI ( (segid " " and resid "159 " and name "HD13") OR (segid " " and resid "159 " and name "HD12") OR (segid " " and resid "159 " and name "HD11") )( (segid " " and resid "158 " and name "HA ") OR (segid " " and resid "154 " and name "HA ") OR (segid " " and resid "123 " and name "HA ") ) 6.000 6.000 0.000 peak 9957 weight 0.10000E+01 volume -0.17400E+00 ppm1 0.914 ppm2 4.336 ASSI ( (segid " " and resid "138 " and name "HB2 ") )( (segid " " and resid "114 " and name "HD2 ") ) 6.000 6.000 0.000 peak 9958 weight 0.10000E+01 volume 0.99000E-01 ppm1 1.625 ppm2 6.965 ASSI ( (segid " " and resid "156 " and name "HB1 ") )( (segid " " and resid "148 " and name "HB3 ") OR (segid " " and resid "148 " and name "HB2 ") OR (segid " " and resid "148 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9959 weight 0.10000E+01 volume 0.13990E+01 ppm1 2.097 ppm2 1.390 ASSI ( (segid " " and resid "82 " and name "HB1 ") )( (segid " " and resid "53 " and name "HZ ") ) 6.000 6.000 0.000 peak 9960 weight 0.10000E+01 volume 0.12200E+00 ppm1 2.285 ppm2 7.448 ASSI ( (segid " " and resid "101 " and name "HB2 ") )( (segid " " and resid "80 " and name "HG13") OR (segid " " and resid "80 " and name "HG12") OR (segid " " and resid "80 " and name "HG11") ) 6.000 6.000 0.000 peak 9961 weight 0.10000E+01 volume 0.24900E+00 ppm1 2.639 ppm2 0.902 ASSI ( (segid " " and resid "115 " and name "HB2 ") )( (segid " " and resid "85 " and name "HG1 ") ) 6.000 6.000 0.000 peak 9962 weight 0.10000E+01 volume 0.29000E+00 ppm1 1.407 ppm2 1.743 ASSI ( (segid " " and resid "101 " and name "HB2 ") OR (segid " " and resid "73 " and name "HB2 ") OR (segid " " and resid "12 " and name "HB2 ") )( (segid " " and resid "79 " and name "HG1 ") OR (segid " " and resid "79 " and name "HB2 ") OR (segid " " and resid "72 " and name "HB1 ") OR (segid " " and resid "69 " and name "HB1 ") OR (segid " " and resid "42 " and name "HB1 ") OR (segid " " and resid "13 " and name "HB2 ") OR (segid " " and resid "13 " and name "HB1 ") OR (segid " " and resid "6 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9963 weight 0.10000E+01 volume 0.21000E+00 ppm1 2.624 ppm2 1.964 ASSI ( (segid " " and resid "82 " and name "HB2 ") )( (segid " " and resid "83 " and name "HA ") OR (segid " " and resid "81 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9964 weight 0.10000E+01 volume 0.17200E+00 ppm1 1.950 ppm2 3.792 ASSI ( (segid " " and resid "115 " and name "HB2 ") )( (segid " " and resid "85 " and name "HA ") ) 6.000 6.000 0.000 peak 9965 weight 0.10000E+01 volume 0.29900E+00 ppm1 1.405 ppm2 3.754 ASSI ( (segid " " and resid "73 " and name "HB1 ") )( (segid " " and resid "45 " and name "HE2 ") OR (segid " " and resid "45 " and name "HE1 ") ) 5.000 5.000 0.000 peak 9966 weight 0.10000E+01 volume 0.35400E+00 ppm1 3.525 ppm2 2.949 ASSI ( (segid " " and resid "82 " and name "HB2 ") )( (segid " " and resid "79 " and name "HA ") ) 6.000 6.000 0.000 peak 9967 weight 0.10000E+01 volume 0.16400E+00 ppm1 1.945 ppm2 4.741 ASSI ( (segid " " and resid "95 " and name "HB1 ") OR (segid " " and resid "82 " and name "HB1 ") )( (segid " " and resid "98 " and name "HB1 ") OR (segid " " and resid "96 " and name "HA ") OR (segid " " and resid "83 " and name "HA ") OR (segid " " and resid "81 " and name "HB1 ") OR (segid " " and resid "59 " and name "HA ") ) 6.000 6.000 0.000 peak 9968 weight 0.10000E+01 volume 0.27200E+00 ppm1 2.280 ppm2 3.758 ASSI ( (segid " " and resid "82 " and name "HB1 ") )( (segid " " and resid "79 " and name "HA ") ) 6.000 6.000 0.000 peak 9969 weight 0.10000E+01 volume 0.16100E+00 ppm1 2.303 ppm2 4.732 ASSI ( (segid " " and resid "73 " and name "HB2 ") )( (segid " " and resid "45 " and name "HE2 ") OR (segid " " and resid "45 " and name "HE1 ") ) 5.000 5.000 0.000 peak 9970 weight 0.10000E+01 volume 0.10160E+01 ppm1 2.650 ppm2 2.935 ASSI ( (segid " " and resid "101 " and name "HB2 ") )( (segid " " and resid "104 " and name "HB3 ") OR (segid " " and resid "104 " and name "HB2 ") OR (segid " " and resid "104 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9971 weight 0.10000E+01 volume 0.39600E+00 ppm1 2.657 ppm2 1.324 ASSI ( (segid " " and resid "82 " and name "HB2 ") )( (segid " " and resid "88 " and name "HD2 ") OR (segid " " and resid "53 " and name "HZ ") ) 6.000 6.000 0.000 peak 9972 weight 0.10000E+01 volume 0.11100E+00 ppm1 1.951 ppm2 7.445 ASSI ( (segid " " and resid "95 " and name "HB2 ") )( (segid " " and resid "92 " and name "HG ") OR (segid " " and resid "63 " and name "HG ") OR (segid " " and resid "60 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9973 weight 0.10000E+01 volume 0.17600E+00 ppm1 1.143 ppm2 1.625 ASSI ( (segid " " and resid "95 " and name "HB1 ") )( (segid " " and resid "63 " and name "HD13") OR (segid " " and resid "63 " and name "HD12") OR (segid " " and resid "63 " and name "HD11") ) 5.000 5.000 0.000 peak 9974 weight 0.10000E+01 volume 0.41100E+00 ppm1 2.268 ppm2 0.670 ASSI ( (segid " " and resid "91 " and name "HB ") )( (segid " " and resid "83 " and name "HB3 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "83 " and name "HB1 ") OR (segid " " and resid "59 " and name "HB3 ") OR (segid " " and resid "59 " and name "HB2 ") OR (segid " " and resid "59 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9975 weight 0.10000E+01 volume -0.57600E+00 ppm1 4.208 ppm2 1.326 ASSI ( (segid " " and resid "91 " and name "HB ") )( (segid " " and resid "53 " and name "HA ") ) 6.000 6.000 0.000 peak 9976 weight 0.10000E+01 volume -0.23600E+00 ppm1 4.208 ppm2 3.888 ASSI ( (segid " " and resid "91 " and name "HB ") )( (segid " " and resid "94 " and name "HG23") OR (segid " " and resid "94 " and name "HG22") OR (segid " " and resid "94 " and name "HG21") OR (segid " " and resid "92 " and name "HD23") OR (segid " " and resid "92 " and name "HD22") OR (segid " " and resid "92 " and name "HD21") OR (segid " " and resid "58 " and name "HG22") OR (segid " " and resid "58 " and name "HG13") OR (segid " " and resid "58 " and name "HG12") ) 6.000 6.000 0.000 peak 9977 weight 0.10000E+01 volume -0.23600E+00 ppm1 4.208 ppm2 0.998 ASSI ( (segid " " and resid "91 " and name "HB ") )( (segid " " and resid "53 " and name "HB2 ") ) 6.000 6.000 0.000 peak 9978 weight 0.10000E+01 volume -0.10300E+00 ppm1 4.209 ppm2 2.753 ASSI ( (segid " " and resid "101 " and name "HB1 ") )( (segid " " and resid "104 " and name "HB3 ") OR (segid " " and resid "104 " and name "HB2 ") OR (segid " " and resid "104 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9979 weight 0.10000E+01 volume 0.38300E+00 ppm1 2.774 ppm2 1.326 ASSI ( (segid " " and resid "26 " and name "HA ") )( (segid " " and resid "29 " and name "HB2 ") ) 5.000 5.000 0.000 peak 9980 weight 0.10000E+01 volume -0.51200E+00 ppm1 3.381 ppm2 1.139 ASSI ( (segid " " and resid "125 " and name "HA ") OR (segid " " and resid "26 " and name "HA ") )( (segid " " and resid "120 " and name "HA1 ") OR (segid " " and resid "37 " and name "HA ") OR (segid " " and resid "24 " and name "HA ") OR (segid " " and resid "14 " and name "HA ") ) 6.000 6.000 0.000 peak 9981 weight 0.10000E+01 volume -0.15500E+00 ppm1 3.400 ppm2 4.058 ASSI ( (segid " " and resid "125 " and name "HA ") OR (segid " " and resid "26 " and name "HA ") )( (segid " " and resid "113 " and name "HG12") OR (segid " " and resid "18 " and name "HB3 ") ) 5.000 5.000 0.000 peak 9982 weight 0.10000E+01 volume -0.48700E+00 ppm1 3.364 ppm2 1.352 ASSI ( (segid " " and resid "147 " and name "HB2 ") )( (segid " " and resid "114 " and name "HD2 ") ) 6.000 6.000 0.000 peak 9983 weight 0.10000E+01 volume 0.93000E-01 ppm1 1.567 ppm2 6.960 ASSI ( (segid " " and resid "147 " and name "HB1 ") )( (segid " " and resid "114 " and name "HD2 ") ) 6.000 6.000 0.000 peak 9984 weight 0.10000E+01 volume 0.60000E-01 ppm1 2.129 ppm2 6.935 ASSI ( (segid " " and resid "147 " and name "HB2 ") )( (segid " " and resid "144 " and name "HA ") OR (segid " " and resid "114 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9985 weight 0.10000E+01 volume 0.29600E+00 ppm1 1.556 ppm2 3.683 ASSI ( (segid " " and resid "147 " and name "HB1 ") )( (segid " " and resid "147 " and name "HD13") OR (segid " " and resid "147 " and name "HD12") OR (segid " " and resid "147 " and name "HD11") ) 5.000 5.000 0.000 peak 9986 weight 0.10000E+01 volume 0.18350E+01 ppm1 2.143 ppm2 1.191 ASSI ( (segid " " and resid "147 " and name "HB1 ") )( (segid " " and resid "144 " and name "HA ") ) 5.000 5.000 0.000 peak 9987 weight 0.10000E+01 volume 0.50200E+00 ppm1 2.147 ppm2 3.694 ASSI ( (segid " " and resid "93 " and name "HE1 ") )( (segid " " and resid "89 " and name "HG ") ) 5.000 5.000 0.000 peak 9988 weight 0.10000E+01 volume 0.39500E+00 ppm1 2.745 ppm2 1.313 ASSI ( (segid " " and resid "93 " and name "HE1 ") )( (segid " " and resid "127 " and name "HE2 ") OR (segid " " and resid "127 " and name "HE1 ") OR (segid " " and resid "127 " and name "HD2 ") OR (segid " " and resid "127 " and name "HD1 ") ) 6.000 6.000 0.000 peak 9989 weight 0.10000E+01 volume 0.18100E+00 ppm1 2.742 ppm2 7.176 ASSI ( (segid " " and resid "143 " and name "HB ") )( (segid " " and resid "145 " and name "HA ") OR (segid " " and resid "134 " and name "HA ") ) 6.000 6.000 0.000 peak 9990 weight 0.10000E+01 volume -0.25600E+00 ppm1 4.678 ppm2 3.911 ASSI ( (segid " " and resid "93 " and name "HE1 ") )( (segid " " and resid "124 " and name "HG23") OR (segid " " and resid "124 " and name "HG22") OR (segid " " and resid "124 " and name "HG21") OR (segid " " and resid "124 " and name "HG13") OR (segid " " and resid "124 " and name "HG12") OR (segid " " and resid "94 " and name "HG23") OR (segid " " and resid "94 " and name "HG21") OR (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") OR (segid " " and resid "92 " and name "HD11") ) 6.000 6.000 0.000 peak 9991 weight 0.10000E+01 volume 0.13900E+00 ppm1 2.740 ppm2 0.950 ASSI ( (segid " " and resid "93 " and name "HE2 ") )( (segid " " and resid "124 " and name "HG23") OR (segid " " and resid "124 " and name "HG22") OR (segid " " and resid "124 " and name "HG21") OR (segid " " and resid "124 " and name "HG13") OR (segid " " and resid "124 " and name "HG11") OR (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") OR (segid " " and resid "92 " and name "HD11") ) 6.000 6.000 0.000 peak 9992 weight 0.10000E+01 volume 0.18700E+00 ppm1 2.599 ppm2 0.955 ASSI ( (segid " " and resid "93 " and name "HE2 ") )( (segid " " and resid "131 " and name "HB1 ") OR (segid " " and resid "97 " and name "HB1 ") OR (segid " " and resid "96 " and name "HB ") OR (segid " " and resid "94 " and name "HB ") ) 6.000 6.000 0.000 peak 9993 weight 0.10000E+01 volume 0.85000E-01 ppm1 2.584 ppm2 2.297 ASSI ( (segid " " and resid "93 " and name "HE2 ") )( (segid " " and resid "89 " and name "HG ") ) 5.000 5.000 0.000 peak 9994 weight 0.10000E+01 volume 0.54700E+00 ppm1 2.589 ppm2 1.302 ASSI ( (segid " " and resid "64 " and name "HE2 ") OR (segid " " and resid "64 " and name "HE1 ") )( (segid " " and resid "60 " and name "HD23") OR (segid " " and resid "60 " and name "HD22") OR (segid " " and resid "60 " and name "HD21") OR (segid " " and resid "60 " and name "HD12") OR (segid " " and resid "60 " and name "HD11") ) 5.000 5.000 0.000 peak 9995 weight 0.10000E+01 volume 0.12860E+01 ppm1 2.987 ppm2 0.958 ASSI ( (segid " " and resid "64 " and name "HE2 ") OR (segid " " and resid "64 " and name "HE1 ") )( (segid " " and resid "60 " and name "HG ") OR (segid " " and resid "27 " and name "HG2 ") ) 5.000 5.000 0.000 peak 9996 weight 0.10000E+01 volume 0.71600E+00 ppm1 2.983 ppm2 1.516 ASSI ( (segid " " and resid "143 " and name "HB ") )( (segid " " and resid "144 " and name "HG1 ") OR (segid " " and resid "137 " and name "HG1 ") OR (segid " " and resid "134 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9997 weight 0.10000E+01 volume -0.35700E+00 ppm1 4.686 ppm2 1.699 ASSI ( (segid " " and resid "143 " and name "HB ") )( (segid " " and resid "144 " and name "HD2 ") ) 5.000 5.000 0.000 peak 9998 weight 0.10000E+01 volume -0.69400E+00 ppm1 4.696 ppm2 3.719 ASSI ( (segid " " and resid "143 " and name "HB ") )( (segid " " and resid "144 " and name "HD1 ") ) 5.000 5.000 0.000 peak 9999 weight 0.10000E+01 volume -0.65100E+00 ppm1 4.689 ppm2 4.304 ASSI ( (segid " " and resid "93 " and name "HE1 ") )( (segid " " and resid "89 " and name "HD13") OR (segid " " and resid "89 " and name "HD12") OR (segid " " and resid "89 " and name "HD11") ) 6.000 6.000 0.000 peak 10000 weight 0.10000E+01 volume 0.19800E+00 ppm1 2.739 ppm2 0.828 ASSI ( (segid " " and resid "93 " and name "HE2 ") )( (segid " " and resid "89 " and name "HD13") OR (segid " " and resid "89 " and name "HD12") OR (segid " " and resid "89 " and name "HD11") ) 5.000 5.000 0.000 peak 10001 weight 0.10000E+01 volume 0.66400E+00 ppm1 2.585 ppm2 0.823 ASSI ( (segid " " and resid "147 " and name "HB2 ") )( (segid " " and resid "142 " and name "HD23") OR (segid " " and resid "142 " and name "HD22") OR (segid " " and resid "117 " and name "HG22") OR (segid " " and resid "117 " and name "HG21") ) 5.000 5.000 0.000 peak 10002 weight 0.10000E+01 volume 0.64900E+00 ppm1 1.541 ppm2 0.765 ASSI ( (segid " " and resid "145 " and name "HB1 ") )( (segid " " and resid "161 " and name "HB2 ") OR (segid " " and resid "157 " and name "HE3 ") OR (segid " " and resid "157 " and name "HE2 ") OR (segid " " and resid "157 " and name "HE1 ") ) 5.000 5.000 0.000 peak 10004 weight 0.10000E+01 volume 0.49900E+00 ppm1 1.746 ppm2 2.087 ASSI ( (segid " " and resid "147 " and name "HB1 ") OR (segid " " and resid "92 " and name "HB1 ") )( (segid " " and resid "144 " and name "HA ") OR (segid " " and resid "89 " and name "HA ") ) 5.000 5.000 0.000 peak 10005 weight 0.10000E+01 volume 0.74600E+00 ppm1 2.098 ppm2 3.731 ASSI ( (segid " " and resid "92 " and name "HB2 ") )( (segid " " and resid "89 " and name "HD22") OR (segid " " and resid "89 " and name "HD21") ) 5.000 5.000 0.000 peak 10006 weight 0.10000E+01 volume 0.82200E+00 ppm1 1.391 ppm2 0.622 ASSI ( (segid " " and resid "14 " and name "HB2 ") )( (segid " " and resid "29 " and name "HD23") OR (segid " " and resid "29 " and name "HD21") OR (segid " " and resid "29 " and name "HD13") OR (segid " " and resid "29 " and name "HD11") ) 5.000 5.000 0.000 peak 10007 weight 0.10000E+01 volume 0.93000E+00 ppm1 1.412 ppm2 0.769 ASSI ( (segid " " and resid "92 " and name "HB1 ") )( (segid " " and resid "89 " and name "HA ") ) 5.000 5.000 0.000 peak 10008 weight 0.10000E+01 volume 0.66400E+00 ppm1 2.079 ppm2 3.728 ASSI ( (segid " " and resid "92 " and name "HB2 ") )( (segid " " and resid "89 " and name "HA ") ) 5.000 5.000 0.000 peak 10009 weight 0.10000E+01 volume 0.55600E+00 ppm1 1.384 ppm2 3.725 ASSI ( (segid " " and resid "89 " and name "HB2 ") )( (segid " " and resid "124 " and name "HG23") OR (segid " " and resid "124 " and name "HG22") OR (segid " " and resid "124 " and name "HG21") ) 5.000 5.000 0.000 peak 10010 weight 0.10000E+01 volume 0.46600E+00 ppm1 1.229 ppm2 0.946 ASSI ( (segid " " and resid "129 " and name "HB3 ") OR (segid " " and resid "129 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB1 ") )( (segid " " and resid "164 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10011 weight 0.10000E+01 volume -0.53000E-01 ppm1 1.132 ppm2 2.287 ASSI ( (segid " " and resid "89 " and name "HB2 ") )( (segid " " and resid "92 " and name "HB1 ") OR (segid " " and resid "56 " and name "HG2 ") ) 6.000 6.000 0.000 peak 10012 weight 0.10000E+01 volume 0.29400E+00 ppm1 1.221 ppm2 2.091 ASSI ( (segid " " and resid "129 " and name "HB3 ") OR (segid " " and resid "129 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB1 ") )( (segid " " and resid "163 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10013 weight 0.10000E+01 volume -0.23600E+00 ppm1 1.129 ppm2 3.255 ASSI ( (segid " " and resid "129 " and name "HB3 ") OR (segid " " and resid "129 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB1 ") OR (segid " " and resid "29 " and name "HB2 ") )( (segid " " and resid "160 " and name "HA ") OR (segid " " and resid "29 " and name "HA ") ) 5.000 5.000 0.000 peak 10014 weight 0.10000E+01 volume -0.62400E+00 ppm1 1.132 ppm2 3.876 ASSI ( (segid " " and resid "111 " and name "HB2 ") )( (segid " " and resid "144 " and name "HD2 ") OR (segid " " and resid "114 " and name "HB1 ") OR (segid " " and resid "110 " and name "HB2 ") ) 6.000 6.000 0.000 peak 10015 weight 0.10000E+01 volume 0.27400E+00 ppm1 1.968 ppm2 3.726 ASSI ( (segid " " and resid "129 " and name "HB3 ") OR (segid " " and resid "129 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB1 ") OR (segid " " and resid "29 " and name "HB2 ") )( (segid " " and resid "159 " and name "HG21") OR (segid " " and resid "134 " and name "HD13") OR (segid " " and resid "134 " and name "HD12") OR (segid " " and resid "134 " and name "HD11") OR (segid " " and resid "35 " and name "HG23") OR (segid " " and resid "35 " and name "HG21") OR (segid " " and resid "14 " and name "HD23") OR (segid " " and resid "14 " and name "HD22") OR (segid " " and resid "14 " and name "HD21") ) 3.300 3.300 0.000 peak 10016 weight 0.10000E+01 volume -0.20380E+01 ppm1 1.139 ppm2 0.899 ASSI ( (segid " " and resid "129 " and name "HB3 ") OR (segid " " and resid "129 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB1 ") )( (segid " " and resid "160 " and name "HG ") ) 6.000 6.000 0.000 peak 10017 weight 0.10000E+01 volume 0.29900E+00 ppm1 1.124 ppm2 1.755 ASSI ( (segid " " and resid "129 " and name "HB3 ") OR (segid " " and resid "129 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB1 ") )( (segid " " and resid "164 " and name "HB2 ") OR (segid " " and resid "160 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10018 weight 0.10000E+01 volume 0.78000E-01 ppm1 1.129 ppm2 1.917 ASSI ( (segid " " and resid "129 " and name "HB3 ") OR (segid " " and resid "129 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB1 ") )( (segid " " and resid "164 " and name "HG1 ") OR (segid " " and resid "163 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10019 weight 0.10000E+01 volume -0.34500E+00 ppm1 1.127 ppm2 2.720 ASSI ( (segid " " and resid "60 " and name "HB2 ") )( (segid " " and resid "94 " and name "HG13") OR (segid " " and resid "94 " and name "HG12") OR (segid " " and resid "94 " and name "HG11") ) 5.000 5.000 0.000 peak 10020 weight 0.10000E+01 volume 0.80700E+00 ppm1 1.611 ppm2 1.193 ASSI ( (segid " " and resid "60 " and name "HB2 ") )( (segid " " and resid "57 " and name "HA ") ) 5.000 5.000 0.000 peak 10021 weight 0.10000E+01 volume 0.79100E+00 ppm1 1.612 ppm2 4.094 ASSI ( (segid " " and resid "60 " and name "HB1 ") )( (segid " " and resid "57 " and name "HA ") ) 5.000 5.000 0.000 peak 10022 weight 0.10000E+01 volume 0.86100E+00 ppm1 1.800 ppm2 4.100 ASSI ( (segid " " and resid "111 " and name "HB1 ") )( (segid " " and resid "113 " and name "HG23") OR (segid " " and resid "113 " and name "HG21") ) 5.000 5.000 0.000 peak 10023 weight 0.10000E+01 volume 0.44900E+00 ppm1 2.431 ppm2 0.742 ASSI ( (segid " " and resid "111 " and name "HB1 ") )( (segid " " and resid "112 " and name "HD2 ") ) 6.000 6.000 0.000 peak 10024 weight 0.10000E+01 volume 0.12600E+00 ppm1 2.435 ppm2 3.966 ASSI ( (segid " " and resid "111 " and name "HB2 ") OR (segid " " and resid "29 " and name "HB1 ") )( (segid " " and resid "113 " and name "HG23") OR (segid " " and resid "113 " and name "HG22") OR (segid " " and resid "113 " and name "HG21") OR (segid " " and resid "29 " and name "HD23") OR (segid " " and resid "29 " and name "HD22") OR (segid " " and resid "29 " and name "HD21") OR (segid " " and resid "29 " and name "HD13") OR (segid " " and resid "29 " and name "HD11") ) 5.000 5.000 0.000 peak 10025 weight 0.10000E+01 volume 0.19610E+01 ppm1 1.990 ppm2 0.762 ASSI ( (segid " " and resid "111 " and name "HB2 ") OR (segid " " and resid "29 " and name "HB1 ") )( (segid " " and resid "112 " and name "HA ") OR (segid " " and resid "110 " and name "HA ") OR (segid " " and resid "14 " and name "HA ") ) 6.000 6.000 0.000 peak 10026 weight 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name "HD12") OR (segid " " and resid "147 " and name "HD11") ) 5.000 5.000 0.000 peak 10092 weight 0.10000E+01 volume -0.19280E+01 ppm1 0.768 ppm2 1.184 ASSI ( (segid " " and resid "13 " and name "HD2 ") OR (segid " " and resid "13 " and name "HD1 ") )( (segid " " and resid "10 " and name "HG22") OR (segid " " and resid "10 " and name "HG21") OR (segid " " and resid "10 " and name "HG13") OR (segid " " and resid "10 " and name "HG12") OR (segid " " and resid "10 " and name "HG11") ) 5.000 5.000 0.000 peak 10093 weight 0.10000E+01 volume 0.66100E+00 ppm1 3.170 ppm2 1.131 ASSI ( (segid " " and resid "13 " and name "HD2 ") OR (segid " " and resid "13 " and name "HD1 ") )( (segid " " and resid "33 " and name "HG1 ") OR (segid " " and resid "33 " and name "HB2 ") OR (segid " " and resid "10 " and name "HB ") ) 6.000 6.000 0.000 peak 10094 weight 0.10000E+01 volume 0.27900E+00 ppm1 3.176 ppm2 2.280 ASSI ( (segid " " and resid "117 " and name "HG23") OR (segid " " and resid "117 " and name 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weight 0.10000E+01 volume -0.40700E+00 ppm1 0.780 ppm2 2.295 ASSI ( (segid " " and resid "166 " and name "HG23") OR (segid " " and resid "166 " and name "HG22") OR (segid " " and resid "166 " and name "HG21") )( (segid " " and resid "167 " and name "HD2 ") ) 5.000 5.000 0.000 peak 10098 weight 0.10000E+01 volume -0.84000E+00 ppm1 0.997 ppm2 3.734 ASSI ( (segid " " and resid "117 " and name "HG23") OR (segid " " and resid "117 " and name "HG22") OR (segid " " and resid "117 " and name "HG21") )( (segid " " and resid "145 " and name "HA ") OR (segid " " and resid "120 " and name "HA1 ") OR (segid " " and resid "114 " and name "HA ") ) 5.000 5.000 0.000 peak 10099 weight 0.10000E+01 volume -0.88600E+00 ppm1 0.779 ppm2 3.980 ASSI ( (segid " " and resid "13 " and name "HD1 ") )( (segid " " and resid "13 " and name "HA ") ) 5.000 5.000 0.000 peak 10100 weight 0.10000E+01 volume 0.86500E+00 ppm1 3.170 ppm2 4.124 ASSI ( (segid " " and resid "13 " and name "HD2 ") OR (segid " " and resid "13 " and name "HD1 ") )( (segid " " and resid "10 " and name "HA ") ) 5.000 5.000 0.000 peak 10101 weight 0.10000E+01 volume 0.71100E+00 ppm1 3.169 ppm2 3.893 ASSI ( (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "159 " and name "HG21") )( (segid " " and resid "163 " and name "HB2 ") ) 6.000 6.000 0.000 peak 10102 weight 0.10000E+01 volume -0.92000E-01 ppm1 0.897 ppm2 2.724 ASSI ( (segid " " and resid "13 " and name "HD2 ") OR (segid " " and resid "13 " and name "HD1 ") )( (segid " " and resid "29 " and name "HD23") OR (segid " " and resid "29 " and name "HD22") OR (segid " " and resid "29 " and name "HD21") ) 5.000 5.000 0.000 peak 10103 weight 0.10000E+01 volume 0.86500E+00 ppm1 3.169 ppm2 0.769 ASSI ( (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "159 " and name "HG21") OR (segid " " and resid "117 " and name "HD13") OR (segid " " and resid "117 " and name "HD12") OR (segid " " and resid "117 " and name "HD11") )( (segid " " and resid "151 " and name "HD1 ") OR (segid " " and resid "125 " and name "HA ") ) 5.000 5.000 0.000 peak 10104 weight 0.10000E+01 volume -0.32800E+00 ppm1 0.899 ppm2 3.337 ASSI ( (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "159 " and name "HG21") OR (segid " " and resid "117 " and name "HD12") )( (segid " " and resid "156 " and name "HA ") ) 5.000 5.000 0.000 peak 10105 weight 0.10000E+01 volume -0.60600E+00 ppm1 0.904 ppm2 4.155 ASSI ( (segid " " and resid "153 " and name "HB3 ") OR (segid " " and resid "153 " and name "HB2 ") OR (segid " " and resid "153 " and name "HB1 ") )( (segid " " and resid "156 " and name "HG ") OR (segid " " and resid "151 " and name "HG1 ") ) 3.300 3.300 0.000 peak 10106 weight 0.10000E+01 volume -0.22450E+01 ppm1 1.364 ppm2 1.880 ASSI ( (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "159 " and name "HG21") OR (segid " " and resid "117 " and name "HD13") OR (segid " " and resid "117 " and name "HD12") OR (segid " " and resid "117 " and name "HD11") )( (segid " " and resid "158 " and name "HA ") OR (segid " " and resid "151 " and name "HA ") OR (segid " " and resid "144 " and name "HD1 ") OR (segid " " and resid "127 " and name "HA ") OR (segid " " and resid "123 " and name "HA ") ) 5.000 5.000 0.000 peak 10107 weight 0.10000E+01 volume -0.32500E+00 ppm1 0.899 ppm2 4.299 ASSI ( (segid " " and resid "165 " and name "HE3 ") OR (segid " " and resid "165 " and name "HE2 ") OR (segid " " and resid "165 " and name "HE1 ") OR (segid " " and resid "52 " and name "HE3 ") OR (segid " " and resid "52 " and name "HE2 ") OR (segid " " and resid "52 " and name "HE1 ") )( (segid " " and resid "162 " and name "HA1 ") OR (segid " " and resid "126 " and name "HA ") OR (segid " " and resid "55 " and name "HB1 ") ) 5.000 5.000 0.000 peak 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name "HB1 ") )( (segid " " and resid "95 " and name "HB1 ") OR (segid " " and resid "94 " and name "HB ") ) 5.000 5.000 0.000 peak 10113 weight 0.10000E+01 volume -0.12630E+01 ppm1 1.326 ppm2 2.287 ASSI ( (segid " " and resid "83 " and name "HB3 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "83 " and name "HB1 ") OR (segid " " and resid "59 " and name "HB3 ") OR (segid " " and resid "59 " and name "HB2 ") OR (segid " " and resid "59 " and name "HB1 ") )( (segid " " and resid "88 " and name "HB1 ") OR (segid " " and resid "58 " and name "HA ") OR (segid " " and resid "51 " and name "HA ") ) 5.000 5.000 0.000 peak 10114 weight 0.10000E+01 volume -0.46700E+00 ppm1 1.321 ppm2 3.424 ASSI ( (segid " " and resid "148 " and name "HB3 ") OR (segid " " and resid "148 " and name "HB2 ") OR (segid " " and resid "148 " and name "HB1 ") )( (segid " " and resid "120 " and name "HA2 ") OR (segid " " and resid "117 " and name "HA ") ) 5.000 5.000 0.000 peak 10115 weight 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and resid "52 " and name "HA ") OR (segid " " and resid "21 " and name "HA1 ") OR (segid " " and resid "19 " and name "HA ") ) 5.000 5.000 0.000 peak 10133 weight 0.10000E+01 volume -0.77100E+00 ppm1 1.326 ppm2 4.288 ASSI ( (segid " " and resid "66 " and name "HA1 ") )( (segid " " and resid "37 " and name "HG2 ") ) 6.000 6.000 0.000 peak 10134 weight 0.10000E+01 volume 0.10700E+00 ppm1 4.395 ppm2 1.386 ASSI ( (segid " " and resid "54 " and name "HA2 ") )( (segid " " and resid "88 " and name "HD2 ") OR (segid " " and resid "88 " and name "HD1 ") ) 6.000 6.000 0.000 peak 10136 weight 0.10000E+01 volume 0.29300E+00 ppm1 3.154 ppm2 7.434 ASSI ( (segid " " and resid "141 " and name "HA1 ") )( (segid " " and resid "143 " and name "HG21") OR (segid " " and resid "137 " and name "HB2 ") ) 6.000 6.000 0.000 peak 10137 weight 0.10000E+01 volume 0.26900E+00 ppm1 4.314 ppm2 1.251 ASSI ( (segid " " and resid "47 " and name "HB3 ") OR (segid " " and resid "47 " and name "HB2 ") OR (segid " " and resid "47 " and name "HB1 ") )( (segid " " and resid "49 " and name "HB2 ") OR (segid " " and resid "14 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10138 weight 0.10000E+01 volume -0.69800E+00 ppm1 1.273 ppm2 2.100 ASSI ( (segid " " and resid "39 " and name "HB3 ") OR (segid " " and resid "39 " and name "HB1 ") )( (segid " " and resid "10 " and name "HB ") ) 5.000 5.000 0.000 peak 10139 weight 0.10000E+01 volume -0.69500E+00 ppm1 1.386 ppm2 2.283 ASSI ( (segid " " and resid "39 " and name "HB3 ") OR (segid " " and resid "39 " and name "HB2 ") OR (segid " " and resid "39 " and name "HB1 ") )( (segid " " and resid "46 " and name "HA ") OR (segid " " and resid "9 " and name "HA ") ) 6.000 6.000 0.000 peak 10142 weight 0.10000E+01 volume -0.16700E+00 ppm1 1.390 ppm2 4.758 ASSI ( (segid " " and resid "141 " and name "HA2 ") )( (segid " " and resid "142 " and name "HG ") OR (segid " " and resid "137 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10143 weight 0.10000E+01 volume 0.20600E+00 ppm1 3.697 ppm2 1.540 ASSI ( (segid " " and resid "47 " and name "HB3 ") OR (segid " " and resid "47 " and name "HB2 ") OR (segid " " and resid "47 " and name "HB1 ") )( (segid " " and resid "62 " and name "HG ") OR (segid " " and resid "37 " and name "HG1 ") OR (segid " " and resid "37 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10144 weight 0.10000E+01 volume -0.96000E+00 ppm1 1.263 ppm2 1.695 ASSI ( (segid " " and resid "141 " and name "HA1 ") )( (segid " " and resid "137 " and name "HD2 ") OR (segid " " and resid "137 " and name "HD1 ") ) 6.000 6.000 0.000 peak 10145 weight 0.10000E+01 volume 0.23600E+00 ppm1 4.318 ppm2 3.163 ASSI ( (segid " " and resid "141 " and name "HA2 ") )( (segid " " and resid "143 " and name "HG23") OR (segid " " and resid "143 " and name "HG22") OR (segid " " and resid "137 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10146 weight 0.10000E+01 volume 0.36400E+00 ppm1 3.707 ppm2 1.269 ASSI ( (segid " " and resid "71 " and name "HG13") OR (segid " " and resid "71 " and name "HG12") OR (segid " " and resid "71 " and name "HG11") )( (segid " " and resid "48 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10147 weight 0.10000E+01 volume -0.53500E+00 ppm1 0.846 ppm2 1.564 ASSI ( (segid " " and resid "71 " and name "HG13") OR (segid " " and resid "71 " and name "HG12") OR (segid " " and resid "71 " and name "HG11") )( (segid " " and resid "46 " and name "HG23") OR (segid " " and resid "46 " and name "HG22") OR (segid " " and resid "46 " and name "HG21") ) 5.000 5.000 0.000 peak 10148 weight 0.10000E+01 volume -0.10370E+01 ppm1 0.846 ppm2 1.193 ASSI ( (segid " " and resid "71 " and name "HG13") OR (segid " " and resid "71 " and name "HG12") OR (segid " " and resid "71 " and name "HG11") )( (segid " " and resid "79 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10149 weight 0.10000E+01 volume -0.21200E+00 ppm1 0.844 ppm2 2.458 ASSI ( (segid " " and resid "71 " and name "HG13") OR (segid " " and resid "71 " and name "HG12") OR (segid " " and resid "71 " and name "HG11") )( (segid " " and resid "68 " and name "HB2 ") OR (segid " " and resid "68 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10151 weight 0.10000E+01 volume -0.99700E+00 ppm1 0.841 ppm2 3.955 ASSI ( (segid " " and resid "74 " and name "HB3 ") OR (segid " " and resid "74 " and name "HB2 ") OR (segid " " and resid "74 " and name "HB1 ") OR (segid " " and resid "19 " and name "HB3 ") OR (segid " " and resid "19 " and name "HB2 ") OR (segid " " and resid "19 " and name "HB1 ") )( (segid " " and resid "75 " and name "HA ") OR (segid " " and resid "50 " and name "HA ") ) 6.000 6.000 0.000 peak 10152 weight 0.10000E+01 volume -0.24800E+00 ppm1 1.543 ppm2 4.659 ASSI ( (segid " " and resid "19 " and name "HB3 ") OR (segid " " and resid "19 " and name "HB2 ") OR (segid " " and resid "19 " and name "HB1 ") )( (segid " " and resid "62 " and name "HD13") OR (segid " " and resid "62 " and name "HD12") OR (segid " " and resid "62 " and name "HD11") OR (segid " " and resid "40 " and name "HD22") OR (segid " " and resid "40 " and name "HD21") ) 5.000 5.000 0.000 peak 10153 weight 0.10000E+01 volume -0.45200E+00 ppm1 1.540 ppm2 0.712 ASSI ( (segid " " and resid "105 " and name "HB2 ") OR (segid " " and resid "47 " and name "HB3 ") OR (segid " " and resid "47 " and name "HB2 ") OR (segid " " and resid "47 " and name "HB1 ") )( (segid " " and resid "105 " and name "HG ") OR (segid " " and resid "62 " and name "HG ") OR (segid " " and resid "37 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10155 weight 0.10000E+01 volume -0.66400E+00 ppm1 1.273 ppm2 1.700 ASSI ( (segid " " and resid "19 " and name "HB3 ") OR (segid " " and resid "19 " and name "HB2 ") OR (segid " " and resid "19 " and name "HB1 ") )( (segid " " and resid "52 " and name "HB2 ") OR (segid " " and resid "20 " and name "HG1 ") ) 5.000 5.000 0.000 peak 10156 weight 0.10000E+01 volume -0.81000E+00 ppm1 1.540 ppm2 1.886 ASSI ( (segid " " and resid "19 " and name "HB3 ") OR (segid " " and resid "19 " and name "HB2 ") OR (segid " " and resid "19 " and name "HB1 ") )( (segid " " and resid "20 " and name "HG1 ") OR (segid " " and resid "20 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10157 weight 0.10000E+01 volume -0.87300E+00 ppm1 1.540 ppm2 1.967 ASSI ( (segid " " and resid "19 " and name "HB3 ") OR (segid " " and resid "19 " and name "HB2 ") OR (segid " " and resid "19 " and name "HB1 ") )( (segid " " and resid "52 " and name "HE2 ") OR (segid " " and resid "52 " and name "HE1 ") OR (segid " " and resid "52 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10158 weight 0.10000E+01 volume -0.42700E+00 ppm1 1.540 ppm2 2.100 ASSI ( (segid " " and resid "19 " and name "HB3 ") OR (segid " " and resid "19 " and name "HB2 ") OR (segid " " and resid "19 " and name "HB1 ") )( (segid " " and resid "50 " and name "HB ") ) 5.000 5.000 0.000 peak 10159 weight 0.10000E+01 volume -0.46800E+00 ppm1 1.555 ppm2 2.517 ASSI ( (segid " " and resid "19 " and name "HB3 ") OR (segid " " and resid "19 " and name "HB2 ") OR (segid " " and resid "19 " and name "HB1 ") )( (segid " " and resid "20 " and name "HA ") ) 5.000 5.000 0.000 peak 10160 weight 0.10000E+01 volume -0.33900E+00 ppm1 1.540 ppm2 4.502 ASSI ( (segid " " and resid "71 " and name "HG13") OR (segid " " and resid "71 " and name "HG12") OR (segid " " and resid "71 " and name "HG11") )( (segid " " and resid "79 " and name "HA ") OR (segid " " and resid "68 " and name "HA ") OR (segid " " and resid "46 " and name "HA ") ) 6.000 6.000 0.000 peak 10161 weight 0.10000E+01 volume -0.17700E+00 ppm1 0.845 ppm2 4.751 ASSI ( (segid " " and resid "141 " and name "HA2 ") )( (segid " " and resid "137 " and name "HG1 ") ) 6.000 6.000 0.000 peak 10162 weight 0.10000E+01 volume 0.16300E+00 ppm1 3.692 ppm2 1.695 ASSI ( (segid " " and resid "51 " and name "HE3 ") OR (segid " " and resid "51 " and name "HE2 ") OR (segid " " and resid "51 " and name "HE1 ") )( (segid " " and resid "53 " and name "HZ ") ) 6.000 6.000 0.000 peak 10163 weight 0.10000E+01 volume -0.19000E+00 ppm1 1.691 ppm2 7.443 ASSI ( (segid " " and resid "51 " and name "HE3 ") OR (segid " " and resid "51 " and name "HE2 ") OR (segid " " and resid "51 " and name "HE1 ") )( (segid " " and resid "53 " and name "HE2 ") OR (segid " " and resid "53 " and name "HE1 ") ) 5.000 5.000 0.000 peak 10164 weight 0.10000E+01 volume -0.45200E+00 ppm1 1.687 ppm2 7.310 ASSI ( (segid " " and resid "50 " and name "HG23") OR (segid " " and resid "50 " and name "HG22") OR (segid " " and resid "50 " and name "HG21") )( (segid " " and resid "62 " and name "HG ") OR (segid " " and resid "51 " and name "HE3 ") OR (segid " " and resid "51 " and name "HE2 ") OR (segid " " and resid "51 " and name "HE1 ") OR (segid " " and resid "48 " and name "HG ") OR (segid " " and resid "42 " and name "HB2 ") OR (segid " " and resid "37 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10165 weight 0.10000E+01 volume -0.44600E+00 ppm1 0.926 ppm2 1.700 ASSI ( (segid " " and resid "76 " and name "HA1 ") )( (segid " " and resid "106 " and name "HA ") ) 6.000 6.000 0.000 peak 10166 weight 0.10000E+01 volume 0.23300E+00 ppm1 4.232 ppm2 4.912 ASSI ( (segid " " and resid "76 " and name "HA2 ") )( (segid " " and resid "72 " and name "HB2 ") ) 6.000 6.000 0.000 peak 10167 weight 0.10000E+01 volume 0.23600E+00 ppm1 3.784 ppm2 1.823 ASSI ( (segid " " and resid "76 " and name "HA1 ") )( (segid " " and resid "72 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10168 weight 0.10000E+01 volume 0.18700E+00 ppm1 4.224 ppm2 1.977 ASSI ( (segid " " and resid "76 " and name "HA1 ") )( (segid " " and resid "72 " and name "HB2 ") ) 6.000 6.000 0.000 peak 10169 weight 0.10000E+01 volume 0.14900E+00 ppm1 4.235 ppm2 1.844 ASSI ( (segid " " and resid "76 " and name "HA2 ") )( (segid " " and resid "106 " and name "HA ") ) 6.000 6.000 0.000 peak 10170 weight 0.10000E+01 volume 0.18400E+00 ppm1 3.789 ppm2 4.905 ASSI ( (segid " " and resid "76 " and name "HA2 ") )( (segid " " and resid "72 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10171 weight 0.10000E+01 volume 0.30300E+00 ppm1 3.782 ppm2 1.967 ASSI ( (segid " " and resid "57 " and name "HB3 ") OR (segid " " and resid "57 " and name "HB2 ") OR (segid " " and resid "57 " and name "HB1 ") )( (segid " " and resid "61 " and name "HG2 ") OR (segid " " and resid "56 " and name "HG2 ") OR (segid " " and resid "56 " and name "HG1 ") OR (segid " " and resid "56 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10173 weight 0.10000E+01 volume -0.10610E+01 ppm1 1.445 ppm2 2.051 ASSI ( (segid " " and resid "105 " and name "HB1 ") )( (segid " " and resid "109 " and name "HA2 ") ) 6.000 6.000 0.000 peak 10174 weight 0.10000E+01 volume 0.92000E-01 ppm1 1.822 ppm2 3.806 ASSI ( (segid " " and resid "57 " and name "HB3 ") OR (segid " " and resid "57 " and name "HB2 ") OR (segid " " and resid "57 " and name "HB1 ") )( (segid " " and resid "60 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10175 weight 0.10000E+01 volume -0.67200E+00 ppm1 1.446 ppm2 1.798 ASSI ( (segid " " and resid "50 " and name "HG23") OR (segid " " and resid "50 " and name "HG21") )( (segid " " and resid "45 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10176 weight 0.10000E+01 volume -0.52800E+00 ppm1 0.908 ppm2 1.919 ASSI ( (segid " " and resid "50 " and name "HG23") OR (segid " " and resid "50 " and name "HG22") OR (segid " " and resid "50 " and name "HG21") )( (segid " " and resid "51 " and name "HB2 ") OR (segid " " and resid "45 " and name "HD2 ") ) 5.000 5.000 0.000 peak 10177 weight 0.10000E+01 volume -0.13020E+01 ppm1 0.926 ppm2 1.459 ASSI ( (segid " " and resid "50 " and name "HG23") OR (segid " " and resid "50 " and name "HG22") OR (segid " " and resid "50 " and name "HG21") )( (segid " " and resid "45 " and name "HB2 ") OR (segid " " and resid "19 " and name "HB3 ") OR (segid " " and resid "19 " and name "HB2 ") OR (segid " " and resid "19 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10178 weight 0.10000E+01 volume -0.16870E+01 ppm1 0.925 ppm2 1.552 ASSI ( (segid " " and resid "50 " and name "HG23") OR (segid " " and resid "50 " and name "HG22") OR (segid " " and resid "50 " and name "HG21") )( (segid " " and resid "47 " and name "HA ") OR (segid " " and resid "15 " and name "HB2 ") OR (segid " " and resid "15 " and name "HB1 ") ) 3.300 3.300 0.000 peak 10180 weight 0.10000E+01 volume -0.32460E+01 ppm1 0.926 ppm2 4.021 ASSI ( (segid " " and resid "50 " and name "HG23") OR (segid " " and resid "50 " and name "HG22") OR (segid " " and resid "50 " and name "HG21") )( (segid " " and resid "49 " and name "HA ") OR (segid " " and resid "17 " and name "HA ") ) 5.000 5.000 0.000 peak 10181 weight 0.10000E+01 volume -0.15060E+01 ppm1 0.926 ppm2 4.155 ASSI ( (segid " " and resid "50 " and name "HG23") OR (segid " " and resid "50 " and name "HG22") OR (segid " " and resid "50 " and name "HG21") )( (segid " " and resid "49 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10182 weight 0.10000E+01 volume -0.55300E+00 ppm1 0.919 ppm2 2.089 ASSI ( (segid " " and resid "44 " and name "HA1 ") )( (segid " " and resid "40 " and name "HG ") OR (segid " " and resid "40 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10183 weight 0.10000E+01 volume 0.19900E+00 ppm1 4.200 ppm2 1.802 ASSI ( (segid " " and resid "44 " and name "HA1 ") )( (segid " " and resid "40 " and name "HD23") OR (segid " " and resid "40 " and name "HD22") OR (segid " " and resid "40 " and name "HD21") ) 6.000 6.000 0.000 peak 10184 weight 0.10000E+01 volume 0.18500E+00 ppm1 4.206 ppm2 0.664 ASSI ( (segid " " and resid "44 " and name "HA1 ") )( (segid " " and resid "40 " and name "HB2 ") ) 6.000 6.000 0.000 peak 10185 weight 0.10000E+01 volume 0.22800E+00 ppm1 4.220 ppm2 1.262 ASSI ( (segid " " and resid "44 " and name "HA2 ") )( (segid " " and resid "40 " and name "HD23") OR (segid " " and resid "40 " and name "HD21") ) 6.000 6.000 0.000 peak 10186 weight 0.10000E+01 volume 0.22300E+00 ppm1 3.727 ppm2 0.668 ASSI ( (segid " " and resid "104 " and name "HB3 ") OR (segid " " and resid "104 " and name "HB2 ") OR (segid " " and resid "104 " and name "HB1 ") )( (segid " " and resid "101 " and name "HA ") ) 6.000 6.000 0.000 peak 10187 weight 0.10000E+01 volume -0.88000E-01 ppm1 1.328 ppm2 4.653 ASSI ( (segid " " and resid "84 " and name "HB3 ") OR (segid " " and resid "84 " and name "HB2 ") OR (segid " " and resid "84 " and name "HB1 ") )( (segid " " and resid "81 " and name "HD2 ") ) 6.000 6.000 0.000 peak 10188 weight 0.10000E+01 volume -0.80000E-01 ppm1 1.448 ppm2 6.515 ASSI ( (segid " " and resid "104 " and name "HB3 ") OR (segid " " and resid "104 " and name "HB2 ") OR (segid " " and resid "104 " and name "HB1 ") )( (segid " " and resid "112 " and name "HB2 ") OR (segid " " and resid "80 " and name "HB ") OR (segid " " and resid "69 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10189 weight 0.10000E+01 volume -0.25600E+00 ppm1 1.326 ppm2 1.909 ASSI ( (segid " " and resid "104 " and name "HB3 ") OR (segid " " and resid "104 " and name "HB2 ") OR (segid " " and resid "104 " and name "HB1 ") )( (segid " " and resid "72 " and name "HG2 ") OR (segid " " and resid "72 " and name "HG1 ") ) 6.000 6.000 0.000 peak 10190 weight 0.10000E+01 volume -0.17700E+00 ppm1 1.326 ppm2 2.249 ASSI ( (segid " " and resid "152 " and name "HA1 ") OR (segid " " and resid "120 " and name "HA1 ") )( (segid " " and resid "156 " and name "HD13") OR (segid " " and resid "156 " and name "HD12") OR (segid " " and resid "156 " and name "HD11") OR (segid " " and resid "125 " and name "HG13") ) 5.000 5.000 0.000 peak 10191 weight 0.10000E+01 volume 0.50100E+00 ppm1 4.021 ppm2 0.998 ASSI ( (segid " " and resid "104 " and name "HB3 ") OR (segid " " and resid "104 " and name "HB2 ") OR (segid " " and resid "104 " and name "HB1 ") )( (segid " " and resid "112 " and name "HD1 ") OR (segid " " and resid "78 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10192 weight 0.10000E+01 volume -0.67000E+00 ppm1 1.326 ppm2 4.294 ASSI ( (segid " " and resid "104 " and name "HB3 ") OR (segid " " and resid "104 " and name "HB2 ") OR (segid " " and resid "104 " and name "HB1 ") )( (segid " " and resid "112 " and name "HB1 ") OR (segid " " and resid "111 " and name "HG ") OR (segid " " and resid "111 " and name "HB2 ") OR (segid " " and resid "79 " and name "HG2 ") OR (segid " " and resid "79 " and name "HG1 ") OR (segid " " and resid "79 " and name "HB2 ") OR (segid " " and resid "72 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10193 weight 0.10000E+01 volume -0.30300E+00 ppm1 1.326 ppm2 1.993 ASSI ( (segid " " and resid "152 " and name "HA1 ") OR (segid " " and resid "120 " and name "HA1 ") )( (segid " " and resid "156 " and name "HD23") OR (segid " " and resid "156 " and name "HD22") OR (segid " " and resid "156 " and name "HD21") ) 6.000 6.000 0.000 peak 10194 weight 0.10000E+01 volume 0.17300E+00 ppm1 4.018 ppm2 0.760 ASSI ( (segid " " and resid "44 " and name "HA1 ") )( (segid " " and resid "40 " and name "HD13") OR (segid " " and resid "40 " and name "HD12") ) 5.000 5.000 0.000 peak 10195 weight 0.10000E+01 volume 0.36700E+00 ppm1 4.200 ppm2 0.901 ASSI ( (segid " " and resid "44 " and name "HA2 ") )( (segid " " and resid "40 " and name "HD13") OR (segid " " and resid "40 " and name "HD12") OR (segid " " and resid "40 " and name "HD11") ) 5.000 5.000 0.000 peak 10196 weight 0.10000E+01 volume 0.61600E+00 ppm1 3.732 ppm2 0.902 ASSI ( (segid " " and resid "120 " and name "HA1 ") )( (segid " " and resid "153 " and name "HB3 ") OR (segid " " and resid "153 " and name "HB2 ") OR (segid " " and resid "153 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10197 weight 0.10000E+01 volume 0.13600E+00 ppm1 4.017 ppm2 1.362 ASSI ( (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB1 ") OR (segid " " and resid "84 " and name "HB3 ") )( (segid " " and resid "121 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10198 weight 0.10000E+01 volume -0.49200E+00 ppm1 1.495 ppm2 3.141 ASSI ( (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB1 ") OR (segid " " and resid "84 " and name "HB3 ") OR (segid " " and resid "84 " and name "HB2 ") OR (segid " " and resid "84 " and name "HB1 ") )( (segid " " and resid "128 " and name "HG ") OR (segid " " and resid "119 " and name "HB1 ") OR (segid " " and resid "117 " and name "HG11") OR (segid " " and resid "115 " and name "HG ") OR (segid " " and resid "85 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10199 weight 0.10000E+01 volume -0.18560E+01 ppm1 1.480 ppm2 2.065 ASSI ( (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB1 ") OR (segid " " and resid "84 " and name "HB3 ") OR (segid " " and resid "84 " and name "HB2 ") OR (segid " " and resid "84 " and name "HB1 ") )( (segid " " and resid "124 " and name "HA ") OR (segid " " and resid "85 " and name "HA ") OR (segid " " and resid "81 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10200 weight 0.10000E+01 volume -0.11640E+01 ppm1 1.482 ppm2 3.734 ASSI ( (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB1 ") OR (segid " " and resid "84 " and name "HB1 ") )( (segid " " and resid "113 " and name "HA ") ) 3.300 3.300 0.000 peak 10201 weight 0.10000E+01 volume -0.24590E+01 ppm1 1.494 ppm2 3.837 ASSI ( (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB1 ") )( (segid " " and resid "121 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10203 weight 0.10000E+01 volume -0.61000E+00 ppm1 1.492 ppm2 3.017 ASSI ( (segid " " and resid "44 " and name "HA2 ") )( (segid " " and resid "40 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10204 weight 0.10000E+01 volume 0.42000E+00 ppm1 3.724 ppm2 1.269 ASSI ( (segid " " and resid "104 " and name "HB3 ") OR (segid " " and resid "104 " and name "HB2 ") OR (segid " " and resid "104 " and name "HB1 ") )( (segid " " and resid "105 " and name "HG ") ) 6.000 6.000 0.000 peak 10205 weight 0.10000E+01 volume -0.29600E+00 ppm1 1.326 ppm2 1.654 ASSI ( (segid " " and resid "120 " and name "HA2 ") )( (segid " " and resid "156 " and name "HD23") OR (segid " " and resid "156 " and name "HD22") OR (segid " " and resid "156 " and name "HD21") ) 6.000 6.000 0.000 peak 10206 weight 0.10000E+01 volume 0.18200E+00 ppm1 3.543 ppm2 0.744 ASSI ( (segid " " and resid "104 " and name "HB3 ") OR (segid " " and resid "104 " and name "HB2 ") OR (segid " " and resid "104 " and name "HB1 ") )( (segid " " and resid "105 " and name "HD23") OR (segid " " and resid "105 " and name "HD22") OR (segid " " and resid "105 " and name "HD21") ) 6.000 6.000 0.000 peak 10207 weight 0.10000E+01 volume -0.55000E-01 ppm1 1.326 ppm2 0.392 ASSI ( (segid " " and resid "104 " and name "HB3 ") OR (segid " " and resid "104 " and name "HB2 ") OR (segid " " and resid "104 " and name "HB1 ") )( (segid " " and resid "112 " and name "HG1 ") OR (segid " " and resid "105 " and name "HB1 ") OR (segid " " and resid "72 " and name "HB2 ") ) 6.000 6.000 0.000 peak 10208 weight 0.10000E+01 volume -0.16200E+00 ppm1 1.326 ppm2 1.780 ASSI ( (segid " " and resid "84 " and name "HB3 ") OR (segid " " and resid "84 " and name "HB2 ") OR (segid " " and resid "84 " and name "HB1 ") )( (segid " " and resid "115 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10209 weight 0.10000E+01 volume -0.85500E+00 ppm1 1.450 ppm2 2.191 ASSI ( (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB1 ") )( (segid " " and resid "125 " and name "HB ") ) 5.000 5.000 0.000 peak 10210 weight 0.10000E+01 volume -0.74000E+00 ppm1 1.486 ppm2 2.239 ASSI ( (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB1 ") )( (segid " " and resid "124 " and name "HB ") ) 5.000 5.000 0.000 peak 10211 weight 0.10000E+01 volume -0.10870E+01 ppm1 1.486 ppm2 2.394 ASSI ( (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB1 ") )( (segid " " and resid "125 " and name "HA ") ) 5.000 5.000 0.000 peak 10212 weight 0.10000E+01 volume -0.51300E+00 ppm1 1.506 ppm2 3.369 ASSI ( (segid " " and resid "104 " and name "HB3 ") OR (segid " " and resid "104 " and name "HB2 ") OR (segid " " and resid "104 " and name "HB1 ") )( (segid " " and resid "106 " and name "HA ") OR (segid " " and resid "105 " and name "HA ") ) 6.000 6.000 0.000 peak 10213 weight 0.10000E+01 volume -0.83000E-01 ppm1 1.326 ppm2 4.929 ASSI ( (segid " " and resid "120 " and name "HA2 ") OR (segid " " and resid "11 " and name "HA1 ") )( (segid " " and resid "156 " and name "HD13") OR (segid " " and resid "156 " and name "HD12") OR (segid " " and resid "156 " and name "HD11") OR (segid " " and resid "8 " and name "HG13") OR (segid " " and resid "8 " and name "HG12") OR (segid " " and resid "8 " and name "HG11") ) 5.000 5.000 0.000 peak 10214 weight 0.10000E+01 volume 0.11010E+01 ppm1 3.552 ppm2 0.997 ASSI ( (segid " " and resid "11 " and name "HA2 ") )( (segid " " and resid "8 " and name "HG23") OR (segid " " and resid "8 " and name "HG22") OR (segid " " and resid "8 " and name "HG13") OR (segid " " and resid "8 " and name "HG12") OR (segid " " and resid "8 " and name "HG11") ) 5.000 5.000 0.000 peak 10217 weight 0.10000E+01 volume 0.47200E+00 ppm1 3.804 ppm2 0.968 ASSI ( (segid " " and resid "102 " and name "HG13") OR (segid " " and resid "102 " and name "HG12") OR (segid " " and resid "102 " and name "HG11") )( (segid " " and resid "131 " and name "HG2 ") OR (segid " " and resid "112 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10219 weight 0.10000E+01 volume -0.13420E+01 ppm1 0.863 ppm2 1.956 ASSI ( (segid " " and resid "21 " and name "HA2 ") )( (segid " " and resid "52 " and name "HE3 ") OR (segid " " and resid "52 " and name "HE2 ") OR (segid " " and resid "52 " and name "HE1 ") OR (segid " " and resid "52 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10221 weight 0.10000E+01 volume 0.26800E+00 ppm1 3.569 ppm2 2.096 ASSI ( (segid " " and resid "102 " and name "HG13") OR (segid " " and resid "102 " and name "HG12") OR (segid " " and resid "102 " and name "HG11") )( (segid " " and resid "96 " and name "HG23") OR (segid " " and resid "96 " and name "HG22") OR (segid " " and resid "96 " and name "HG21") OR (segid " " and resid "96 " and name "HG13") OR (segid " " and resid "96 " and name "HG12") OR (segid " " and resid "96 " and name "HG11") ) 3.300 3.300 0.000 peak 10222 weight 0.10000E+01 volume -0.30450E+01 ppm1 0.866 ppm2 1.127 ASSI ( (segid " " and resid "102 " and name "HG13") OR (segid " " and resid "102 " and name "HG12") OR (segid " " and resid "102 " and name "HG11") )( (segid " " and resid "131 " and name "HG1 ") ) 5.000 5.000 0.000 peak 10223 weight 0.10000E+01 volume -0.10000E+01 ppm1 0.868 ppm2 2.069 ASSI ( (segid " " and resid "102 " and name "HG13") OR (segid " " and resid "102 " and name "HG12") OR (segid " " and resid "102 " and name "HG11") )( (segid " " and resid "132 " and name "HB2 ") OR (segid " " and resid "132 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10224 weight 0.10000E+01 volume -0.20600E+00 ppm1 0.861 ppm2 3.535 ASSI ( (segid " " and resid "102 " and name "HG13") OR (segid " " and resid "102 " and name "HG12") OR (segid " " and resid "102 " and name "HG11") )( (segid " " and resid "96 " and name "HA ") ) 5.000 5.000 0.000 peak 10225 weight 0.10000E+01 volume -0.31000E+00 ppm1 0.866 ppm2 3.744 ASSI ( (segid " " and resid "109 " and name "HA2 ") )( (segid " " and resid "105 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10226 weight 0.10000E+01 volume 0.31400E+00 ppm1 3.805 ppm2 1.815 ASSI ( (segid " " and resid "102 " and name "HG13") OR (segid " " and resid "102 " and name "HG12") OR (segid " " and resid "102 " and name "HG11") )( (segid " " and resid "131 " and name "HB1 ") OR (segid " " and resid "96 " and name "HB ") ) 5.000 5.000 0.000 peak 10227 weight 0.10000E+01 volume -0.17560E+01 ppm1 0.867 ppm2 2.309 ASSI ( (segid " " and resid "109 " and name "HA2 ") OR (segid " " and resid "11 " and name "HA2 ") )( (segid " " and resid "138 " and name "HA ") OR (segid " " and resid "41 " and name "HA ") ) 5.000 5.000 0.000 peak 10228 weight 0.10000E+01 volume 0.33700E+00 ppm1 3.798 ppm2 4.577 ASSI ( (segid " " and resid "109 " and name "HA1 ") )( (segid " " and resid "139 " and name "HB3 ") OR (segid " " and resid "139 " and name "HB2 ") OR (segid " " and resid "139 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10229 weight 0.10000E+01 volume 0.23900E+00 ppm1 4.313 ppm2 1.401 ASSI ( (segid " " and resid "109 " and name "HA1 ") )( (segid " " and resid "105 " and name "HB2 ") ) 6.000 6.000 0.000 peak 10230 weight 0.10000E+01 volume 0.26600E+00 ppm1 4.310 ppm2 1.278 ASSI ( (segid " " and resid "109 " and name "HA1 ") )( (segid " " and resid "138 " and name "HA ") OR (segid " " and resid "108 " and name "HA ") ) 6.000 6.000 0.000 peak 10231 weight 0.10000E+01 volume 0.24900E+00 ppm1 4.318 ppm2 4.577 ASSI ( (segid " " and resid "21 " and name "HA2 ") OR (segid " " and resid "11 " and name "HA1 ") )( (segid " " and resid "58 " and name "HG23") OR (segid " " and resid "58 " and name "HG22") OR (segid " " and resid "58 " and name "HG21") OR (segid " " and resid "58 " and name "HG13") OR (segid " " and resid "8 " and name "HG13") OR (segid " " and resid "8 " and name "HG12") OR (segid " " and resid "8 " and name "HG11") ) 5.000 5.000 0.000 peak 10232 weight 0.10000E+01 volume 0.11620E+01 ppm1 3.569 ppm2 0.983 ASSI ( (segid " " and resid "21 " and name "HA1 ") )( (segid " " and resid "58 " and name "HG23") OR (segid " " and resid "58 " and name "HG22") OR (segid " " and resid "58 " and name "HG21") OR (segid " " and resid "58 " and name "HG13") ) 5.000 5.000 0.000 peak 10233 weight 0.10000E+01 volume 0.63100E+00 ppm1 4.288 ppm2 0.982 ASSI ( (segid " " and resid "109 " and name "HA2 ") )( (segid " " and resid "105 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10234 weight 0.10000E+01 volume 0.43700E+00 ppm1 3.800 ppm2 1.277 ASSI ( (segid " " and resid "109 " and name "HA2 ") )( (segid " " and resid "105 " and name "HD13") OR (segid " " and resid "105 " and name "HD12") OR (segid " " and resid "105 " and name "HD11") ) 5.000 5.000 0.000 peak 10235 weight 0.10000E+01 volume 0.39600E+00 ppm1 3.802 ppm2 0.847 ASSI ( (segid " " and resid "109 " and name "HA1 ") )( (segid " " and resid "105 " and name "HD13") OR (segid " " and resid "105 " and name "HD12") OR (segid " " and resid "105 " and name "HD11") ) 6.000 6.000 0.000 peak 10236 weight 0.10000E+01 volume 0.29600E+00 ppm1 4.319 ppm2 0.866 ASSI ( (segid " " and resid "21 " and name "HA1 ") )( (segid " " and resid "52 " and name "HE3 ") OR (segid " " and resid "52 " and name "HE2 ") OR (segid " " and resid "52 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10238 weight 0.10000E+01 volume 0.36200E+00 ppm1 4.294 ppm2 2.092 ASSI ( (segid " " and resid "109 " and name "HA1 ") )( (segid " " and resid "105 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10239 weight 0.10000E+01 volume 0.32000E+00 ppm1 4.309 ppm2 1.837 ASSI ( (segid " " and resid "23 " and name "HG23") OR (segid " " and resid "23 " and name "HG22") OR (segid " " and resid "23 " and name "HG21") )( (segid " " and resid "61 " and name "HG1 ") OR (segid " " and resid "24 " and name "HG2 ") OR (segid " " and resid "24 " and name "HG1 ") OR (segid " " and resid "22 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10240 weight 0.10000E+01 volume -0.12050E+01 ppm1 0.921 ppm2 2.476 ASSI ( (segid " " and resid "23 " and name "HG23") OR (segid " " and resid "23 " and name "HG22") OR (segid " " and resid "23 " and name "HG21") )( (segid " " and resid "22 " and name "HA ") ) 6.000 6.000 0.000 peak 10241 weight 0.10000E+01 volume -0.24900E+00 ppm1 0.909 ppm2 4.701 ASSI ( (segid " " and resid "100 " and name "HB1 ") OR (segid " " and resid "67 " and name "HB3 ") OR (segid " " and resid "67 " and name "HB2 ") )( (segid " " and resid "70 " and name "HA ") OR (segid " " and resid "38 " and name "HA ") ) 6.000 6.000 0.000 peak 10242 weight 0.10000E+01 volume -0.11100E+00 ppm1 1.127 ppm2 5.115 ASSI ( (segid " " and resid "67 " and name "HB3 ") OR (segid " " and resid "67 " and name "HB2 ") OR (segid " " and resid "67 " and name "HB1 ") )( (segid " " and resid "65 " and name "HG1 ") OR (segid " " and resid "38 " and name "HB2 ") OR (segid " " and resid "37 " and name "HD2 ") ) 6.000 6.000 0.000 peak 10244 weight 0.10000E+01 volume -0.21700E+00 ppm1 1.118 ppm2 2.571 ASSI ( (segid " " and resid "23 " and name "HG23") OR (segid " " and resid "23 " and name "HG22") OR (segid " " and resid "23 " and name "HG21") OR (segid " " and resid "8 " and name "HG23") )( (segid " " and resid "42 " and name "HB2 ") OR (segid " " and resid "27 " and name "HG1 ") ) 5.000 5.000 0.000 peak 10245 weight 0.10000E+01 volume 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and resid "125 " and name "HG21") )( (segid " " and resid "116 " and name "HA ") ) 5.000 5.000 0.000 peak 10252 weight 0.10000E+01 volume -0.11050E+01 ppm1 0.873 ppm2 4.155 ASSI ( (segid " " and resid "96 " and name "HG13") OR (segid " " and resid "96 " and name "HG12") OR (segid " " and resid "96 " and name "HG11") )( (segid " " and resid "131 " and name "HG1 ") OR (segid " " and resid "97 " and name "HG2 ") ) 5.000 5.000 0.000 peak 10253 weight 0.10000E+01 volume -0.50900E+00 ppm1 1.113 ppm2 2.073 ASSI ( (segid " " and resid "125 " and name "HG23") OR (segid " " and resid "125 " and name "HG22") OR (segid " " and resid "125 " and name "HG21") )( (segid " " and resid "120 " and name "HA2 ") OR (segid " " and resid "117 " and name "HA ") ) 5.000 5.000 0.000 peak 10254 weight 0.10000E+01 volume -0.66800E+00 ppm1 0.872 ppm2 3.488 ASSI ( (segid " " and resid "96 " and name "HG13") OR (segid " " and resid "96 " and name "HG12") OR (segid " " and resid "96 " and name "HG11") )( (segid " " and resid "128 " and name "HD13") OR (segid " " and resid "128 " and name "HD12") OR (segid " " and resid "128 " and name "HD11") ) 5.000 5.000 0.000 peak 10255 weight 0.10000E+01 volume -0.55000E+00 ppm1 1.121 ppm2 0.677 ASSI ( (segid " " and resid "96 " and name "HG13") OR (segid " " and resid "96 " and name "HG12") OR (segid " " and resid "96 " and name "HG11") )( (segid " " and resid "97 " and name "HA ") ) 5.000 5.000 0.000 peak 10256 weight 0.10000E+01 volume -0.66300E+00 ppm1 1.125 ppm2 4.097 ASSI ( (segid " " and resid "125 " and name "HG23") OR (segid " " and resid "125 " and name "HG22") OR (segid " " and resid "125 " and name "HG21") )( (segid " " and resid "120 " and name "HA1 ") ) 5.000 5.000 0.000 peak 10257 weight 0.10000E+01 volume -0.16660E+01 ppm1 0.871 ppm2 4.015 ASSI ( (segid " " and resid "8 " and name "HG12") OR (segid " " and resid "8 " and name "HG11") )( (segid " " and resid "41 " and name "HA ") ) 6.000 6.000 0.000 peak 10258 weight 0.10000E+01 volume -0.26200E+00 ppm1 0.979 ppm2 4.555 ASSI ( (segid " " and resid "71 " and name "HG23") OR (segid " " and resid "71 " and name "HG22") OR (segid " " and resid "71 " and name "HG21") )( (segid " " and resid "79 " and name "HA ") OR (segid " " and resid "68 " and name "HA ") OR (segid " " and resid "46 " and name "HA ") ) 6.000 6.000 0.000 peak 10259 weight 0.10000E+01 volume -0.24200E+00 ppm1 0.926 ppm2 4.754 ASSI ( (segid " " and resid "26 " and name "HG23") OR (segid " " and resid "26 " and name "HG22") OR (segid " " and resid "26 " and name "HG21") )( (segid " " and resid "55 " and name "HB2 ") OR (segid " " and resid "27 " and name "HA ") ) 5.000 5.000 0.000 peak 10260 weight 0.10000E+01 volume -0.76200E+00 ppm1 0.825 ppm2 3.683 ASSI ( (segid " " and resid "26 " and name "HG23") OR (segid " " and resid "26 " and name "HG22") OR (segid " " and resid "26 " and name "HG21") )( (segid " " and resid "61 " and name "HG1 ") ) 5.000 5.000 0.000 peak 10261 weight 0.10000E+01 volume 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and resid "50 " and name "HG13") OR (segid " " and resid "50 " and name "HG12") )( (segid " " and resid "132 " and name "HA ") OR (segid " " and resid "70 " and name "HA ") OR (segid " " and resid "38 " and name "HA ") ) 6.000 6.000 0.000 peak 10268 weight 0.10000E+01 volume -0.13000E+00 ppm1 0.846 ppm2 5.106 ASSI ( (segid " " and resid "86 " and name "HG23") OR (segid " " and resid "86 " and name "HG22") OR (segid " " and resid "86 " and name "HG21") )( (segid " " and resid "128 " and name "HD23") OR (segid " " and resid "128 " and name "HD22") OR (segid " " and resid "124 " and name "HG23") OR (segid " " and resid "124 " and name "HG22") OR (segid " " and resid "124 " and name "HG21") OR (segid " " and resid "124 " and name "HG13") OR (segid " " and resid "124 " and name "HG12") OR (segid " " and resid "124 " and name "HG11") OR (segid " " and resid "95 " and name "HD23") OR (segid " " and resid "95 " and name "HD22") OR (segid " " and resid "95 " and name "HD21") OR (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") OR (segid " " and resid "92 " and name "HD11") OR (segid " " and resid "80 " and name "HG13") OR (segid " " and resid "80 " and name "HG11") ) 5.000 5.000 0.000 peak 10269 weight 0.10000E+01 volume -0.13810E+01 ppm1 1.330 ppm2 0.937 ASSI ( (segid " " and resid "86 " and name "HG23") OR (segid " " and resid "86 " and name "HG22") OR (segid " " and resid "86 " and name "HG21") )( (segid " " and resid "85 " and name "HG1 ") ) 5.000 5.000 0.000 peak 10273 weight 0.10000E+01 volume -0.54200E+00 ppm1 1.326 ppm2 1.760 ASSI ( (segid " " and resid "86 " and name "HG23") OR (segid " " and resid "86 " and name "HG22") OR (segid " " and resid "86 " and name "HG21") )( (segid " " and resid "82 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10274 weight 0.10000E+01 volume -0.17100E+00 ppm1 1.326 ppm2 2.313 ASSI ( (segid " " and resid "86 " and name "HG23") OR (segid " " and resid "86 " and name "HG22") OR (segid " " and resid "86 " and name "HG21") )( (segid " " and resid "53 " and name "HB2 ") ) 6.000 6.000 0.000 peak 10276 weight 0.10000E+01 volume -0.14600E+00 ppm1 1.326 ppm2 2.740 ASSI ( (segid " " and resid "86 " and name "HG23") OR (segid " " and resid "86 " and name "HG22") OR (segid " " and resid "86 " and name "HG21") )( (segid " " and resid "83 " and name "HA ") ) 5.000 5.000 0.000 peak 10278 weight 0.10000E+01 volume -0.34000E+00 ppm1 1.326 ppm2 3.781 ASSI ( (segid " " and resid "86 " and name "HG23") OR (segid " " and resid "86 " and name "HG22") OR (segid " " and resid "86 " and name "HG21") )( (segid " " and resid "53 " and name "HD2 ") OR (segid " " and resid "53 " and name "HD1 ") ) 6.000 6.000 0.000 peak 10279 weight 0.10000E+01 volume -0.14800E+00 ppm1 1.329 ppm2 7.215 ASSI ( (segid " " and resid "86 " and name "HG23") OR (segid " " and resid "86 " and name "HG22") OR (segid " " and resid "86 " and name "HG21") )( (segid " " and resid "88 " and name "HE2 ") OR (segid " " and resid "88 " and name "HE1 ") OR (segid " " and resid "88 " and name "HD2 ") OR (segid " " and resid "88 " and name "HD1 ") ) 5.000 5.000 0.000 peak 10280 weight 0.10000E+01 volume -0.31600E+00 ppm1 1.327 ppm2 7.429 ASSI ( (segid " " and resid "86 " and name "HG23") OR (segid " " and resid "86 " and name "HG22") OR (segid " " and resid "86 " and name "HG21") )( (segid " " and resid "88 " and name "HE2 ") OR (segid " " and resid "88 " and name "HE1 ") OR (segid " " and resid "53 " and name "HE2 ") ) 5.000 5.000 0.000 peak 10281 weight 0.10000E+01 volume -0.34200E+00 ppm1 1.329 ppm2 7.347 ASSI ( (segid " " and resid "112 " and name "HD2 ") )( (segid " " and resid "112 " and name "HG2 ") OR (segid " " and resid "102 " and name "HG13") OR (segid " " and resid "80 " and name "HG22") OR (segid " " and resid "80 " and name "HG13") ) 5.000 5.000 0.000 peak 10283 weight 0.10000E+01 volume 0.46200E+00 ppm1 3.963 ppm2 0.853 ASSI ( (segid " " and resid "112 " and name "HD2 ") )( (segid " " and resid "111 " and name "HD23") OR (segid " " and resid "111 " and name "HD22") OR (segid " " and resid "111 " and name "HD21") ) 5.000 5.000 0.000 peak 10284 weight 0.10000E+01 volume 0.44900E+00 ppm1 3.984 ppm2 0.958 ASSI ( (segid " " and resid "112 " and name "HD2 ") )( (segid " " and resid "112 " and name "HG1 ") ) 5.000 5.000 0.000 peak 10285 weight 0.10000E+01 volume 0.32600E+00 ppm1 3.969 ppm2 1.815 ASSI ( (segid " " and resid "112 " and name "HD2 ") )( (segid " " and resid "111 " and name "HG ") OR (segid " " and resid "111 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10286 weight 0.10000E+01 volume 0.55300E+00 ppm1 3.969 ppm2 1.967 ASSI ( (segid " " and resid "112 " and name "HD1 ") )( (segid " " and resid "111 " and name "HD23") OR (segid " " and resid "111 " and name "HD22") OR (segid " " and resid "111 " and name "HD21") ) 5.000 5.000 0.000 peak 10287 weight 0.10000E+01 volume 0.57200E+00 ppm1 4.290 ppm2 0.959 ASSI ( (segid " " and resid "124 " and name "HG23") OR (segid " " and resid "124 " and name "HG22") OR (segid " " and resid "124 " and name "HG21") )( (segid " " and resid "121 " and name "HA ") ) 6.000 6.000 0.000 peak 10288 weight 0.10000E+01 volume -0.17200E+00 ppm1 0.926 ppm2 5.222 ASSI ( (segid " " and resid "144 " and name "HD2 ") )( (segid " " and resid "134 " and name "HD23") OR (segid " " and resid "134 " and name "HD22") OR (segid " " and resid "134 " and name "HD21") OR (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD11") OR (segid " " and resid "113 " and name "HG23") OR (segid " " and resid "113 " and name "HG22") OR (segid " " and resid "113 " and name "HG21") ) 6.000 6.000 0.000 peak 10289 weight 0.10000E+01 volume 0.22200E+00 ppm1 3.730 ppm2 0.728 ASSI ( (segid " " and resid "112 " and name "HD1 ") )( (segid " " and resid "112 " and name "HG2 ") OR (segid " " and resid "80 " and name "HG23") OR (segid " " and resid "80 " and name "HG22") OR (segid " " and resid "80 " and name "HG21") OR (segid " " and resid "80 " and name "HG13") ) 5.000 5.000 0.000 peak 10290 weight 0.10000E+01 volume 0.61700E+00 ppm1 4.294 ppm2 0.847 ASSI ( (segid " " and resid "124 " and name "HG23") OR (segid " " and resid "124 " and name "HG22") OR (segid " " and resid "124 " and name "HG21") )( (segid " " and resid "88 " and name "HA ") ) 5.000 5.000 0.000 peak 10291 weight 0.10000E+01 volume -0.69400E+00 ppm1 0.930 ppm2 4.657 ASSI ( (segid " " and resid "112 " and name "HD1 ") )( (segid " " and resid "105 " and name "HD23") OR (segid " " and resid "105 " and name "HD22") OR (segid " " and resid "105 " and name "HD21") ) 6.000 6.000 0.000 peak 10292 weight 0.10000E+01 volume 0.10100E+00 ppm1 4.295 ppm2 0.392 ASSI ( (segid " " and resid "144 " and name "HD1 ") OR (segid " " and resid "112 " and name "HD1 ") )( (segid " " and resid "134 " and name "HA ") OR (segid " " and resid "102 " and name "HA ") OR (segid " " and resid "81 " and name "HA ") ) 5.000 5.000 0.000 peak 10293 weight 0.10000E+01 volume 0.62800E+00 ppm1 4.300 ppm2 3.882 ASSI ( (segid " " and resid "144 " and name "HD2 ") )( (segid " " and resid "164 " and name "HE3 ") OR (segid " " and resid "164 " and name "HE2 ") OR (segid " " and resid "164 " and name "HE1 ") OR (segid " " and resid "134 " and name "HG ") OR (segid " " and resid "111 " and name "HG ") ) 6.000 6.000 0.000 peak 10294 weight 0.10000E+01 volume 0.15700E+00 ppm1 3.729 ppm2 1.950 ASSI ( (segid " " and resid "124 " and name "HG23") OR (segid " " and resid "124 " and name "HG22") OR (segid " " and resid "124 " and name "HG21") )( (segid " " and resid "87 " and name "HA2 ") ) 5.000 5.000 0.000 peak 10295 weight 0.10000E+01 volume -0.10270E+01 ppm1 0.926 ppm2 2.580 ASSI ( (segid " " and resid "144 " and name "HD2 ") )( (segid " " and resid "134 " and name "HA ") ) 6.000 6.000 0.000 peak 10296 weight 0.10000E+01 volume 0.15800E+00 ppm1 3.731 ppm2 3.887 ASSI ( (segid " " and resid "144 " and name "HD1 ") OR (segid " " and resid "112 " and name "HD1 ") )( (segid " " and resid "134 " and name "HD23") OR (segid " " and resid "134 " and name "HD22") OR (segid " " and resid "134 " and name "HD21") OR (segid " " and resid "128 " and name "HD13") OR (segid " " and resid "128 " and name "HD12") OR (segid " " and resid "128 " and name "HD11") OR (segid " " and resid "113 " and name "HD11") OR (segid " " and resid "113 " and name "HG23") OR (segid " " and resid "113 " and name "HG22") OR (segid " " and resid "113 " and name "HG21") ) 5.000 5.000 0.000 peak 10297 weight 0.10000E+01 volume 0.43200E+00 ppm1 4.296 ppm2 0.728 ASSI ( (segid " " and resid "144 " and name "HD1 ") )( (segid " " and resid "143 " and name "HG23") OR (segid " " and resid "143 " and name "HG22") OR (segid " " and resid "143 " and name "HG21") ) 5.000 5.000 0.000 peak 10298 weight 0.10000E+01 volume 0.45800E+00 ppm1 4.298 ppm2 1.230 ASSI ( (segid " " and resid "112 " and name "HD1 ") )( (segid " " and resid "112 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10299 weight 0.10000E+01 volume 0.51400E+00 ppm1 4.298 ppm2 1.897 ASSI ( (segid " " and resid "112 " and name "HD1 ") )( (segid " " and resid "111 " and name "HG ") OR (segid " " and resid "111 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10300 weight 0.10000E+01 volume 0.53700E+00 ppm1 4.296 ppm2 1.981 ASSI ( (segid " " and resid "112 " and name "HD1 ") )( (segid " " and resid "111 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10301 weight 0.10000E+01 volume 0.12800E+00 ppm1 4.286 ppm2 2.442 ASSI ( (segid " " and resid "144 " and name "HD1 ") )( (segid " " and resid "144 " and name "HD2 ") ) 5.000 5.000 0.000 peak 10302 weight 0.10000E+01 volume 0.50100E+00 ppm1 4.304 ppm2 3.712 ASSI ( (segid " " and resid "144 " and name "HD2 ") )( (segid " " and resid "143 " and name "HG23") OR (segid " " and resid "143 " and name "HG22") OR (segid " " and resid "143 " and name "HG21") ) 6.000 6.000 0.000 peak 10303 weight 0.10000E+01 volume 0.27900E+00 ppm1 3.730 ppm2 1.233 ASSI ( (segid " " and resid "144 " and name "HD2 ") )( (segid " " and resid "145 " and name "HB1 ") OR (segid " " and resid "144 " and name "HB2 ") ) 6.000 6.000 0.000 peak 10304 weight 0.10000E+01 volume 0.20700E+00 ppm1 3.730 ppm2 1.753 ASSI ( (segid " " and resid "144 " and name "HD2 ") )( (segid " " and resid "145 " and name "HD13") OR (segid " " and resid "145 " and name "HD12") OR (segid " " and resid "145 " and name "HD11") OR (segid " " and resid "142 " and name "HD13") OR (segid " " and resid "134 " and name "HD13") OR (segid " " and resid "134 " and name "HD12") OR (segid " " and resid "134 " and name "HD11") OR (segid " " and resid "117 " and name "HD13") OR (segid " " and resid "117 " and name "HD12") OR (segid " " and resid "117 " and name "HD11") OR (segid " " and resid "111 " and name "HD22") ) 6.000 6.000 0.000 peak 10305 weight 0.10000E+01 volume 0.10900E+00 ppm1 3.722 ppm2 0.917 ASSI ( (segid " " and resid "94 " and name "HG12") OR (segid " " and resid "94 " and name "HG11") OR (segid " " and resid "46 " and name "HG23") OR (segid " " and resid "46 " and name "HG22") OR (segid " " and resid "46 " and name "HG21") )( (segid " " and resid "95 " and name "HG ") OR (segid " " and resid "40 " and name "HG ") ) 3.300 3.300 0.000 peak 10307 weight 0.10000E+01 volume -0.21340E+01 ppm1 1.193 ppm2 1.753 ASSI ( (segid " " and resid "80 " and name "HG13") OR (segid " " and resid "80 " and name "HG12") OR (segid " " and resid "80 " and name "HG11") )( (segid " " and resid "81 " and name "HE1 ") ) 6.000 6.000 0.000 peak 10308 weight 0.10000E+01 volume -0.15000E+00 ppm1 0.899 ppm2 7.491 ASSI ( (segid " " and resid "143 " and name "HG23") OR (segid " " and resid "143 " and name "HG22") OR (segid " " and resid "143 " and name "HG21") )( (segid " " and resid "137 " and name "HG1 ") ) 3.300 3.300 0.000 peak 10309 weight 0.10000E+01 volume -0.24590E+01 ppm1 1.246 ppm2 1.673 ASSI ( (segid " " and resid "143 " and name "HG23") OR (segid " " and resid "143 " and name "HG22") OR (segid " " and resid "143 " and name "HG21") )( (segid " " and resid "137 " and name "HD2 ") OR (segid " " and resid "137 " and name "HD1 ") ) 5.000 5.000 0.000 peak 10310 weight 0.10000E+01 volume -0.94700E+00 ppm1 1.246 ppm2 3.141 ASSI ( (segid " " and resid "77 " and name "HG23") OR (segid " " and resid "77 " and name "HG22") OR (segid " " and resid "77 " and name "HG21") )( (segid " " and resid "81 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10311 weight 0.10000E+01 volume -0.18710E+01 ppm1 1.246 ppm2 3.274 ASSI ( (segid " " and resid "134 " and name "HD23") OR (segid " " and resid "134 " and name "HD22") OR (segid " " and resid "134 " and name "HD21") )( (segid " " and resid "132 " and name "HB2 ") OR (segid " " and resid "132 " and name "HB1 ") OR (segid " " and resid "130 " and name "HD1 ") ) 5.000 5.000 0.000 peak 10312 weight 0.10000E+01 volume -0.17620E+01 ppm1 0.686 ppm2 3.514 ASSI ( (segid " " and resid "156 " and name "HD23") OR (segid " " and resid "156 " and name "HD22") OR (segid " " and resid "156 " and name "HD21") OR (segid " " and resid "134 " and name "HD21") )( (segid " " and resid "132 " and name "HB1 ") OR (segid " " and resid "120 " and name "HA2 ") OR (segid " " and resid "117 " and name "HA ") ) 5.000 5.000 0.000 peak 10313 weight 0.10000E+01 volume -0.18960E+01 ppm1 0.724 ppm2 3.534 ASSI ( (segid " " and resid "102 " and name "HG23") OR (segid " " and resid "102 " and name "HG22") OR (segid " " and resid "102 " and name "HG21") OR (segid " " and resid "80 " and name "HG13") OR (segid " " and resid "80 " and name "HG12") OR (segid " " and resid "80 " and name "HG11") )( (segid " " and resid "127 " and name "HZ ") OR (segid " " and resid "53 " and name "HE2 ") OR (segid " " and resid "53 " and name "HE1 ") ) 6.000 6.000 0.000 peak 10314 weight 0.10000E+01 volume -0.17100E+00 ppm1 0.899 ppm2 7.331 ASSI ( (segid " " and resid "102 " and name "HG23") OR (segid " " and resid "102 " and name "HG22") OR (segid " " and resid "102 " and name "HG21") OR (segid " " and resid "80 " and name "HG13") OR (segid " " and resid "80 " and name "HG11") OR (segid " " and resid "34 " and name "HD23") OR (segid " " and resid "34 " and name "HD22") OR (segid " " and resid "34 " and name "HD21") )( (segid " " and resid "101 " and name "HA ") OR (segid " " and resid "32 " and name "HA ") OR (segid " " and resid "31 " and name "HA ") ) 5.000 5.000 0.000 peak 10316 weight 0.10000E+01 volume -0.96000E+00 ppm1 0.855 ppm2 4.647 ASSI ( (segid " " and resid "63 " and name "HD23") OR (segid " " and resid "63 " and name "HD22") OR (segid " " and resid "63 " and name "HD21") )( (segid " " and resid "98 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10317 weight 0.10000E+01 volume -0.74000E+00 ppm1 0.846 ppm2 2.847 ASSI ( (segid " " and resid "30 " and name "HD23") OR (segid " " and resid "30 " and name "HD22") )( (segid " " and resid "37 " and name "HD1 ") ) 5.000 5.000 0.000 peak 10318 weight 0.10000E+01 volume -0.62300E+00 ppm1 0.766 ppm2 3.274 ASSI ( (segid " " and resid "37 " and name "HD1 ") )( (segid " " and resid "30 " and name "HD23") OR (segid " " and resid "30 " and name "HD22") ) 6.000 6.000 0.000 peak 10319 weight 0.10000E+01 volume 0.19400E+00 ppm1 3.291 ppm2 0.769 ASSI ( (segid " " and resid "37 " and name "HD2 ") )( (segid " " and resid "30 " and name "HD23") OR (segid " " and resid "30 " and name "HD22") OR (segid " " and resid "30 " and name "HD21") ) 6.000 6.000 0.000 peak 10320 weight 0.10000E+01 volume 0.18900E+00 ppm1 2.552 ppm2 0.756 ASSI ( (segid " " and resid "147 " and name "HD23") OR (segid " " and resid "147 " and name "HD22") OR (segid " " and resid "147 " and name "HD21") )( (segid " " and resid "151 " and name "HD2 ") ) 5.000 5.000 0.000 peak 10321 weight 0.10000E+01 volume -0.51100E+00 ppm1 1.039 ppm2 2.989 ASSI ( (segid " " and resid "147 " and name "HD23") OR (segid " " and resid "147 " and name "HD22") OR (segid " " and resid "147 " and name "HD21") )( (segid " " and resid "117 " and name "HA ") OR (segid " " and resid "114 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10322 weight 0.10000E+01 volume -0.82900E+00 ppm1 1.040 ppm2 3.526 ASSI ( (segid " " and resid "40 " and name "HD23") OR (segid " " and resid "40 " and name "HD22") OR (segid " " and resid "40 " and name "HD21") )( (segid " " and resid "46 " and name "HA ") ) 5.000 5.000 0.000 peak 10323 weight 0.10000E+01 volume -0.51800E+00 ppm1 0.659 ppm2 4.795 ASSI ( (segid " " and resid "89 " and name "HD23") OR (segid " " and resid "89 " and name "HD22") OR (segid " " and resid "89 " and name "HD21") )( (segid " " and resid "124 " and name "HB ") OR (segid " " and resid "97 " and name "HG1 ") ) 6.000 6.000 0.000 peak 10325 weight 0.10000E+01 volume -0.18500E+00 ppm1 0.605 ppm2 2.394 ASSI ( (segid " " and resid "26 " and name "HG13") OR (segid " " and resid "26 " and name "HG12") OR (segid " " and resid "26 " and name "HG11") OR (segid " " and resid "23 " and name "HG13") OR (segid " " and resid "23 " and name "HG11") )( (segid " " and resid "27 " and name "HD2 ") OR (segid " " and resid "27 " and name "HD1 ") OR (segid " " and resid "22 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10326 weight 0.10000E+01 volume -0.97500E+00 ppm1 0.939 ppm2 3.093 ASSI ( (segid " " and resid "127 " and name "HZ ") )( (segid " " and resid "127 " and name "HB2 ") ) 6.000 6.000 0.000 peak 10328 weight 0.10000E+01 volume -0.12200E+00 ppm1 7.325 ppm2 2.935 ASSI ( (segid " " and resid "89 " and name "HD23") OR (segid " " and resid "89 " and name "HD22") OR (segid " " and resid "89 " and name "HD21") )( (segid " " and resid "125 " and name "HB ") OR (segid " " and resid "97 " and name "HB1 ") OR (segid " " and resid "94 " and name "HB ") ) 6.000 6.000 0.000 peak 10329 weight 0.10000E+01 volume -0.17100E+00 ppm1 0.607 ppm2 2.217 ASSI ( (segid " " and resid "130 " and name "HD1 ") )( (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG21") OR (segid " " and resid "134 " and name "HD12") ) 5.000 5.000 0.000 peak 10330 weight 0.10000E+01 volume 0.39300E+00 ppm1 3.466 ppm2 0.895 ASSI ( (segid " " and resid "130 " and name "HD1 ") )( (segid " " and resid "129 " and name "HB3 ") OR (segid " " and resid "129 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10331 weight 0.10000E+01 volume 0.60700E+00 ppm1 3.466 ppm2 1.129 ASSI ( (segid " " and resid "130 " and name "HD2 ") )( (segid " " and resid "129 " and name "HB3 ") OR (segid " " and resid "129 " and name "HB2 ") OR (segid " " and resid "129 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10332 weight 0.10000E+01 volume 0.81100E+00 ppm1 3.061 ppm2 1.129 ASSI ( (segid " " and resid "130 " and name "HD2 ") )( (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "159 " and name "HG21") OR (segid " " and resid "134 " and name "HD13") OR (segid " " and resid "134 " and name "HD12") OR (segid " " and resid "134 " and name "HD11") OR (segid " " and resid "128 " and name "HD23") OR 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5.000 0.000 peak 10367 weight 0.10000E+01 volume -0.67300E+00 ppm1 7.215 ppm2 0.960 ASSI ( (segid " " and resid "127 " and name "HE2 ") OR (segid " " and resid "127 " and name "HE1 ") )( (segid " " and resid "93 " and name "HB2 ") OR (segid " " and resid "92 " and name "HG ") ) 6.000 6.000 0.000 peak 10368 weight 0.10000E+01 volume -0.26600E+00 ppm1 7.224 ppm2 1.646 ASSI ( (segid " " and resid "42 " and name "HG1 ") )( (segid " " and resid "42 " and name "HD2 ") OR (segid " " and resid "42 " and name "HD1 ") ) 5.000 5.000 0.000 peak 10369 weight 0.10000E+01 volume -0.10130E+01 ppm1 1.273 ppm2 2.927 ASSI ( (segid " " and resid "127 " and name "HE2 ") OR (segid " " and resid "127 " and name "HE1 ") )( (segid " " and resid "128 " and name "HD23") OR (segid " " and resid "128 " and name "HD22") OR (segid " " and resid "128 " and name "HD21") OR (segid " " and resid "102 " and name "HG11") ) 5.000 5.000 0.000 peak 10370 weight 0.10000E+01 volume -0.66500E+00 ppm1 7.215 ppm2 0.895 ASSI ( 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" and name "HD22") OR (segid " " and resid "48 " and name "HD13") OR (segid " " and resid "48 " and name "HD12") OR (segid " " and resid "48 " and name "HD11") ) 5.000 5.000 0.000 peak 10409 weight 0.10000E+01 volume -0.80300E+00 ppm1 2.118 ppm2 0.830 ASSI ( (segid " " and resid "69 " and name "HG2 ") )( (segid " " and resid "68 " and name "HA ") ) 6.000 6.000 0.000 peak 10410 weight 0.10000E+01 volume -0.19700E+00 ppm1 1.833 ppm2 4.756 ASSI ( (segid " " and resid "69 " and name "HG1 ") )( (segid " " and resid "100 " and name "HB3 ") OR (segid " " and resid "100 " and name "HB2 ") OR (segid " " and resid "100 " and name "HB1 ") OR (segid " " and resid "95 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10411 weight 0.10000E+01 volume -0.49700E+00 ppm1 2.121 ppm2 1.129 ASSI ( (segid " " and resid "67 " and name "HA ") )( (segid " " and resid "38 " and name "HB2 ") OR (segid " " and resid "37 " and name "HD2 ") ) 6.000 6.000 0.000 peak 10412 weight 0.10000E+01 volume 0.10200E+00 ppm1 4.018 ppm2 2.570 ASSI ( (segid " " and resid "88 " and name "HD2 ") OR (segid " " and resid "88 " and name "HD1 ") )( (segid " " and resid "53 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10413 weight 0.10000E+01 volume -0.18000E+00 ppm1 7.449 ppm2 2.840 ASSI ( (segid " " and resid "160 " and name "HD13") OR (segid " " and resid "160 " and name "HD12") OR (segid " " and resid "160 " and name "HD11") )( (segid " " and resid "132 " and name "HB2 ") OR (segid " " and resid "132 " and name "HB1 ") OR (segid " " and resid "130 " and name "HD1 ") OR (segid " " and resid "120 " and name "HA2 ") OR (segid " " and resid "117 " and name "HA ") ) 6.000 6.000 0.000 peak 10414 weight 0.10000E+01 volume -0.19700E+00 ppm1 0.659 ppm2 3.514 ASSI ( (segid " " and resid "69 " and name "HG2 ") )( (segid " " and resid "95 " and name "HA ") OR (segid " " and resid "68 " and name "HB1 ") OR (segid " " and resid "63 " and name "HA ") ) 6.000 6.000 0.000 peak 10415 weight 0.10000E+01 volume -0.25200E+00 ppm1 1.833 ppm2 3.941 ASSI ( (segid " " and resid "67 " and name "HA ") )( (segid " " and resid "66 " and name "HA2 ") OR (segid " " and resid "62 " and name "HA ") OR (segid " " and resid "48 " and name "HA ") ) 6.000 6.000 0.000 peak 10416 weight 0.10000E+01 volume 0.20100E+00 ppm1 4.019 ppm2 3.791 ASSI ( (segid " " and resid "67 " and name "HA ") )( (segid " " and resid "48 " and name "HB2 ") OR (segid " " and resid "37 " and name "HG2 ") ) 5.000 5.000 0.000 peak 10417 weight 0.10000E+01 volume 0.80900E+00 ppm1 4.022 ppm2 1.388 ASSI ( (segid " " and resid "67 " and name "HA ") )( (segid " " and resid "37 " and name "HG1 ") OR (segid " " and resid "37 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10418 weight 0.10000E+01 volume 0.11480E+01 ppm1 4.019 ppm2 1.691 ASSI ( (segid " " and resid "67 " and name "HA ") )( (segid " " and resid "37 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10419 weight 0.10000E+01 volume 0.44900E+00 ppm1 4.020 ppm2 1.947 ASSI ( (segid " " and resid "88 " and name "HD2 ") OR (segid " " and resid "88 " and name "HD1 ") )( (segid " " and resid "86 " and name "HB ") ) 6.000 6.000 0.000 peak 10421 weight 0.10000E+01 volume -0.20400E+00 ppm1 7.451 ppm2 4.368 ASSI ( (segid " " and resid "88 " and name "HD2 ") OR (segid " " and resid "88 " and name "HD1 ") )( (segid " " and resid "83 " and name "HA ") ) 6.000 6.000 0.000 peak 10422 weight 0.10000E+01 volume -0.13300E+00 ppm1 7.453 ppm2 3.808 ASSI ( (segid " " and resid "88 " and name "HD2 ") OR (segid " " and resid "88 " and name "HD1 ") )( (segid " " and resid "54 " and name "HA2 ") OR (segid " " and resid "54 " and name "HA1 ") ) 6.000 6.000 0.000 peak 10423 weight 0.10000E+01 volume -0.10700E+00 ppm1 7.454 ppm2 3.167 ASSI ( (segid " " and resid "88 " and name "HD2 ") OR (segid " " and resid "88 " and name "HD1 ") )( (segid " " and resid "53 " and name "HB2 ") ) 6.000 6.000 0.000 peak 10424 weight 0.10000E+01 volume -0.19500E+00 ppm1 7.446 ppm2 2.740 ASSI ( (segid " " and resid "88 " and name "HD2 ") OR (segid " " and resid "88 " and name "HD1 ") )( (segid " " and resid "86 " and name "HG23") OR (segid " " and resid "86 " and name "HG22") OR (segid " " and resid "86 " and name "HG21") OR (segid " " and resid "83 " and name "HB3 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "83 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10425 weight 0.10000E+01 volume -0.19000E+00 ppm1 7.446 ppm2 1.326 ASSI ( (segid " " and resid "67 " and name "HA ") )( (segid " " and resid "66 " and name "HA1 ") OR (segid " " and resid "36 " and name "HA ") ) 6.000 6.000 0.000 peak 10426 weight 0.10000E+01 volume 0.11300E+00 ppm1 4.016 ppm2 4.347 ASSI ( (segid " " and resid "145 " and name "HD13") OR (segid " " and resid "145 " and name "HD12") OR (segid " " and resid "145 " and name "HD11") )( (segid " " and resid "161 " and name "HA ") ) 5.000 5.000 0.000 peak 10427 weight 0.10000E+01 volume -0.12470E+01 ppm1 0.956 ppm2 4.015 ASSI ( (segid " " and resid "138 " and name "HA ") )( (segid " " and resid "110 " and name "HA ") ) 5.000 5.000 0.000 peak 10428 weight 0.10000E+01 volume 0.33700E+00 ppm1 4.586 ppm2 4.085 ASSI ( (segid " " and resid "138 " and name "HA ") )( (segid " " and resid "147 " and name "HD13") OR (segid " " and resid "147 " and name "HD12") OR (segid " " and resid "137 " and name "HB2 ") OR (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") ) 6.000 6.000 0.000 peak 10429 weight 0.10000E+01 volume 0.12500E+00 ppm1 4.581 ppm2 1.211 ASSI ( (segid " " and resid "138 " and name "HA ") )( (segid " " and resid "139 " and name "HB3 ") OR (segid " " and resid "139 " and name "HB2 ") OR (segid " " and resid "139 " and name "HB1 ") OR (segid " " and resid "137 " and name "HG2 ") ) 6.000 6.000 0.000 peak 10430 weight 0.10000E+01 volume 0.24900E+00 ppm1 4.583 ppm2 1.406 ASSI ( (segid " " and resid "145 " and name "HD13") OR (segid " " and resid "145 " and name "HD12") OR (segid " " and resid "145 " and name "HD11") OR (segid " " and resid "134 " and name "HD13") OR (segid " " and resid "134 " and name "HD12") )( (segid " " and resid "164 " and name "HG2 ") OR (segid " " and resid "161 " and name "HG2 ") ) 5.000 5.000 0.000 peak 10431 weight 0.10000E+01 volume -0.19560E+01 ppm1 0.952 ppm2 2.367 ASSI ( (segid " " and resid "134 " and name "HG ") )( (segid " " and resid "132 " and name "HB2 ") OR (segid " " and resid "132 " and name "HB1 ") OR (segid " " and resid "130 " and name "HD1 ") ) 6.000 6.000 0.000 peak 10432 weight 0.10000E+01 volume -0.22200E+00 ppm1 1.940 ppm2 3.488 ASSI ( (segid " " and resid "45 " and name "HG2 ") OR (segid " " and resid "45 " and name "HG1 ") )( (segid " " and resid "73 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10433 weight 0.10000E+01 volume -0.13300E+00 ppm1 1.337 ppm2 3.532 ASSI ( (segid " " and resid "128 " and name "HD13") OR (segid " " and resid "128 " and name "HD12") OR (segid " " and resid "128 " and name "HD11") OR (segid " " and resid "62 " and name "HD13") OR (segid " " and resid "62 " and name "HD12") OR (segid " " and resid "62 " and name "HD11") )( (segid " " and resid "116 " and name "HA ") OR (segid " " and resid "112 " and name "HA ") OR (segid " " and resid "37 " and name "HA ") OR (segid " " and resid "17 " and name "HA ") OR (segid " " and resid "14 " and name "HA ") ) 5.000 5.000 0.000 peak 10434 weight 0.10000E+01 volume -0.47800E+00 ppm1 0.686 ppm2 4.102 ASSI ( (segid " " and resid "138 " and name "HA ") )( (segid " " and resid "109 " and name "HA1 ") ) 5.000 5.000 0.000 peak 10435 weight 0.10000E+01 volume 0.48500E+00 ppm1 4.582 ppm2 4.315 ASSI ( (segid " " and resid "138 " and name "HA ") )( (segid " " and resid "109 " and name "HA2 ") ) 6.000 6.000 0.000 peak 10436 weight 0.10000E+01 volume 0.22700E+00 ppm1 4.582 ppm2 3.798 ASSI ( (segid " " and resid "62 " and name "HD13") OR (segid " " and resid "62 " and name "HD12") OR (segid " " and resid "62 " and name "HD11") )( (segid " " and resid "51 " and name "HG1 ") ) 5.000 5.000 0.000 peak 10438 weight 0.10000E+01 volume -0.61900E+00 ppm1 0.654 ppm2 2.332 ASSI ( (segid " " and resid "103 " and name "HA ") )( (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") ) 6.000 6.000 0.000 peak 10439 weight 0.10000E+01 volume 0.12900E+00 ppm1 5.348 ppm2 1.191 ASSI ( (segid " " and resid "145 " and name "HD13") OR (segid " " and resid "145 " and name "HD12") OR (segid " " and resid "145 " and name "HD11") OR (segid " " and resid "134 " and name "HD13") OR (segid " " and resid "134 " and name "HD12") OR (segid " " and resid "134 " and name "HD11") )( (segid " " and resid "164 " and name "HG2 ") OR (segid " " and resid "161 " and name "HG2 ") ) 3.300 3.300 0.000 peak 10440 weight 0.10000E+01 volume -0.22130E+01 ppm1 0.929 ppm2 2.355 ASSI ( (segid " " and resid "160 " and name "HD13") OR (segid " " and resid "160 " and name "HD12") OR (segid " " and resid "160 " and name "HD11") OR (segid " " and resid "62 " and name "HD11") )( (segid " " and resid "157 " and name "HA ") OR (segid " " and resid "144 " and name "HA ") OR (segid " " and resid "129 " and name "HA ") OR (segid " " and resid "59 " and name "HA ") ) 3.300 3.300 0.000 peak 10441 weight 0.10000E+01 volume -0.27950E+01 ppm1 0.648 ppm2 3.717 ASSI ( (segid " " and resid "103 " and name "HA ") )( (segid " " and resid "105 " and name "HD23") OR (segid " " and resid "105 " and name "HD22") OR (segid " " and resid "105 " and name "HD21") ) 6.000 6.000 0.000 peak 10442 weight 0.10000E+01 volume 0.80000E-01 ppm1 5.340 ppm2 0.395 ASSI ( (segid " " and resid "103 " and name "HA ") )( (segid " " and resid "111 " and name "HG ") OR (segid " " and resid "111 " and name "HB2 ") ) 6.000 6.000 0.000 peak 10443 weight 0.10000E+01 volume 0.11900E+00 ppm1 5.341 ppm2 1.968 ASSI ( (segid " " and resid "103 " and name "HA ") )( (segid " " and resid "111 " and name "HD23") OR (segid " " and resid "111 " and name "HD22") OR (segid " " and resid "111 " and name "HD21") ) 5.000 5.000 0.000 peak 10444 weight 0.10000E+01 volume 0.17880E+01 ppm1 5.345 ppm2 0.962 ASSI ( (segid " " and resid "103 " and name "HA ") )( (segid " " and resid "112 " and name "HG2 ") OR (segid " " and resid "102 " and name "HG23") OR (segid " " and resid "102 " and name "HG21") ) 5.000 5.000 0.000 peak 10445 weight 0.10000E+01 volume 0.60000E+00 ppm1 5.345 ppm2 0.871 ASSI ( (segid " " and resid "95 " and name "HD13") OR (segid " " and resid "95 " and name "HD12") OR (segid " " and resid "95 " and name "HD11") )( (segid " " and resid "93 " and name "HA ") OR (segid " " and resid "80 " and name "HA ") OR (segid " " and resid "59 " and name "HA ") ) 3.300 3.300 0.000 peak 10446 weight 0.10000E+01 volume -0.21930E+01 ppm1 0.766 ppm2 3.701 ASSI ( (segid " " and resid "134 " and name "HG ") )( (segid " " and resid "129 " and name "HA ") ) 6.000 6.000 0.000 peak 10447 weight 0.10000E+01 volume 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" and resid "79 " and name "HA ") ) 6.000 6.000 0.000 peak 10451 weight 0.10000E+01 volume -0.11500E+00 ppm1 0.766 ppm2 4.742 ASSI ( (segid " " and resid "134 " and name "HD13") OR (segid " " and resid "134 " and name "HD12") OR (segid " " and resid "134 " and name "HD11") )( (segid " " and resid "163 " and name "HA ") ) 6.000 6.000 0.000 peak 10452 weight 0.10000E+01 volume -0.20000E+00 ppm1 0.914 ppm2 4.637 ASSI ( (segid " " and resid "105 " and name "HG ") OR (segid " " and resid "85 " and name "HG2 ") )( (segid " " and resid "116 " and name "HA ") OR (segid " " and resid "104 " and name "HA ") ) 5.000 5.000 0.000 peak 10453 weight 0.10000E+01 volume -0.33000E+00 ppm1 1.646 ppm2 4.155 ASSI ( (segid " " and resid "70 " and name "HA ") )( (segid " " and resid "79 " and name "HD2 ") OR (segid " " and resid "79 " and name "HD1 ") OR (segid " " and resid "78 " and name "HB2 ") OR (segid " " and resid "71 " and name "HA ") ) 6.000 6.000 0.000 peak 10454 weight 0.10000E+01 volume 0.22300E+00 ppm1 5.146 ppm2 4.306 ASSI ( (segid " " and resid "70 " and name "HA ") )( (segid " " and resid "80 " and name "HG21") OR (segid " " and resid "71 " and name "HG13") OR (segid " " and resid "71 " and name "HG12") OR (segid " " and resid "71 " and name "HG11") OR (segid " " and resid "48 " and name "HD13") OR (segid " " and resid "48 " and name "HD12") OR (segid " " and resid "48 " and name "HD11") ) 6.000 6.000 0.000 peak 10455 weight 0.10000E+01 volume 0.24000E+00 ppm1 5.145 ppm2 0.835 ASSI ( (segid " " and resid "142 " and name "HD13") OR (segid " " and resid "142 " and name "HD12") OR (segid " " and resid "142 " and name "HD11") )( (segid " " and resid "140 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10456 weight 0.10000E+01 volume -0.70500E+00 ppm1 0.893 ppm2 3.900 ASSI ( (segid " " and resid "142 " and name "HD13") OR (segid " " and resid "142 " and name "HD12") OR (segid " " and resid "142 " and name "HD11") )( (segid " " and resid "140 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10457 weight 0.10000E+01 volume -0.86800E+00 ppm1 0.895 ppm2 4.100 ASSI ( (segid " " and resid "142 " and name "HD13") OR (segid " " and resid "142 " and name "HD12") OR (segid " " and resid "142 " and name "HD11") )( (segid " " and resid "147 " and name "HA ") ) 5.000 5.000 0.000 peak 10458 weight 0.10000E+01 volume -0.13230E+01 ppm1 0.888 ppm2 4.211 ASSI ( (segid " " and resid "70 " and name "HA ") OR (segid " " and resid "38 " and name "HA ") )( (segid " " and resid "80 " and name "HG13") OR (segid " " and resid "80 " and name "HG12") OR (segid " " and resid "80 " and name "HG11") OR (segid " " and resid "71 " and name "HG23") OR (segid " " and resid "71 " and name "HG22") OR (segid " " and resid "71 " and name "HG21") OR (segid " " and resid "62 " and name "HD23") OR (segid " " and resid "62 " and name "HD22") OR (segid " " and resid "62 " and name "HD21") OR (segid " " and resid "40 " and name "HD13") OR (segid " " and resid "40 " and name "HD12") OR (segid " " and resid "40 " and name "HD11") ) 6.000 6.000 0.000 peak 10459 weight 0.10000E+01 volume 0.26200E+00 ppm1 5.147 ppm2 0.928 ASSI ( (segid " " and resid "85 " and name "HG2 ") )( (segid " " and resid "119 " and name "HG1 ") ) 5.000 5.000 0.000 peak 10460 weight 0.10000E+01 volume -0.31800E+00 ppm1 1.625 ppm2 2.962 ASSI ( (segid " " and resid "105 " and name "HA ") )( (segid " " and resid "111 " and name "HA ") ) 6.000 6.000 0.000 peak 10461 weight 0.10000E+01 volume 0.12000E+00 ppm1 4.935 ppm2 5.275 ASSI ( (segid " " and resid "105 " and name "HA ") )( (segid " " and resid "115 " and name "HD23") OR (segid " " and resid "115 " and name "HD22") OR (segid " " and resid "115 " and name "HD21") OR (segid " " and resid "111 " and name "HD23") OR (segid " " and resid "111 " and name "HD22") OR (segid " " and resid "111 " and name "HD21") ) 5.000 5.000 0.000 peak 10462 weight 0.10000E+01 volume 0.35400E+00 ppm1 4.948 ppm2 0.956 ASSI ( (segid " " and resid "89 " and name "HG ") )( (segid " " 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1.753 ppm2 3.461 ASSI ( (segid " " and resid "29 " and name "HD13") OR (segid " " and resid "29 " and name "HD12") OR (segid " " and resid "29 " and name "HD11") )( (segid " " and resid "26 " and name "HA ") ) 5.000 5.000 0.000 peak 10468 weight 0.10000E+01 volume -0.41200E+00 ppm1 0.765 ppm2 3.393 ASSI ( (segid " " and resid "39 " and name "HA ") )( (segid " " and resid "10 " and name "HG23") OR (segid " " and resid "10 " and name "HG22") OR (segid " " and resid "10 " and name "HG21") OR (segid " " and resid "10 " and name "HG12") OR (segid " " and resid "10 " and name "HG11") ) 6.000 6.000 0.000 peak 10469 weight 0.10000E+01 volume 0.28500E+00 ppm1 4.044 ppm2 1.145 ASSI ( (segid " " and resid "111 " and name "HA ") )( (segid " " and resid "128 " and name "HD12") OR (segid " " and resid "128 " and name "HD11") OR (segid " " and resid "113 " and name "HG23") OR (segid " " and resid "113 " and name "HG22") OR (segid " " and resid "113 " and name "HG21") ) 6.000 6.000 0.000 peak 10470 weight 0.10000E+01 volume 0.14200E+00 ppm1 5.275 ppm2 0.744 ASSI ( (segid " " and resid "39 " and name "HA ") )( (segid " " and resid "40 " and name "HD23") OR (segid " " and resid "40 " and name "HD22") OR (segid " " and resid "40 " and name "HD21") ) 6.000 6.000 0.000 peak 10471 weight 0.10000E+01 volume 0.15600E+00 ppm1 4.045 ppm2 0.681 ASSI ( (segid " " and resid "39 " and name "HA ") )( (segid " " and resid "40 " and name "HD13") OR (segid " " and resid "40 " and name "HD12") OR (segid " " and resid "40 " and name "HD11") OR (segid " " and resid "35 " and name "HG11") OR (segid " " and resid "8 " and name "HG21") OR (segid " " and resid "8 " and name "HG13") OR (segid " " and resid "8 " and name "HG11") ) 5.000 5.000 0.000 peak 10472 weight 0.10000E+01 volume 0.51900E+00 ppm1 4.045 ppm2 0.924 ASSI ( (segid " " and resid "39 " and name "HA ") )( (segid " " and resid "36 " and name "HB2 ") ) 6.000 6.000 0.000 peak 10473 weight 0.10000E+01 volume 0.15800E+00 ppm1 4.044 ppm2 2.885 ASSI ( (segid " " and resid "39 " and name "HA ") )( (segid " " and resid "11 " and name "HA2 ") ) 6.000 6.000 0.000 peak 10474 weight 0.10000E+01 volume 0.26400E+00 ppm1 4.041 ppm2 3.792 ASSI ( (segid " " and resid "39 " and name "HA ") )( (segid " " and resid "42 " and name "HA ") OR (segid " " and resid "8 " and name "HA ") ) 5.000 5.000 0.000 peak 10475 weight 0.10000E+01 volume 0.91500E+00 ppm1 4.039 ppm2 4.173 ASSI ( (segid " " and resid "39 " and name "HA ") )( (segid " " and resid "47 " and name "HB3 ") OR (segid " " and resid "47 " and name "HB2 ") OR (segid " " and resid "47 " and name "HB1 ") OR (segid " " and resid "40 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10476 weight 0.10000E+01 volume 0.49200E+00 ppm1 4.044 ppm2 1.274 ASSI ( (segid " " and resid "39 " and name "HA ") )( (segid " " and resid "40 " and name "HA ") OR (segid " " and resid "36 " and name "HA ") OR (segid " " and resid "7 " and name "HA ") ) 6.000 6.000 0.000 peak 10477 weight 0.10000E+01 volume 0.44000E-01 ppm1 4.034 ppm2 4.357 ASSI ( (segid " " and resid "115 " and name "HG ") )( (segid " " and resid "114 " and name "HB2 ") ) 6.000 6.000 0.000 peak 10479 weight 0.10000E+01 volume -0.22200E+00 ppm1 2.020 ppm2 3.514 ASSI ( (segid " " and resid "115 " and name "HG ") )( (segid " " and resid "81 " and name "HD2 ") ) 6.000 6.000 0.000 peak 10480 weight 0.10000E+01 volume -0.10500E+00 ppm1 2.035 ppm2 6.530 ASSI ( (segid " " and resid "39 " and name "HA ") )( (segid " " and resid "40 " and name "HG ") OR (segid " " and resid "40 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10481 weight 0.10000E+01 volume 0.29900E+00 ppm1 4.040 ppm2 1.779 ASSI ( (segid " " and resid "111 " and name "HA ") )( (segid " " and resid "112 " and name "HD1 ") ) 5.000 5.000 0.000 peak 10482 weight 0.10000E+01 volume 0.31900E+00 ppm1 5.284 ppm2 4.285 ASSI ( (segid " " and resid "111 " and name "HA ") )( (segid " " and resid "112 " and name "HD2 ") ) 5.000 5.000 0.000 peak 10483 weight 0.10000E+01 volume 0.30400E+00 ppm1 5.275 ppm2 3.966 ASSI ( (segid " " and resid "111 " and name "HA ") )( (segid " " and resid "105 " and name "HD13") OR (segid " " and resid "105 " and name "HD12") OR (segid " " and resid "105 " and name "HD11") ) 5.000 5.000 0.000 peak 10484 weight 0.10000E+01 volume 0.35600E+00 ppm1 5.276 ppm2 0.856 ASSI ( (segid " " and resid "111 " and name "HA ") )( (segid " " and resid "112 " and name "HG1 ") OR (segid " " and resid "105 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10485 weight 0.10000E+01 volume 0.14700E+00 ppm1 5.280 ppm2 1.829 ASSI ( (segid " " and resid "115 " and name "HG ") OR (segid " " and resid "56 " and name "HG2 ") OR (segid " " and resid "56 " and name "HG1 ") )( (segid " " and resid "113 " and name "HG12") OR (segid " " and resid "106 " and name "HB2 ") OR (segid " " and resid "105 " and name "HB2 ") OR (segid " " and resid "104 " and name "HB2 ") OR (segid " " and resid "104 " and name "HB1 ") OR (segid " " and resid "89 " and name "HG ") OR (segid " " and resid "83 " and name "HB3 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "83 " and name "HB1 ") OR (segid " " and resid "59 " and name "HB3 ") OR (segid " " and resid "59 " and name "HB2 ") OR (segid " " and resid "59 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10486 weight 0.10000E+01 volume -0.85500E+00 ppm1 2.034 ppm2 1.326 ASSI ( (segid " " and resid "115 " and name "HG ") OR (segid " " and resid "56 " and name "HG2 ") OR (segid " " and resid "56 " and name "HG1 ") )( (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "84 " and name "HB3 ") OR (segid " " and resid "84 " and name "HB2 ") OR (segid " " and resid "57 " and name "HB3 ") OR (segid " " and resid "57 " and name "HB2 ") OR (segid " " and resid "57 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10487 weight 0.10000E+01 volume -0.71100E+00 ppm1 2.032 ppm2 1.449 ASSI ( (segid " " and resid "72 " and name "HA ") )( (segid " " and resid "79 " and name "HD2 ") OR (segid " " and resid "79 " and name "HD1 ") OR (segid " " and resid "78 " and name "HB2 ") OR (segid " " and resid "71 " and name "HA ") ) 5.000 5.000 0.000 peak 10488 weight 0.10000E+01 volume 0.66400E+00 ppm1 4.998 ppm2 4.310 ASSI ( (segid " " and resid "121 " and name "HA ") )( (segid " " and resid "125 " and name "HG13") OR (segid " " and resid "125 " and name "HG12") OR (segid " " and resid "125 " and name "HG11") OR (segid " " and resid "124 " and name "HG23") OR (segid " " and resid "124 " and name "HG22") OR (segid " " and resid "124 " and name "HG21") OR (segid " " and resid "124 " and name "HG13") OR (segid " " and resid "124 " and name "HG12") OR (segid " " and resid "124 " and name "HG11") ) 5.000 5.000 0.000 peak 10489 weight 0.10000E+01 volume 0.51000E+00 ppm1 5.225 ppm2 0.952 ASSI ( (segid " " and resid "72 " and name "HA ") )( (segid " " and resid "78 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10490 weight 0.10000E+01 volume 0.19000E+00 ppm1 4.998 ppm2 4.445 ASSI ( (segid " " and resid "37 " and name "HG2 ") )( (segid " " and resid "37 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10491 weight 0.10000E+01 volume -0.12990E+01 ppm1 1.384 ppm2 1.966 ASSI ( (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") )( (segid " " and resid "113 " and name "HG23") OR (segid " " and resid "113 " and name "HG22") OR (segid " " and resid "113 " and name "HG21") ) 3.300 3.300 0.000 peak 10492 weight 0.10000E+01 volume -0.20560E+01 ppm1 1.193 ppm2 0.739 ASSI ( (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") )( (segid " " and resid "133 " and name "HB1 ") OR (segid " " and resid "103 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10493 weight 0.10000E+01 volume -0.37200E+00 ppm1 1.193 ppm2 2.927 ASSI ( (segid " " and resid "30 " and name "HD13") OR (segid " " and resid "30 " and name "HD12") OR (segid " " and resid "30 " and name "HD11") )( (segid " " and resid "58 " and name "HA ") OR (segid " " and resid "26 " and name "HA ") ) 6.000 6.000 0.000 peak 10494 weight 0.10000E+01 volume -0.25700E+00 ppm1 0.666 ppm2 3.395 ASSI ( (segid " " and resid "63 " and name "HD13") OR (segid " " and resid "63 " and name "HD12") OR (segid " " and resid "63 " and name "HD11") OR (segid " " and resid "30 " and name "HD13") OR (segid " " and resid "30 " and name "HD12") )( (segid " " and resid "60 " and name "HA ") OR (segid " " and resid "27 " and name "HA ") ) 5.000 5.000 0.000 peak 10495 weight 0.10000E+01 volume -0.95000E+00 ppm1 0.659 ppm2 3.648 ASSI ( (segid " " and resid "115 " and name "HD13") OR (segid " " and resid "115 " and name "HD12") OR (segid " " and resid "115 " and name "HD11") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") )( (segid " " and resid "144 " and name "HD2 ") OR (segid " " and resid "85 " and name "HA ") OR (segid " " and resid "81 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10496 weight 0.10000E+01 volume -0.13200E+01 ppm1 1.219 ppm2 3.755 ASSI ( (segid " " and resid "115 " and name "HD13") OR (segid " " and resid "115 " and name "HD12") OR (segid " " and resid "115 " and name "HD11") )( (segid " " and resid "81 " and name "HA ") ) 5.000 5.000 0.000 peak 10497 weight 0.10000E+01 volume -0.13630E+01 ppm1 1.219 ppm2 3.877 ASSI ( (segid " " and resid "37 " and name "HG2 ") )( (segid " " and resid "66 " and name "HA1 ") ) 5.000 5.000 0.000 peak 10498 weight 0.10000E+01 volume -0.34900E+00 ppm1 1.395 ppm2 4.377 ASSI ( (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") )( (segid " " and resid "111 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10499 weight 0.10000E+01 volume -0.88300E+00 ppm1 1.193 ppm2 2.434 ASSI ( (segid " " and resid "121 " and name "HA ") )( (segid " " and resid "154 " and name "HG2 ") OR (segid " " and resid "154 " and name "HG1 ") OR (segid " " and resid "124 " and name "HB ") OR (segid " " and resid "119 " and name "HG2 ") ) 6.000 6.000 0.000 peak 10500 weight 0.10000E+01 volume 0.12500E+00 ppm1 5.224 ppm2 2.400 ASSI ( (segid " " and resid "65 " and name "HA ") )( (segid " " and resid "30 " and name "HD13") OR (segid " " and resid "30 " and name "HD12") OR (segid " " and resid "30 " and name "HD11") ) 6.000 6.000 0.000 peak 10501 weight 0.10000E+01 volume 0.20500E+00 ppm1 4.512 ppm2 0.659 ASSI ( (segid " " and resid "28 " and name "HG1 ") )( (segid " " and resid "28 " and name "HD2 ") ) 5.000 5.000 0.000 peak 10502 weight 0.10000E+01 volume -0.10290E+01 ppm1 1.673 ppm2 3.021 ASSI ( (segid " " and resid "115 " and name "HD13") OR (segid " " and resid "115 " and name "HD12") OR (segid " " and resid "115 " and name "HD11") )( (segid " " and resid "112 " and name "HA ") ) 5.000 5.000 0.000 peak 10503 weight 0.10000E+01 volume -0.94600E+00 ppm1 1.218 ppm2 4.135 ASSI ( (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") )( (segid " " and resid "136 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10504 weight 0.10000E+01 volume -0.51100E+00 ppm1 1.193 ppm2 3.043 ASSI ( (segid " " and resid "28 " and name "HG2 ") )( (segid " " and resid "25 " and name "HA ") ) 6.000 6.000 0.000 peak 10505 weight 0.10000E+01 volume -0.15200E+00 ppm1 1.539 ppm2 4.658 ASSI ( (segid " " and resid "65 " and name "HA ") )( (segid " " and resid "64 " and name "HA ") OR (segid " " and resid "37 " and name "HA ") ) 6.000 6.000 0.000 peak 10506 weight 0.10000E+01 volume 0.12500E+00 ppm1 4.502 ppm2 4.100 ASSI ( (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") )( (segid " " and resid "133 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10507 weight 0.10000E+01 volume -0.32200E+00 ppm1 1.192 ppm2 2.564 ASSI ( (segid " " and resid "121 " and name "HA ") )( (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB1 ") OR (segid " " and resid "84 " and name "HB3 ") ) 6.000 6.000 0.000 peak 10508 weight 0.10000E+01 volume 0.11100E+00 ppm1 5.225 ppm2 1.493 ASSI ( (segid " " and resid "30 " and name "HD13") OR (segid " " and resid "30 " and name "HD12") OR (segid " " and resid "30 " and name "HD11") )( (segid " " and resid "37 " and name "HA ") OR (segid " " and resid "14 " and name "HA ") ) 5.000 5.000 0.000 peak 10509 weight 0.10000E+01 volume -0.38300E+00 ppm1 0.671 ppm2 4.090 ASSI ( (segid " " and resid "30 " and name "HD13") OR (segid " " and resid "30 " and name "HD12") OR (segid " " and resid "30 " and name "HD11") )( (segid " " and resid "65 " and name "HB1 ") OR (segid " " and resid "26 " and name "HB ") ) 5.000 5.000 0.000 peak 10510 weight 0.10000E+01 volume -0.79200E+00 ppm1 0.662 ppm2 2.179 ASSI ( (segid " " and resid "65 " and name "HA ") )( (segid " " and resid "64 " and name "HD1 ") OR (segid " " and resid "64 " and name "HG2 ") OR (segid " " and resid "64 " and name "HG1 ") OR (segid " " and resid "37 " and name "HG1 ") ) 6.000 6.000 0.000 peak 10511 weight 0.10000E+01 volume 0.29500E+00 ppm1 4.511 ppm2 1.662 ASSI ( (segid " " and resid "48 " and name "HD13") OR (segid " " and resid "48 " and name "HD12") OR (segid " " and resid "48 " and name "HD11") )( (segid " " and resid "67 " and name "HB3 ") OR (segid " " and resid "67 " and name "HB2 ") OR (segid " " and resid "67 " and name "HB1 ") ) 3.300 3.300 0.000 peak 10512 weight 0.10000E+01 volume -0.20280E+01 ppm1 0.819 ppm2 1.139 ASSI ( (segid " " and resid "48 " and name "HD13") OR (segid " " and resid "48 " and name "HD12") OR (segid " " and resid "48 " and name "HD11") )( (segid " " and resid "79 " and name "HA ") OR (segid " " and resid "68 " and name "HA ") ) 6.000 6.000 0.000 peak 10513 weight 0.10000E+01 volume -0.14000E+00 ppm1 0.819 ppm2 4.742 ASSI ( (segid " " and resid "24 " and name "HB2 ") )( (segid " " and resid "23 " and name "HG22") OR (segid " " and resid "23 " and name "HG21") OR (segid " " and resid "23 " and name "HG13") OR (segid " " and resid "23 " and name "HG12") OR (segid " " and resid "23 " and name "HG11") ) 5.000 5.000 0.000 peak 10515 weight 0.10000E+01 volume -0.53300E+00 ppm1 2.180 ppm2 0.926 ASSI ( (segid " " and resid "40 " and name "HA ") )( (segid " " and resid "47 " and name "HA ") OR (segid " " and resid "39 " and name "HA ") ) 6.000 6.000 0.000 peak 10516 weight 0.10000E+01 volume 0.16700E+00 ppm1 4.364 ppm2 4.035 ASSI ( (segid " " and resid "40 " and name "HA ") )( (segid " " and resid "46 " and name "HA ") ) 5.000 5.000 0.000 peak 10517 weight 0.10000E+01 volume 0.32100E+00 ppm1 4.365 ppm2 4.792 ASSI ( (segid " " and resid "45 " and name "HA ") )( (segid " " and resid "40 " and name "HD23") OR (segid " " and resid "40 " and name "HD21") ) 6.000 6.000 0.000 peak 10518 weight 0.10000E+01 volume 0.26200E+00 ppm1 4.827 ppm2 0.665 ASSI ( (segid " " and resid "40 " and name "HA ") )( (segid " " and resid "47 " and name "HB3 ") OR (segid " " and resid "47 " and name "HB2 ") OR (segid " " and resid "47 " and name "HB1 ") OR (segid " " and resid "46 " and name "HG23") OR (segid " " and resid "46 " and name "HG22") OR (segid " " and resid "46 " and name "HG21") ) 5.000 5.000 0.000 peak 10519 weight 0.10000E+01 volume 0.83700E+00 ppm1 4.364 ppm2 1.202 ASSI ( (segid " " and resid "156 " and name "HD13") OR (segid " " and resid "156 " and name "HD12") OR (segid " " and resid "156 " and name "HD11") )( (segid " " and resid "151 " and name "HD2 ") OR (segid " " and resid "121 " and name "HB2 ") ) 6.000 6.000 0.000 peak 10520 weight 0.10000E+01 volume -0.19100E+00 ppm1 1.001 ppm2 2.998 ASSI ( (segid " " and resid "45 " and name "HA ") )( (segid " " and resid "46 " and name "HG23") OR (segid " " and resid "46 " and name "HG22") OR (segid " " and resid "46 " and name "HG21") ) 5.000 5.000 0.000 peak 10521 weight 0.10000E+01 volume 0.38500E+00 ppm1 4.819 ppm2 1.183 ASSI ( (segid " " and resid "45 " and name "HA ") )( (segid " " and resid "40 " and name "HG ") OR (segid " " and resid "40 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10522 weight 0.10000E+01 volume 0.20800E+00 ppm1 4.821 ppm2 1.769 ASSI ( (segid " " and resid "40 " and name "HA ") )( (segid " " and resid "45 " and name "HG1 ") OR (segid " " and resid "39 " and name "HB3 ") OR (segid " " and resid "39 " and name "HB2 ") OR (segid " " and resid "39 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10523 weight 0.10000E+01 volume 0.22100E+00 ppm1 4.364 ppm2 1.405 ASSI ( (segid " " and resid "156 " and name "HD13") OR (segid " " and resid "156 " and name "HD12") OR (segid " " and resid "156 " and name "HD11") )( (segid " " and resid "151 " and name "HD1 ") ) 6.000 6.000 0.000 peak 10524 weight 0.10000E+01 volume -0.16900E+00 ppm1 0.993 ppm2 3.304 ASSI ( (segid " " and resid "40 " and name "HA ") )( (segid " " and resid "46 " and name "HA ") ) 5.000 5.000 0.000 peak 10525 weight 0.10000E+01 volume 0.30100E+00 ppm1 4.365 ppm2 4.751 ASSI ( (segid " " and resid "156 " and name "HD13") OR (segid " " and resid "156 " and name "HD12") OR (segid " " and resid "156 " and name "HD11") )( (segid " " and resid "148 " and name "HA ") ) 5.000 5.000 0.000 peak 10526 weight 0.10000E+01 volume -0.11410E+01 ppm1 0.992 ppm2 3.749 ASSI ( (segid " " and resid "156 " and name "HD13") OR (segid " " and resid "156 " and name "HD12") OR (segid " " and resid "156 " and name "HD11") )( (segid " " and resid "152 " and name "HA2 ") ) 5.000 5.000 0.000 peak 10527 weight 0.10000E+01 volume -0.10890E+01 ppm1 0.993 ppm2 3.874 ASSI ( (segid " " and resid "156 " and name "HD13") OR (segid " " and resid "156 " and name "HD12") OR (segid " " and resid "156 " and name "HD11") )( (segid " " and resid "152 " and name "HA1 ") OR (segid " " and resid "120 " and name "HA1 ") ) 5.000 5.000 0.000 peak 10528 weight 0.10000E+01 volume -0.10200E+01 ppm1 0.993 ppm2 4.021 ASSI ( (segid " " and resid "24 " and name "HB2 ") )( (segid " " and resid "28 " and name "HG1 ") OR (segid " " and resid "27 " and name "HG1 ") ) 6.000 6.000 0.000 peak 10529 weight 0.10000E+01 volume -0.29700E+00 ppm1 2.180 ppm2 1.700 ASSI ( (segid " " and resid "137 " and name "HA ") )( (segid " " and resid "143 " and name "HA ") ) 5.000 5.000 0.000 peak 10531 weight 0.10000E+01 volume 0.43300E+00 ppm1 4.224 ppm2 5.384 ASSI ( (segid " " and resid "142 " and name "HA ") )( (segid " " and resid "146 " and name "HB2 ") OR (segid " " and resid "146 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10532 weight 0.10000E+01 volume 0.60800E+00 ppm1 4.980 ppm2 2.153 ASSI ( (segid " " and resid "137 " and name "HA ") )( (segid " " and resid "144 " and name "HD2 ") OR (segid " " and resid "144 " and name "HA ") OR (segid " " and resid "141 " and name "HA2 ") ) 5.000 5.000 0.000 peak 10533 weight 0.10000E+01 volume 0.33000E+00 ppm1 4.229 ppm2 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") )( (segid " " and resid "130 " and name "HA ") OR (segid " " and resid "97 " and name "HA ") ) 6.000 6.000 0.000 peak 10538 weight 0.10000E+01 volume 0.20100E+00 ppm1 4.560 ppm2 4.136 ASSI ( (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") OR (segid " " and resid "92 " and name "HD11") )( (segid " " and resid "124 " and name "HB ") OR (segid " " and resid "97 " and name "HG1 ") ) 6.000 6.000 0.000 peak 10542 weight 0.10000E+01 volume -0.27600E+00 ppm1 0.963 ppm2 2.392 ASSI ( (segid " " and resid "139 " and name "HA ") OR (segid " " and resid "17 " and name "HA ") )( (segid " " and resid "138 " and name "HA ") OR (segid " " and resid "108 " and name "HA ") OR (segid " " and resid "25 " and name "HA ") ) 6.000 6.000 0.000 peak 10543 weight 0.10000E+01 volume 0.24200E+00 ppm1 4.128 ppm2 4.604 ASSI ( (segid " " and resid "116 " and name "HA ") OR (segid " " and resid "17 " and name "HA ") )( (segid " " and resid "128 " and name "HD12") OR (segid 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resid "117 " and name "HG12") ) 3.300 3.300 0.000 peak 10550 weight 0.10000E+01 volume -0.23690E+01 ppm1 1.193 ppm2 0.766 ASSI ( (segid " " and resid "27 " and name "HG2 ") )( (segid " " and resid "26 " and name "HG13") OR (segid " " and resid "26 " and name "HG12") OR (segid " " and resid "26 " and name "HG11") OR (segid " " and resid "23 " and name "HG23") OR (segid " " and resid "23 " and name "HG21") ) 5.000 5.000 0.000 peak 10551 weight 0.10000E+01 volume -0.87400E+00 ppm1 1.496 ppm2 0.933 ASSI ( (segid " " and resid "147 " and name "HD13") OR (segid " " and resid "147 " and name "HD12") OR (segid " " and resid "147 " and name "HD11") )( (segid " " and resid "150 " and name "HB1 ") OR (segid " " and resid "146 " and name "HG1 ") OR (segid " " and resid "119 " and name "HG2 ") OR (segid " " and resid "111 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10552 weight 0.10000E+01 volume -0.23700E+00 ppm1 1.193 ppm2 2.394 ASSI ( (segid " " and resid "27 " and name "HG1 ") )( (segid " " and 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0.10000E+01 volume -0.20900E+00 ppm1 0.549 ppm2 1.782 ASSI ( (segid " " and resid "116 " and name "HA ") OR (segid " " and resid "17 " and name "HA ") )( (segid " " and resid "125 " and name "HA ") OR (segid " " and resid "26 " and name "HA ") OR (segid " " and resid "20 " and name "HD1 ") ) 5.000 5.000 0.000 peak 10570 weight 0.10000E+01 volume 0.31400E+00 ppm1 4.136 ppm2 3.370 ASSI ( (segid " " and resid "51 " and name "HA ") )( (segid " " and resid "51 " and name "HE3 ") OR (segid " " and resid "51 " and name "HE2 ") OR (segid " " and resid "51 " and name "HE1 ") ) 6.000 6.000 0.000 peak 10571 weight 0.10000E+01 volume 0.12500E+00 ppm1 3.441 ppm2 1.684 ASSI ( (segid " " and resid "144 " and name "HG1 ") OR (segid " " and resid "13 " and name "HG2 ") )( (segid " " and resid "134 " and name "HA ") OR (segid " " and resid "10 " and name "HA ") ) 5.000 5.000 0.000 peak 10572 weight 0.10000E+01 volume -0.84800E+00 ppm1 1.684 ppm2 3.885 ASSI ( (segid " " and resid "112 " and name "HG1 ") 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5.000 5.000 0.000 peak 10597 weight 0.10000E+01 volume 0.85700E+00 ppm1 3.725 ppm2 1.556 ASSI ( (segid " " and resid "128 " and name "HA ") OR (segid " " and resid "18 " and name "HA ") )( (segid " " and resid "102 " and name "HB ") OR (segid " " and resid "52 " and name "HB1 ") OR (segid " " and resid "26 " and name "HB ") ) 5.000 5.000 0.000 peak 10598 weight 0.10000E+01 volume 0.40300E+00 ppm1 3.831 ppm2 2.174 ASSI ( (segid " " and resid "118 " and name "HG2 ") )( (segid " " and resid "150 " and name "HB1 ") OR (segid " " and resid "119 " and name "HG2 ") ) 5.000 5.000 0.000 peak 10599 weight 0.10000E+01 volume -0.30600E+00 ppm1 1.618 ppm2 2.423 ASSI ( (segid " " and resid "118 " and name "HG2 ") )( (segid " " and resid "147 " and name "HD13") OR (segid " " and resid "147 " and name "HD11") ) 5.000 5.000 0.000 peak 10600 weight 0.10000E+01 volume -0.11070E+01 ppm1 1.620 ppm2 1.193 ASSI ( (segid " " and resid "83 " and name "HA ") )( (segid " " and resid "53 " and name "HD2 ") OR (segid " " and resid "53 " and name "HD1 ") ) 5.000 5.000 0.000 peak 10601 weight 0.10000E+01 volume 0.44400E+00 ppm1 3.801 ppm2 7.195 ASSI ( (segid " " and resid "134 " and name "HA ") OR (segid " " and resid "128 " and name "HA ") OR (segid " " and resid "83 " and name "HA ") OR (segid " " and resid "18 " and name "HA ") )( (segid " " and resid "144 " and name "HD1 ") OR (segid " " and resid "127 " and name "HA ") OR (segid " " and resid "86 " and name "HA ") OR (segid " " and resid "21 " and name "HA1 ") OR (segid " " and resid "19 " and name "HA ") ) 5.000 5.000 0.000 peak 10602 weight 0.10000E+01 volume 0.63500E+00 ppm1 3.846 ppm2 4.289 ASSI ( (segid " " and resid "83 " and name "HA ") OR (segid " " and resid "18 " and name "HA ") )( (segid " " and resid "88 " and name "HB2 ") OR (segid " " and resid "87 " and name "HA2 ") OR (segid " " and resid "52 " and name "HG2 ") ) 6.000 6.000 0.000 peak 10603 weight 0.10000E+01 volume 0.26300E+00 ppm1 3.805 ppm2 2.543 ASSI ( (segid " " and resid "128 " and name "HA ") )( (segid " " and resid "131 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10604 weight 0.10000E+01 volume 0.45900E+00 ppm1 3.845 ppm2 2.311 ASSI ( (segid " " and resid "150 " and name "HB1 ") )( (segid " " and resid "147 " and name "HD23") OR (segid " " and resid "147 " and name "HD22") OR (segid " " and resid "147 " and name "HD21") ) 5.000 5.000 0.000 peak 10605 weight 0.10000E+01 volume -0.81700E+00 ppm1 2.407 ppm2 1.033 ASSI ( (segid " " and resid "83 " and name "HA ") )( (segid " " and resid "88 " and name "HD2 ") OR (segid " " and resid "88 " and name "HD1 ") ) 6.000 6.000 0.000 peak 10606 weight 0.10000E+01 volume 0.16600E+00 ppm1 3.800 ppm2 7.440 ASSI ( (segid " " and resid "128 " and name "HA ") )( (segid " " and resid "127 " and name "HD2 ") OR (segid " " and resid "127 " and name "HD1 ") ) 6.000 6.000 0.000 peak 10607 weight 0.10000E+01 volume 0.24200E+00 ppm1 3.864 ppm2 7.121 ASSI ( (segid " " and resid "134 " and name "HA ") )( (segid " " and resid "143 " and name "HB ") OR (segid " " and resid "135 " and name "HA ") OR (segid " " and resid "133 " and name "HA ") ) 6.000 6.000 0.000 peak 10608 weight 0.10000E+01 volume 0.18000E+00 ppm1 3.872 ppm2 4.703 ASSI ( (segid " " and resid "148 " and name "HA ") )( (segid " " and resid "117 " and name "HG23") OR (segid " " and resid "117 " and name "HG22") OR (segid " " and resid "117 " and name "HG21") ) 3.300 3.300 0.000 peak 10609 weight 0.10000E+01 volume 0.27740E+01 ppm1 3.752 ppm2 0.775 ASSI ( (segid " " and resid "148 " and name "HA ") )( (segid " " and resid "151 " and name "HG2 ") OR (segid " " and resid "151 " and name "HG1 ") OR (segid " " and resid "151 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10610 weight 0.10000E+01 volume 0.13900E+01 ppm1 3.749 ppm2 1.796 ASSI ( (segid " " and resid "150 " and name "HB2 ") OR (segid " " and resid "65 " and name "HB1 ") )( (segid " " and resid "142 " and name "HD23") OR (segid " " and resid "142 " and name "HD22") OR (segid " " and resid "30 " and name "HD23") OR (segid " " and resid "30 " and name "HD22") OR (segid " " and resid "30 " and name "HD21") ) 5.000 5.000 0.000 peak 10611 weight 0.10000E+01 volume -0.79800E+00 ppm1 2.180 ppm2 0.766 ASSI ( (segid " " and resid "154 " and name "HB1 ") OR (segid " " and resid "150 " and name "HB2 ") OR (segid " " and resid "65 " and name "HB1 ") )( (segid " " and resid "159 " and name "HD13") OR (segid " " and resid "159 " and name "HD12") OR (segid " " and resid "159 " and name "HD11") OR (segid " " and resid "142 " and name "HD13") OR (segid " " and resid "142 " and name "HD12") OR (segid " " and resid "142 " and name "HD11") OR (segid " " and resid "62 " and name "HD23") OR (segid " " and resid "62 " and name "HD22") OR (segid " " and resid "62 " and name "HD21") ) 5.000 5.000 0.000 peak 10612 weight 0.10000E+01 volume -0.11130E+01 ppm1 2.184 ppm2 0.912 ASSI ( (segid " " and resid "65 " and name "HB1 ") )( (segid " " and resid "37 " and name "HD1 ") ) 6.000 6.000 0.000 peak 10613 weight 0.10000E+01 volume -0.14200E+00 ppm1 2.180 ppm2 3.301 ASSI ( (segid " " and resid "154 " and name "HB1 ") OR (segid " " and resid "65 " and name "HB1 ") )( (segid " " and resid "152 " and name "HA2 ") OR (segid " " and resid "63 " and name "HA ") ) 5.000 5.000 0.000 peak 10614 weight 0.10000E+01 volume -0.37900E+00 ppm1 2.153 ppm2 3.861 ASSI ( (segid " " and resid "65 " and name "HB1 ") )( (segid " " and resid "30 " and name "HD13") OR (segid " " and resid "30 " and name "HD12") ) 5.000 5.000 0.000 peak 10615 weight 0.10000E+01 volume -0.53300E+00 ppm1 2.180 ppm2 0.676 ASSI ( (segid " " and resid "135 " and name "HA ") )( (segid " " and resid "143 " and name "HG23") OR (segid " " and resid "143 " and name "HG22") OR (segid " " and resid "143 " and name "HG21") ) 5.000 5.000 0.000 peak 10616 weight 0.10000E+01 volume 0.14520E+01 ppm1 4.717 ppm2 1.253 ASSI ( (segid " " and resid "65 " and name "HB2 ") )( (segid " " and resid "30 " and name "HD23") OR (segid " " and resid "30 " and name "HD22") OR (segid " " and resid "30 " and name "HD21") ) 5.000 5.000 0.000 peak 10617 weight 0.10000E+01 volume -0.11510E+01 ppm1 2.039 ppm2 0.783 ASSI ( (segid " " and resid "33 " and name "HB1 ") )( (segid " " and resid "29 " and name "HD23") OR (segid " " and resid "29 " and name "HD22") OR (segid " " and resid "29 " and name "HD21") ) 5.000 5.000 0.000 peak 10618 weight 0.10000E+01 volume -0.52300E+00 ppm1 2.418 ppm2 0.768 ASSI ( (segid " " and resid "97 " and name "HB2 ") OR (segid " " and resid "65 " and name "HB2 ") )( (segid " " and resid "93 " and name "HG2 ") OR (segid " " and resid "30 " and name "HD12") OR (segid " " and resid "30 " and name "HD11") ) 5.000 5.000 0.000 peak 10619 weight 0.10000E+01 volume -0.12520E+01 ppm1 2.034 ppm2 0.671 ASSI ( (segid " " and resid "33 " and name "HB1 ") )( (segid " " and resid "35 " and name "HG23") OR (segid " " and resid "35 " and name "HG22") OR (segid " " and resid "35 " and name "HG13") OR (segid " " and resid "35 " and name "HG12") ) 5.000 5.000 0.000 peak 10620 weight 0.10000E+01 volume -0.85400E+00 ppm1 2.417 ppm2 0.975 ASSI ( (segid " " and resid "33 " and name "HB2 ") )( (segid " " and resid "29 " and name "HD23") OR (segid " " and resid "29 " and name "HD22") OR (segid " " and resid "29 " and name "HD21") ) 5.000 5.000 0.000 peak 10621 weight 0.10000E+01 volume -0.73900E+00 ppm1 2.326 ppm2 0.767 ASSI ( (segid " " and resid "33 " and name "HB2 ") )( (segid " " and resid "35 " and name "HG22") OR (segid " " and resid "35 " and name "HG13") OR (segid " " and resid "35 " and name "HG12") ) 5.000 5.000 0.000 peak 10622 weight 0.10000E+01 volume -0.11940E+01 ppm1 2.330 ppm2 0.980 ASSI ( (segid " " and resid "33 " and name "HB1 ") )( (segid " " and resid "29 " and name "HB2 ") OR (segid " " and resid "10 " and name "HG13") OR (segid " " and resid "10 " and name "HG12") OR (segid " " and resid "10 " and name "HG11") ) 5.000 5.000 0.000 peak 10623 weight 0.10000E+01 volume -0.35400E+00 ppm1 2.394 ppm2 1.139 ASSI ( (segid " " and resid "33 " and name "HB1 ") )( (segid " " and resid "29 " and name "HA ") ) 5.000 5.000 0.000 peak 10624 weight 0.10000E+01 volume -0.58600E+00 ppm1 2.410 ppm2 3.896 ASSI ( (segid " " and resid "33 " and name "HB2 ") )( (segid " " and resid "33 " and name "HA ") ) 5.000 5.000 0.000 peak 10625 weight 0.10000E+01 volume -0.41200E+00 ppm1 2.319 ppm2 4.456 ASSI ( (segid " " and resid "164 " and name "HA ") OR (segid " " and resid "20 " and name "HA ") )( (segid " " and resid "161 " and name "HA ") OR (segid " " and resid "55 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10626 weight 0.10000E+01 volume 0.27100E+00 ppm1 4.506 ppm2 4.018 ASSI ( (segid " " and resid "164 " and name "HA ") OR (segid " " and resid "20 " and name "HA ") )( (segid " " and resid "130 " and name "HA ") OR (segid " " and resid "17 " and name "HA ") ) 5.000 5.000 0.000 peak 10627 weight 0.10000E+01 volume 0.32700E+00 ppm1 4.510 ppm2 4.151 ASSI ( (segid " " and resid "151 " and name "HA ") )( (segid " " and resid "157 " and name "HA ") OR (segid " " and resid "148 " and name "HA ") ) 6.000 6.000 0.000 peak 10628 weight 0.10000E+01 volume 0.18600E+00 ppm1 4.285 ppm2 3.748 ASSI ( (segid " " and resid "151 " and name "HA ") )( (segid " " and resid "156 " and name "HD13") OR (segid " " and resid "156 " and name "HD12") OR (segid " " and resid "156 " and name "HD11") OR (segid " " and resid "147 " and name "HD23") OR (segid " " and resid "147 " and name "HD22") OR (segid " " and resid "147 " and name "HD21") ) 6.000 6.000 0.000 peak 10629 weight 0.10000E+01 volume 0.23700E+00 ppm1 4.295 ppm2 1.037 ASSI ( (segid " " and resid "151 " and name "HA ") )( (segid " " and resid "157 " and name "HG2 ") OR (segid " " and resid "150 " and name "HG2 ") ) 5.000 5.000 0.000 peak 10630 weight 0.10000E+01 volume 0.46500E+00 ppm1 4.293 ppm2 2.341 ASSI ( (segid " " and resid "151 " and name "HA ") )( (segid " " and resid "153 " and name "HB3 ") OR (segid " " and resid "153 " and name "HB2 ") OR (segid " " and resid "153 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10631 weight 0.10000E+01 volume 0.34800E+00 ppm1 4.296 ppm2 1.380 ASSI ( (segid " " and resid "68 " and name "HA ") )( (segid " " and resid "71 " and name "HG11") OR (segid " " and resid "63 " and name "HD23") OR (segid " " and resid "63 " and name "HD22") OR (segid " " and resid "63 " and name "HD21") OR (segid " " and resid "48 " and name "HD13") OR (segid " " and resid "48 " and name "HD12") OR (segid " " and resid "48 " and name "HD11") ) 5.000 5.000 0.000 peak 10632 weight 0.10000E+01 volume 0.36600E+00 ppm1 4.753 ppm2 0.815 ASSI ( (segid " " and resid "164 " and name "HA ") OR (segid " " and resid "20 " and name "HA ") )( (segid " " and resid "166 " and name "HG11") OR (segid " " and resid "134 " and name "HB2 ") OR (segid " " and resid "19 " and name "HB3 ") OR (segid " " and resid "19 " and name "HB2 ") OR (segid " " and resid "19 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10633 weight 0.10000E+01 volume 0.49600E+00 ppm1 4.501 ppm2 1.571 ASSI ( (segid " " and resid "135 " and name "HA ") OR (segid " " and resid "68 " and name "HA ") )( (segid " " and resid "164 " and name "HE3 ") OR (segid " " and resid "164 " and name "HE2 ") OR (segid " " and resid "164 " and name "HE1 ") OR (segid " " and resid "164 " and name "HB2 ") OR (segid " " and resid "134 " and name "HG ") OR (segid " " and resid "69 " and name "HB1 ") OR (segid " " and resid "37 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10634 weight 0.10000E+01 volume 0.52800E+00 ppm1 4.764 ppm2 1.950 ASSI ( (segid " " and resid "64 " and name "HD2 ") OR (segid " " and resid "64 " and name "HD1 ") )( (segid " " and resid "60 " and name "HD23") OR (segid " " and resid "60 " and name "HD22") OR (segid " " and resid "60 " and name "HD21") ) 3.300 3.300 0.000 peak 10635 weight 0.10000E+01 volume -0.21060E+01 ppm1 1.697 ppm2 0.957 ASSI ( (segid " " and resid "164 " and name "HA ") OR (segid " " and resid "20 " and name "HA ") )( (segid " " and resid "134 " and name "HD13") OR (segid " " and resid "134 " and name "HD12") OR (segid " " and resid "134 " and name "HD11") OR (segid " " and resid "58 " and name "HG13") ) 5.000 5.000 0.000 peak 10636 weight 0.10000E+01 volume 0.80900E+00 ppm1 4.504 ppm2 0.925 ASSI ( (segid " " and resid "135 " and name "HA ") OR (segid " " and resid "68 " and name "HA ") )( (segid " " and resid "144 " and name "HB2 ") OR (segid " " and resid "69 " and name "HG2 ") ) 5.000 5.000 0.000 peak 10637 weight 0.10000E+01 volume 0.42100E+00 ppm1 4.766 ppm2 1.814 ASSI ( (segid " " and resid "135 " and name "HA ") OR (segid " " and resid "68 " and name "HA ") )( (segid " " and resid "165 " and name "HB2 ") OR (segid " " and resid "146 " and name "HB2 ") OR (segid " " and resid "69 " and name "HG1 ") ) 5.000 5.000 0.000 peak 10638 weight 0.10000E+01 volume 0.46600E+00 ppm1 4.766 ppm2 2.120 ASSI ( (segid " " and resid "25 " and name "HB1 ") )( (segid " " and resid "25 " and name "HA ") ) 5.000 5.000 0.000 peak 10639 weight 0.10000E+01 volume -0.39300E+00 ppm1 1.958 ppm2 4.627 ASSI ( (segid " " and resid "36 " and name "HA ") )( (segid " " and resid "30 " and name "HD23") OR (segid " " and resid "30 " and name "HD22") OR (segid " " and resid "30 " and name "HD21") ) 6.000 6.000 0.000 peak 10640 weight 0.10000E+01 volume 0.24900E+00 ppm1 4.375 ppm2 0.765 ASSI ( (segid " " and resid "164 " and name "HA ") OR (segid " " and resid "155 " and name "HA ") )( (segid " " and resid "164 " and name "HG1 ") OR (segid " " and resid "158 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10641 weight 0.10000E+01 volume 0.11230E+01 ppm1 4.476 ppm2 2.664 ASSI ( (segid " " and resid "98 " and name "HB2 ") )( (segid " " and resid "63 " and name "HD23") OR (segid " " and resid "63 " and name "HD22") OR (segid " " and resid "63 " and name "HD21") ) 6.000 6.000 0.000 peak 10642 weight 0.10000E+01 volume -0.18600E+00 ppm1 2.858 ppm2 0.824 ASSI ( (segid " " and resid "93 " and name "HD2 ") OR (segid " " and resid "93 " and name "HD1 ") )( (segid " " and resid "124 " and name "HB ") OR (segid " " and resid "96 " and name "HB ") ) 6.000 6.000 0.000 peak 10643 weight 0.10000E+01 volume -0.20200E+00 ppm1 1.451 ppm2 2.357 ASSI ( (segid " " and resid "113 " and name "HG11") OR (segid " " and resid "93 " and name "HD2 ") OR (segid " " and resid "93 " and name "HD1 ") )( (segid " " and resid "125 " and name "HG21") OR (segid " " and resid "89 " and name "HD13") OR (segid " " and resid "89 " and name "HD12") OR (segid " " and resid "89 " and name "HD11") ) 5.000 5.000 0.000 peak 10644 weight 0.10000E+01 volume -0.14340E+01 ppm1 1.452 ppm2 0.834 ASSI ( (segid " " and resid "93 " and name "HD2 ") OR (segid " " and resid "93 " and name "HD1 ") )( (segid " " and resid "127 " and name "HZ ") ) 6.000 6.000 0.000 peak 10645 weight 0.10000E+01 volume -0.17000E+00 ppm1 1.448 ppm2 7.324 ASSI ( (segid " " and resid "121 " and name "HB1 ") )( (segid " " and resid "124 " and name "HB ") ) 5.000 5.000 0.000 peak 10646 weight 0.10000E+01 volume -0.36500E+00 ppm1 3.139 ppm2 2.397 ASSI ( (segid " " and resid "121 " and name "HB2 ") )( (segid " " and resid "124 " and name "HG23") OR (segid " " and resid "124 " and name "HG21") OR (segid " " and resid "124 " and name "HG13") OR (segid " " and resid "124 " and name "HG11") ) 5.000 5.000 0.000 peak 10647 weight 0.10000E+01 volume -0.74300E+00 ppm1 3.007 ppm2 0.957 ASSI ( (segid " " and resid "121 " and name "HB2 ") )( (segid " " and resid "124 " and name "HB ") ) 5.000 5.000 0.000 peak 10648 weight 0.10000E+01 volume -0.37100E+00 ppm1 3.019 ppm2 2.396 ASSI ( (segid " " and resid "121 " and name "HB2 ") )( (segid " " and resid "87 " and name "HA2 ") ) 6.000 6.000 0.000 peak 10649 weight 0.10000E+01 volume -0.25200E+00 ppm1 3.003 ppm2 2.596 ASSI ( (segid " " and resid "121 " and name "HB1 ") )( (segid " " and resid "124 " and name "HG23") OR (segid " " and resid "124 " and name "HG22") OR (segid " " and resid "124 " and name "HG21") ) 5.000 5.000 0.000 peak 10650 weight 0.10000E+01 volume -0.62100E+00 ppm1 3.140 ppm2 0.953 ASSI ( (segid " " and resid "48 " and name "HA ") )( (segid " " and resid "62 " and name "HD13") OR (segid " " and resid "62 " and name "HD12") OR (segid " " and resid "62 " and name "HD11") ) 5.000 5.000 0.000 peak 10652 weight 0.10000E+01 volume 0.12080E+01 ppm1 3.783 ppm2 0.695 ASSI ( (segid " " and resid "151 " and name "HB2 ") )( (segid " " and resid "153 " and name "HB3 ") OR (segid " " and resid "153 " and name "HB2 ") OR (segid " " and resid "153 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10653 weight 0.10000E+01 volume -0.81500E+00 ppm1 1.803 ppm2 1.366 ASSI ( (segid " " and resid "48 " and name "HA ") )( (segid " " and resid "51 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10654 weight 0.10000E+01 volume 0.40700E+00 ppm1 3.785 ppm2 1.976 ASSI ( (segid " " and resid "48 " and name "HA ") )( (segid " " and resid "62 " and name "HD23") OR (segid " " and resid "62 " and name "HD22") OR (segid " " and resid "62 " and name "HD21") OR (segid " " and resid "50 " and name "HG23") OR (segid " " and resid "50 " and name "HG22") ) 5.000 5.000 0.000 peak 10655 weight 0.10000E+01 volume 0.58200E+00 ppm1 3.788 ppm2 0.927 ASSI ( (segid " " and resid "48 " and name "HA ") )( (segid " " and resid "51 " and name "HG2 ") ) 5.000 5.000 0.000 peak 10656 weight 0.10000E+01 volume 0.45500E+00 ppm1 3.780 ppm2 1.172 ASSI ( (segid " " and resid "48 " and name "HA ") )( (segid " " and resid "51 " and name "HG1 ") ) 6.000 6.000 0.000 peak 10657 weight 0.10000E+01 volume 0.26000E+00 ppm1 3.784 ppm2 2.334 ASSI ( (segid " " and resid "51 " and name "HG1 ") )( (segid " " and resid "62 " and name "HD23") OR (segid " " and resid "62 " and name "HD22") OR (segid " " and resid "58 " and name "HG23") OR (segid " " and resid "58 " and name "HG13") OR (segid " " and resid "58 " and name "HG12") OR (segid " " and resid "58 " and name "HG11") OR (segid " " and resid "50 " and name "HG21") ) 5.000 5.000 0.000 peak 10658 weight 0.10000E+01 volume -0.69100E+00 ppm1 2.323 ppm2 0.953 ASSI ( (segid " " and resid "6 " and name "HA ") )( (segid " " and resid "5 " and name "HG ") OR (segid " " and resid "5 " and name "HB2 ") OR (segid " " and resid "5 " and name "HB1 ") OR (segid " " and resid "4 " and name "HG ") OR (segid " " and resid "4 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10659 weight 0.10000E+01 volume 0.49500E+00 ppm1 4.283 ppm2 1.664 ASSI ( (segid " " and resid "51 " and name "HG2 ") )( (segid " " and resid "18 " and name "HB3 ") OR (segid " " and resid "18 " and name "HB2 ") OR (segid " " and resid "18 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10660 weight 0.10000E+01 volume -0.79500E+00 ppm1 1.192 ppm2 1.304 ASSI ( (segid " " and resid "51 " and name "HG2 ") )( (segid " " and resid "51 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10661 weight 0.10000E+01 volume -0.87700E+00 ppm1 1.188 ppm2 1.447 ASSI ( (segid " " and resid "51 " and name "HG2 ") )( (segid " " and resid "51 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10662 weight 0.10000E+01 volume -0.11470E+01 ppm1 1.180 ppm2 1.956 ASSI ( (segid " " and resid "51 " and name "HG2 ") )( (segid " " and resid "63 " and name "HA ") OR (segid " " and resid "53 " and name "HA ") ) 6.000 6.000 0.000 peak 10663 weight 0.10000E+01 volume -0.29300E+00 ppm1 1.186 ppm2 3.904 ASSI ( (segid " " and resid "33 " and name "HA ") )( (segid " " and resid "29 " and name "HD23") OR (segid " " and resid "29 " and name "HD22") OR (segid " " and resid "29 " and name "HD21") OR (segid " " and resid "29 " and name "HD13") OR (segid " " and resid "29 " and name "HD11") ) 6.000 6.000 0.000 peak 10664 weight 0.10000E+01 volume 0.22300E+00 ppm1 4.468 ppm2 0.774 ASSI ( (segid " " and resid "113 " and name "HG12") )( (segid " " and resid "117 " and name "HD13") OR (segid " " and resid "117 " and name "HD12") OR (segid " " and resid "117 " and name "HD11") ) 5.000 5.000 0.000 peak 10665 weight 0.10000E+01 volume -0.82500E+00 ppm1 1.326 ppm2 0.891 ASSI ( (segid " " and resid "121 " and name "HB2 ") )( (segid " " and resid "116 " and name "HA ") ) 6.000 6.000 0.000 peak 10666 weight 0.10000E+01 volume -0.14800E+00 ppm1 3.010 ppm2 4.170 ASSI ( (segid " " and resid "93 " and name "HD2 ") OR (segid " " and resid "93 " and name "HD1 ") )( (segid " " and resid "127 " and name "HD2 ") OR (segid " " and resid "127 " and name "HD1 ") ) 6.000 6.000 0.000 peak 10667 weight 0.10000E+01 volume -0.13800E+00 ppm1 1.445 ppm2 7.120 ASSI ( (segid " " and resid "32 " and name "HA ") )( (segid " " and resid "34 " and name "HB1 ") OR (segid " " and resid "28 " and name "HB2 ") OR (segid " " and resid "28 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10668 weight 0.10000E+01 volume 0.40800E+00 ppm1 4.668 ppm2 1.971 ASSI ( (segid " " and resid "33 " and name "HA ") )( (segid " " and resid "29 " and name "HA ") ) 6.000 6.000 0.000 peak 10669 weight 0.10000E+01 volume 0.21500E+00 ppm1 4.464 ppm2 3.897 ASSI ( (segid " " and resid "33 " and name "HA ") )( (segid " " and resid "35 " and name "HG23") OR (segid " " and resid "35 " and name "HG22") OR (segid " " and resid "35 " and name "HG21") OR (segid " " and resid "35 " and name "HG13") OR (segid " " and resid "35 " and name "HG12") OR (segid " " and resid "35 " and name "HG11") OR (segid " " and resid "34 " and name "HD13") OR (segid " " and resid "34 " and name "HD12") ) 5.000 5.000 0.000 peak 10670 weight 0.10000E+01 volume 0.41800E+00 ppm1 4.471 ppm2 0.956 ASSI ( (segid " " and resid "51 " and name "HG1 ") )( (segid " " and resid "79 " and name "HB2 ") OR (segid " " and resid "51 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10671 weight 0.10000E+01 volume -0.15630E+01 ppm1 2.328 ppm2 1.954 ASSI ( (segid " " and resid "51 " and name "HG1 ") )( (segid " " and resid "18 " and name "HB2 ") OR (segid " " and resid "18 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10672 weight 0.10000E+01 volume -0.42500E+00 ppm1 2.330 ppm2 1.327 ASSI ( (segid " " and resid "33 " and name "HA ") )( (segid " " and resid "32 " and name "HG1 ") OR (segid " " and resid "29 " and name "HG ") OR (segid " " and resid "13 " and name "HG1 ") ) 6.000 6.000 0.000 peak 10673 weight 0.10000E+01 volume 0.11600E+00 ppm1 4.449 ppm2 1.815 ASSI ( (segid " " and resid "118 " and name "HB2 ") )( (segid " " and resid "147 " and name "HD13") OR (segid " " and resid "147 " and name "HD12") OR (segid " " and resid "147 " and name "HD11") ) 5.000 5.000 0.000 peak 10674 weight 0.10000E+01 volume -0.10470E+01 ppm1 2.068 ppm2 1.195 ASSI ( (segid " " and resid "156 " and name "HA ") )( (segid " " and resid "159 " and name "HA ") OR (segid " " and resid "148 " and name "HA ") ) 5.000 5.000 0.000 peak 10675 weight 0.10000E+01 volume 0.35500E+00 ppm1 4.155 ppm2 3.771 ASSI ( (segid " " and resid "113 " and name "HG11") OR (segid " " and resid "45 " and name "HD2 ") )( (segid " " and resid "117 " and name "HD13") OR (segid " " and resid "117 " and name "HD12") OR (segid " " and resid "117 " and name "HD11") OR (segid " " and resid "50 " and name "HG13") OR (segid " " and resid "50 " and name "HG12") ) 5.000 5.000 0.000 peak 10676 weight 0.10000E+01 volume -0.17500E+01 ppm1 1.478 ppm2 0.859 ASSI ( (segid " " and resid "27 " and name "HB2 ") OR (segid " " and resid "27 " and name "HB1 ") )( (segid " " and resid "61 " and name "HG1 ") ) 5.000 5.000 0.000 peak 10677 weight 0.10000E+01 volume -0.66000E+00 ppm1 1.886 ppm2 2.420 ASSI ( (segid " " and resid "156 " and name "HA ") )( (segid " " and resid "153 " and name "HB3 ") OR (segid " " and resid "153 " and name "HB2 ") OR (segid " " and resid "148 " and name "HB3 ") OR (segid " " and resid "148 " and name "HB2 ") OR (segid " " and resid "148 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10678 weight 0.10000E+01 volume 0.46400E+00 ppm1 4.146 ppm2 1.401 ASSI ( (segid " " and resid "156 " and name "HA ") )( (segid " " and resid "159 " and name "HD13") OR (segid " " and resid "159 " and name "HD12") OR (segid " " and resid "159 " and name "HD11") ) 3.300 3.300 0.000 peak 10679 weight 0.10000E+01 volume 0.22920E+01 ppm1 4.156 ppm2 0.901 ASSI ( (segid " " and resid "156 " and name "HA ") )( (segid " " and resid "152 " and name "HA2 ") OR (segid " " and resid "126 " and name "HB2 ") OR (segid " " and resid "126 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10680 weight 0.10000E+01 volume 0.33800E+00 ppm1 4.150 ppm2 3.881 ASSI ( (segid " " and resid "149 " and name "HB2 ") OR (segid " " and resid "112 " and name "HB2 ") OR (segid " " and resid "27 " and name "HB2 ") OR (segid " " and resid "27 " and name "HB1 ") )( (segid " " and resid "146 " and name "HA ") OR (segid " " and resid "112 " and name "HD2 ") OR (segid " " and resid "24 " and name "HA ") ) 3.300 3.300 0.000 peak 10681 weight 0.10000E+01 volume -0.22070E+01 ppm1 1.886 ppm2 4.006 ASSI ( (segid " " and resid "156 " and name "HA ") )( (segid " " and resid "157 " and name "HB1 ") OR (segid " " and resid "125 " and name "HB ") ) 5.000 5.000 0.000 peak 10682 weight 0.10000E+01 volume 0.30200E+00 ppm1 4.153 ppm2 2.249 ASSI ( (segid " " and resid "45 " and name "HD1 ") )( (segid " " and resid "50 " and name "HG13") OR (segid " " and resid "50 " and name "HG12") OR (segid " " and resid "50 " and name "HG11") ) 5.000 5.000 0.000 peak 10683 weight 0.10000E+01 volume -0.78100E+00 ppm1 1.583 ppm2 0.861 ASSI ( (segid " " and resid "28 " and name "HB2 ") OR (segid " " and resid "28 " and name "HB1 ") )( (segid " " and resid "25 " and name "HA ") ) 5.000 5.000 0.000 peak 10684 weight 0.10000E+01 volume -0.54400E+00 ppm1 1.967 ppm2 4.635 ASSI ( (segid " " and resid "78 " and name "HA ") )( (segid " " and resid "72 " and name "HG2 ") OR (segid " " and resid "72 " and name "HG1 ") OR (segid " " and resid "49 " and name "HG2 ") ) 6.000 6.000 0.000 peak 10686 weight 0.10000E+01 volume 0.78000E-01 ppm1 5.862 ppm2 2.239 ASSI ( (segid " " and resid "78 " and name "HA ") )( (segid " " and resid "80 " and name "HG23") OR (segid " " and resid "80 " and name "HG13") OR (segid " " and resid "80 " and name "HG12") OR (segid " " and resid "71 " and name "HG13") OR (segid " " and resid "71 " and name "HG12") OR (segid " " and resid "71 " and name "HG11") ) 6.000 6.000 0.000 peak 10687 weight 0.10000E+01 volume 0.93000E-01 ppm1 5.864 ppm2 0.844 ASSI ( (segid " " and resid "78 " and name "HA ") )( (segid " " and resid "79 " and name "HG2 ") OR (segid " " and resid "79 " and name "HG1 ") OR (segid " " and resid "79 " and name "HB2 ") OR (segid " " and resid "72 " and name "HB1 ") OR (segid " " and resid "71 " and name "HB ") ) 6.000 6.000 0.000 peak 10688 weight 0.10000E+01 volume 0.10400E+00 ppm1 5.863 ppm2 2.010 ASSI ( (segid " " and resid "158 " and name "HA ") )( (segid " " and resid "160 " and name "HD23") OR (segid " " and resid "160 " and name "HD22") OR (segid " " and resid "160 " and name "HD21") OR (segid " " and resid "156 " and name "HD23") OR (segid " " and resid "156 " and name "HD22") ) 5.000 5.000 0.000 peak 10689 weight 0.10000E+01 volume 0.99300E+00 ppm1 4.329 ppm2 0.773 ASSI ( (segid " " and resid "163 " and name "HA ") )( (segid " " and resid "166 " and name "HD13") OR (segid " " and resid "166 " and name "HD12") OR (segid " " and resid "166 " and name "HD11") OR (segid " " and resid "134 " and name "HD13") OR (segid " " and resid "134 " and name "HD12") OR (segid " " and resid "134 " and name "HD11") ) 5.000 5.000 0.000 peak 10690 weight 0.10000E+01 volume 0.88000E+00 ppm1 4.629 ppm2 0.926 ASSI ( (segid " " and resid "158 " and name "HA ") )( (segid " " and resid "145 " and name "HD23") OR (segid " " and resid "145 " and name "HD22") OR (segid " " and resid "145 " and name "HD21") ) 5.000 5.000 0.000 peak 10691 weight 0.10000E+01 volume 0.73500E+00 ppm1 4.326 ppm2 1.003 ASSI ( (segid " " and resid "158 " and name "HA ") )( (segid " " and resid "161 " and name "HG1 ") ) 5.000 5.000 0.000 peak 10692 weight 0.10000E+01 volume 0.43900E+00 ppm1 4.339 ppm2 2.538 ASSI ( (segid " " and resid "115 " and name "HA ") )( (segid " " and resid "151 " and name "HG2 ") OR (segid " " and resid "151 " and name "HB2 ") OR (segid " " and resid "128 " and name "HB1 ") OR (segid " " and resid "113 " and name "HB ") OR (segid " " and resid "112 " and name "HG1 ") OR (segid " " and resid "85 " and name "HG1 ") ) 6.000 6.000 0.000 peak 10693 weight 0.10000E+01 volume 0.28300E+00 ppm1 4.071 ppm2 1.764 ASSI ( (segid " " and resid "158 " and name "HA ") )( (segid " " and resid "161 " and name "HG2 ") OR (segid " " and resid "157 " and name "HG1 ") ) 5.000 5.000 0.000 peak 10694 weight 0.10000E+01 volume 0.42600E+00 ppm1 4.336 ppm2 2.367 ASSI ( (segid " " and resid "158 " and name "HA ") )( (segid " " and resid "162 " and name "HA1 ") OR (segid " " and resid "161 " and name "HA ") ) 6.000 6.000 0.000 peak 10695 weight 0.10000E+01 volume 0.24800E+00 ppm1 4.340 ppm2 4.014 ASSI ( (segid " " and resid "115 " and name "HA ") )( (segid " " and resid "118 " and name "HA ") OR (segid " " and resid "114 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10696 weight 0.10000E+01 volume 0.22000E+00 ppm1 4.071 ppm2 3.647 ASSI ( (segid " " and resid "117 " and name "HG12") )( (segid " " and resid "156 " and name "HD13") OR (segid " " and resid "156 " and name "HD12") OR (segid " " and resid "125 " and name "HG13") OR (segid " " and resid "125 " and name "HG12") OR (segid " " and resid "125 " and name "HG11") ) 5.000 5.000 0.000 peak 10697 weight 0.10000E+01 volume -0.51200E+00 ppm1 0.774 ppm2 1.000 ASSI ( (segid " " and resid "56 " and name "HB1 ") )( (segid " " and resid "90 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10698 weight 0.10000E+01 volume -0.28100E+00 ppm1 2.051 ppm2 2.735 ASSI ( (segid " " and resid "20 " and name "HB1 ") )( (segid " " and resid "52 " and name "HG2 ") OR (segid " " and resid "52 " and name "HG1 ") ) 6.000 6.000 0.000 peak 10699 weight 0.10000E+01 volume -0.28900E+00 ppm1 1.970 ppm2 2.593 ASSI ( (segid " " and resid "115 " and name "HA ") )( (segid " " and resid "118 " and name "HD2 ") OR (segid " " and resid "118 " and name "HD1 ") ) 5.000 5.000 0.000 peak 10700 weight 0.10000E+01 volume 0.44100E+00 ppm1 4.067 ppm2 3.242 ASSI ( (segid " " and resid "89 " and name "HA ") )( (segid " " and resid "92 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10701 weight 0.10000E+01 volume 0.81100E+00 ppm1 3.721 ppm2 2.077 ASSI ( (segid " " and resid "129 " and name "HA ") OR (segid " " and resid "89 " and name "HA ") )( (segid " " and resid "144 " and name "HG1 ") OR (segid " " and resid "93 " and name "HB2 ") OR (segid " " and resid "92 " and name "HG ") ) 5.000 5.000 0.000 peak 10702 weight 0.10000E+01 volume 0.49400E+00 ppm1 3.722 ppm2 1.638 ASSI ( (segid " " and resid "56 " and name "HB1 ") )( (segid " " and resid "93 " and name "HE2 ") OR (segid " " and resid "90 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10703 weight 0.10000E+01 volume -0.33300E+00 ppm1 2.047 ppm2 2.590 ASSI ( (segid " " and resid "115 " and name "HA ") )( (segid " " and resid "110 " and name "HB2 ") OR (segid " " and resid "85 " and name "HA ") ) 5.000 5.000 0.000 peak 10704 weight 0.10000E+01 volume 0.43400E+00 ppm1 4.074 ppm2 3.744 ASSI ( (segid " " and resid "115 " and name "HA ") )( (segid " " and resid "118 " and name "HG2 ") ) 5.000 5.000 0.000 peak 10705 weight 0.10000E+01 volume 0.57500E+00 ppm1 4.059 ppm2 1.618 ASSI ( (segid " " and resid "56 " and name "HB2 ") )( (segid " " and resid "90 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10706 weight 0.10000E+01 volume -0.24300E+00 ppm1 1.967 ppm2 2.750 ASSI ( (segid " " and resid "158 " and name "HA ") )( (segid " " and resid "159 " and name "HA ") OR (segid " " and resid "157 " and name "HA ") ) 6.000 6.000 0.000 peak 10707 weight 0.10000E+01 volume 0.26100E+00 ppm1 4.337 ppm2 3.739 ASSI ( (segid " " and resid "85 " and name "HB2 ") OR (segid " " and resid "85 " and name "HB1 ") )( (segid " " and resid "119 " and name "HG1 ") ) 5.000 5.000 0.000 peak 10708 weight 0.10000E+01 volume -0.48400E+00 ppm1 2.051 ppm2 2.992 ASSI ( (segid " " and resid "129 " and name "HA ") )( (segid " " and resid "113 " and name "HG11") ) 5.000 5.000 0.000 peak 10709 weight 0.10000E+01 volume 0.51000E+00 ppm1 3.710 ppm2 1.457 ASSI ( (segid " " and resid "82 " and name "HA ") )( (segid " " and resid "85 " and name "HD2 ") OR (segid " " and resid "81 " and name "HB2 ") ) 6.000 6.000 0.000 peak 10710 weight 0.10000E+01 volume 0.23300E+00 ppm1 4.447 ppm2 3.237 ASSI ( (segid " " and resid "82 " and name "HA ") OR (segid " " and resid "2 " and name "HA ") )( (segid " " and resid "85 " and name "HA ") OR (segid " " and resid "83 " and name "HA ") OR (segid " " and resid "81 " and name "HB1 ") OR (segid " " and resid "1 " and name "HA2 ") OR (segid " " and resid "1 " and name "HA1 ") ) 5.000 5.000 0.000 peak 10711 weight 0.10000E+01 volume 0.36400E+00 ppm1 4.432 ppm2 3.781 ASSI ( (segid " " and resid "80 " and name "HB ") )( (segid " " and resid "100 " and name "HB2 ") OR (segid " " and resid "100 " and name "HB1 ") OR (segid " " and resid "96 " and name "HG23") OR (segid " " and resid "96 " and name "HG22") OR (segid " " and resid "96 " and name "HG21") ) 5.000 5.000 0.000 peak 10712 weight 0.10000E+01 volume -0.16630E+01 ppm1 1.913 ppm2 1.139 ASSI ( (segid " " and resid "80 " and name "HB ") )( (segid " " and resid "102 " and name "HA ") OR (segid " " and resid "81 " and name "HA ") ) 5.000 5.000 0.000 peak 10713 weight 0.10000E+01 volume -0.84600E+00 ppm1 1.922 ppm2 3.897 ASSI ( (segid " " and resid "82 " and name "HA ") )( (segid " " and resid "85 " and name "HB2 ") OR (segid " " and resid "85 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10714 weight 0.10000E+01 volume 0.15880E+01 ppm1 4.441 ppm2 2.048 ASSI ( (segid " " and resid "82 " and name "HA ") )( (segid " " and resid "115 " and name "HD12") OR (segid " " and resid "77 " and name "HG23") OR (segid " " and resid "77 " and name "HG22") OR (segid " " and resid "77 " and name "HG21") ) 5.000 5.000 0.000 peak 10715 weight 0.10000E+01 volume 0.50400E+00 ppm1 4.454 ppm2 1.231 ASSI ( (segid " " and resid "82 " and name "HA ") )( (segid " " and resid "86 " and name "HG23") OR (segid " " and resid "86 " and name "HG22") OR (segid " " and resid "86 " and name "HG21") ) 5.000 5.000 0.000 peak 10716 weight 0.10000E+01 volume 0.45100E+00 ppm1 4.450 ppm2 1.328 ASSI ( (segid " " and resid "2 " and name "HA ") )( (segid " " and resid "5 " and name "HD12") OR (segid " " and resid "5 " and name "HD11") OR (segid " " and resid "4 " and name "HD13") OR (segid " " and resid "4 " and name "HD11") ) 6.000 6.000 0.000 peak 10717 weight 0.10000E+01 volume 0.25700E+00 ppm1 4.453 ppm2 0.952 ASSI ( (segid " " and resid "82 " and name "HA ") )( (segid " " and resid "85 " and name "HG1 ") ) 5.000 5.000 0.000 peak 10718 weight 0.10000E+01 volume 0.31300E+00 ppm1 4.448 ppm2 1.759 ASSI ( (segid " " and resid "129 " and name "HA ") )( (segid " " and resid "132 " and name "HB2 ") OR (segid " " and resid "132 " and name "HB1 ") OR (segid " " and resid "130 " and name "HD1 ") ) 5.000 5.000 0.000 peak 10719 weight 0.10000E+01 volume 0.36200E+00 ppm1 3.758 ppm2 3.517 ASSI ( (segid " " and resid "82 " and name "HA ") OR (segid " " and resid "2 " and name "HA ") )( (segid " " and resid "85 " and name "HG2 ") OR (segid " " and resid "5 " and name "HB2 ") OR (segid " " and resid "4 " and name "HG ") OR (segid " " and resid "4 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10720 weight 0.10000E+01 volume 0.20100E+00 ppm1 4.447 ppm2 1.604 ASSI ( (segid " " and resid "129 " and name "HA ") OR (segid " " and resid "89 " and name "HA ") OR (segid " " and resid "81 " and name "HB1 ") OR (segid " " and resid "62 " and name "HA ") )( (segid " " and resid "130 " and name "HD1 ") OR (segid " " and resid "127 " and name "HB1 ") OR (segid " " and resid "88 " and name "HB1 ") OR (segid " " and resid "85 " and name "HD1 ") OR (segid " " and resid "58 " and name "HA ") ) 6.000 6.000 0.000 peak 10721 weight 0.10000E+01 volume 0.23700E+00 ppm1 3.755 ppm2 3.443 ASSI ( (segid " " and resid "88 " and name "HA ") OR (segid " " and resid "31 " and name "HA ") OR (segid " " and resid "12 " and name "HA ") )( (segid " " and resid "89 " and name "HD12") OR (segid " " and resid "89 " and name "HD11") OR (segid " " and resid "50 " and name "HG11") OR (segid " " and resid "34 " and name "HD23") OR (segid " " and resid "34 " and name "HD22") OR (segid " " and resid "34 " and name "HD21") ) 5.000 5.000 0.000 peak 10722 weight 0.10000E+01 volume 0.98900E+00 ppm1 4.634 ppm2 0.841 ASSI ( (segid " " and resid "144 " and name "HB2 ") )( (segid " " and resid "144 " and name "HG2 ") ) 6.000 6.000 0.000 peak 10723 weight 0.10000E+01 volume -0.26200E+00 ppm1 1.778 ppm2 0.533 ASSI ( (segid " " and resid "147 " and name "HA ") )( (segid " " and resid "150 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10724 weight 0.10000E+01 volume 0.99500E+00 ppm1 4.211 ppm2 2.400 ASSI ( (segid " " and resid "124 " and name "HB ") )( (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10725 weight 0.10000E+01 volume -0.19120E+01 ppm1 2.396 ppm2 1.495 ASSI ( (segid " " and resid "160 " and name "HA ") )( (segid " " and resid "163 " and name "HD2 ") ) 6.000 6.000 0.000 peak 10726 weight 0.10000E+01 volume 0.26500E+00 ppm1 3.889 ppm2 7.012 ASSI ( (segid " " and resid "36 " and name "HB2 ") )( (segid " " and resid "36 " and name "HD2 ") ) 6.000 6.000 0.000 peak 10727 weight 0.10000E+01 volume -0.11600E+00 ppm1 2.876 ppm2 7.177 ASSI ( (segid " " and resid "12 " and name "HA ") )( (segid " " and resid "43 " and name "HB2 ") OR (segid " " and resid "41 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10728 weight 0.10000E+01 volume 0.65600E+00 ppm1 4.635 ppm2 2.837 ASSI ( (segid " " and resid "147 " and name "HA ") )( (segid " " and resid "142 " and name "HD13") OR (segid " " and resid "142 " and name "HD12") OR (segid " " and resid "142 " and name "HD11") ) 3.300 3.300 0.000 peak 10729 weight 0.10000E+01 volume 0.29120E+01 ppm1 4.209 ppm2 0.888 ASSI ( (segid " " and resid "147 " and name "HA ") )( (segid " " and resid "142 " and name "HD23") OR (segid " " and resid "142 " and name "HD22") OR (segid " " and resid "142 " and name "HD21") ) 5.000 5.000 0.000 peak 10730 weight 0.10000E+01 volume 0.15420E+01 ppm1 4.210 ppm2 0.755 ASSI ( (segid " " and resid "60 " and name "HA ") )( (segid " " and resid "95 " and name "HB2 ") OR (segid " " and resid "91 " and name "HG23") OR (segid " " and resid "91 " and name "HG22") OR (segid " " and resid "91 " and name "HG21") OR (segid " " and resid "67 " and name "HB3 ") OR (segid " " and resid "67 " and name "HB2 ") OR (segid " " and resid "67 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10731 weight 0.10000E+01 volume 0.40500E+00 ppm1 3.630 ppm2 1.114 ASSI ( (segid " " and resid "75 " and name "HA ") OR (segid " " and resid "31 " and name "HA ") OR (segid " " and resid "12 " and name "HA ") )( (segid " " and resid "74 " and name "HB3 ") OR (segid " " and resid "74 " and name "HB2 ") OR (segid " " and resid "74 " and name "HB1 ") OR (segid " " and resid "30 " and name "HB1 ") OR (segid " " and resid "19 " and name "HB1 ") OR (segid " " and resid "17 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10732 weight 0.10000E+01 volume 0.51100E+00 ppm1 4.658 ppm2 1.550 ASSI ( (segid " " and resid "163 " and name "HB1 ") OR (segid " " and resid "81 " and name "HB2 ") )( (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "134 " and name "HD13") OR (segid " " and resid "134 " and name "HD12") OR (segid " " and resid "80 " and name "HG13") OR (segid " " and resid "80 " and name "HG12") OR (segid " " and resid "80 " and name "HG11") ) 6.000 6.000 0.000 peak 10733 weight 0.10000E+01 volume -0.28300E+00 ppm1 3.268 ppm2 0.937 ASSI ( (segid " " and resid "124 " and name "HB ") )( (segid " " and resid "121 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10734 weight 0.10000E+01 volume -0.50600E+00 ppm1 2.394 ppm2 3.141 ASSI ( (segid " " and resid "137 " and name "HB1 ") )( (segid " " and resid "144 " and name "HD2 ") OR (segid " " and resid "141 " and name "HA2 ") ) 6.000 6.000 0.000 peak 10735 weight 0.10000E+01 volume -0.25700E+00 ppm1 1.540 ppm2 3.701 ASSI ( (segid " " and resid "124 " and name "HB ") )( (segid " " and resid "121 " and name "HA ") ) 6.000 6.000 0.000 peak 10736 weight 0.10000E+01 volume -0.78000E-01 ppm1 2.394 ppm2 5.222 ASSI ( (segid " " and resid "36 " and name "HB1 ") )( (segid " " and resid "36 " and name "HD2 ") ) 6.000 6.000 0.000 peak 10737 weight 0.10000E+01 volume -0.16900E+00 ppm1 3.194 ppm2 7.171 ASSI ( (segid " " and resid "160 " and name "HA ") )( (segid " " and resid "163 " and name "HB2 ") ) 6.000 6.000 0.000 peak 10738 weight 0.10000E+01 volume 0.21000E+00 ppm1 3.888 ppm2 2.716 ASSI ( (segid " " and resid "163 " and name "HB2 ") )( (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "134 " and name "HD13") OR (segid " " and resid "134 " and name "HD12") OR (segid " " and resid "134 " and name "HD11") ) 5.000 5.000 0.000 peak 10739 weight 0.10000E+01 volume -0.32600E+00 ppm1 2.719 ppm2 0.935 ASSI ( (segid " " and resid "62 " and name "HA ") )( (segid " " and resid "65 " and name "HG2 ") OR (segid " " and resid "61 " and name "HG1 ") ) 6.000 6.000 0.000 peak 10740 weight 0.10000E+01 volume 0.24100E+00 ppm1 3.774 ppm2 2.458 ASSI ( (segid " " and resid "62 " and name "HA ") )( (segid " " and resid "65 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10741 weight 0.10000E+01 volume 0.37200E+00 ppm1 3.775 ppm2 2.177 ASSI ( (segid " " and resid "160 " and name "HA ") )( (segid " " and resid "164 " and name "HA ") ) 6.000 6.000 0.000 peak 10742 weight 0.10000E+01 volume 0.21100E+00 ppm1 3.909 ppm2 4.455 ASSI ( (segid " " and resid "60 " and name "HA ") )( (segid " " and resid "63 " and name "HD13") OR (segid " " and resid "63 " and name "HD12") OR (segid " " and resid "63 " and name "HD11") ) 5.000 5.000 0.000 peak 10743 weight 0.10000E+01 volume 0.14130E+01 ppm1 3.632 ppm2 0.648 ASSI ( (segid " " and resid "60 " and name "HA ") )( (segid " " and resid "63 " and name "HD23") OR (segid " " and resid "63 " and name "HD21") OR (segid " " and resid "63 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10744 weight 0.10000E+01 volume 0.78900E+00 ppm1 3.628 ppm2 0.848 ASSI ( (segid " " and resid "147 " and name "HA ") )( (segid " " and resid "150 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10745 weight 0.10000E+01 volume 0.17670E+01 ppm1 4.207 ppm2 2.209 ASSI ( (segid " " and resid "60 " and name "HA ") )( (segid " " and resid "59 " and name "HB3 ") OR (segid " " and resid "59 " and name "HB2 ") OR (segid " " and resid "59 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10746 weight 0.10000E+01 volume 0.30000E+00 ppm1 3.628 ppm2 1.301 ASSI ( (segid " " and resid "60 " and name "HA ") )( (segid " " and resid "95 " and name "HA ") OR (segid " " and resid "63 " and name "HA ") OR (segid " " and resid "61 " and name "HA ") ) 6.000 6.000 0.000 peak 10747 weight 0.10000E+01 volume 0.13400E+00 ppm1 3.629 ppm2 3.892 ASSI ( (segid " " and resid "60 " and name "HA ") )( (segid " " and resid "94 " and name "HG11") OR (segid " " and resid "63 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10748 weight 0.10000E+01 volume 0.49200E+00 ppm1 3.629 ppm2 1.198 ASSI ( (segid " " and resid "90 " and name "HA ") )( (segid " " and resid "93 " and name "HG2 ") OR (segid " " and resid "89 " and name "HD23") OR (segid " " and resid "89 " and name "HD22") OR (segid " " and resid "89 " and name "HD21") ) 5.000 5.000 0.000 peak 10749 weight 0.10000E+01 volume 0.34200E+00 ppm1 4.251 ppm2 0.608 ASSI ( (segid " " and resid "124 " and name "HB ") )( (segid " " and resid "121 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10751 weight 0.10000E+01 volume -0.34700E+00 ppm1 2.394 ppm2 3.032 ASSI ( (segid " " and resid "49 " and name "HA ") OR (segid " " and resid "42 " and name "HA ") )( (segid " " and resid "79 " and name "HB2 ") OR (segid " " and resid "42 " and name "HB1 ") ) 3.300 3.300 0.000 peak 10752 weight 0.10000E+01 volume 0.29420E+01 ppm1 4.157 ppm2 1.944 ASSI ( (segid " " and resid "137 " and name "HB2 ") )( (segid " " and resid "142 " and name "HD13") OR (segid " " and resid "142 " and name "HD12") OR (segid " " and resid "142 " and name "HD11") OR (segid " " and resid "117 " and name "HD13") OR (segid " " and resid "105 " and name "HD13") OR (segid " " and resid "105 " and name "HD12") OR (segid " " and resid "105 " and name "HD11") ) 6.000 6.000 0.000 peak 10753 weight 0.10000E+01 volume -0.14300E+00 ppm1 1.270 ppm2 0.865 ASSI ( (segid " " and resid "42 " and name "HA ") )( (segid " " and resid "42 " and name "HG2 ") ) 6.000 6.000 0.000 peak 10754 weight 0.10000E+01 volume 0.29900E+00 ppm1 4.156 ppm2 0.275 ASSI ( (segid " " and resid "42 " and name "HA ") )( (segid " " and resid "42 " and name "HG1 ") ) 5.000 5.000 0.000 peak 10755 weight 0.10000E+01 volume 0.10780E+01 ppm1 4.156 ppm2 1.275 ASSI ( (segid " " and resid "145 " and name "HA ") OR (segid " " and resid "29 " and name "HA ") )( (segid " " and resid "147 " and name "HA ") OR (segid " " and resid "30 " and name "HA ") ) 5.000 5.000 0.000 peak 10756 weight 0.10000E+01 volume 0.39900E+00 ppm1 3.917 ppm2 4.220 ASSI ( (segid " " and resid "131 " and name "HB2 ") )( (segid " " and resid "128 " and name "HD23") OR (segid " " and resid "102 " and name "HG23") OR (segid " " and resid "102 " and name "HG21") OR (segid " " and resid "102 " and name "HG13") OR (segid " " and resid "102 " and name "HG12") OR (segid " " and resid "102 " and name "HG11") ) 5.000 5.000 0.000 peak 10757 weight 0.10000E+01 volume -0.12790E+01 ppm1 1.486 ppm2 0.872 ASSI ( (segid " " and resid "94 " and name "HB ") )( (segid " " and resid "59 " and name "HB3 ") OR (segid " " and resid "59 " and name "HB2 ") OR (segid " " and resid "59 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10758 weight 0.10000E+01 volume -0.10220E+01 ppm1 2.260 ppm2 1.326 ASSI ( (segid " " and resid "160 " and name "HA ") )( (segid " " and resid "164 " and name "HA ") ) 6.000 6.000 0.000 peak 10759 weight 0.10000E+01 volume 0.20900E+00 ppm1 3.872 ppm2 4.469 ASSI ( (segid " " and resid "69 " and name "HB2 ") )( (segid " " and resid "95 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10760 weight 0.10000E+01 volume -0.56500E+00 ppm1 1.673 ppm2 2.287 ASSI ( (segid " " and resid "166 " and name "HA ") )( (segid " " and resid "168 " and name "HB2 ") OR (segid " " and resid "167 " and name "HG2 ") OR (segid " " and resid "167 " and name "HB2 ") OR (segid " " and resid "164 " and name "HE1 ") OR (segid " " and resid "134 " and name "HG ") ) 5.000 5.000 0.000 peak 10761 weight 0.10000E+01 volume 0.41800E+00 ppm1 4.510 ppm2 2.000 ASSI ( (segid " " and resid "136 " and name "HA ") )( (segid " " and resid "133 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10762 weight 0.10000E+01 volume 0.37200E+00 ppm1 4.266 ppm2 2.928 ASSI ( (segid " " and resid "136 " and name "HA ") )( (segid " " and resid "143 " and name "HG23") OR (segid " " and resid "143 " and name "HG22") OR (segid " " and resid "143 " and name "HG21") OR (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") ) 5.000 5.000 0.000 peak 10763 weight 0.10000E+01 volume 0.54300E+00 ppm1 4.268 ppm2 1.209 ASSI ( (segid " " and resid "166 " and name "HA ") )( (segid " " and resid "167 " and name "HD2 ") ) 3.300 3.300 0.000 peak 10764 weight 0.10000E+01 volume 0.21110E+01 ppm1 4.524 ppm2 3.731 ASSI ( (segid " " and resid "166 " and name "HA ") )( (segid " " and resid "168 " and name "HE2 ") OR (segid " " and resid "167 " and name "HG1 ") OR (segid " " and resid "165 " and name "HE3 ") OR (segid " " and resid "165 " and name "HE1 ") OR (segid " " and resid "165 " and name "HB2 ") OR (segid " " and resid "165 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10765 weight 0.10000E+01 volume 0.22500E+00 ppm1 4.532 ppm2 2.119 ASSI ( (segid " " and resid "69 " and name "HB2 ") OR (segid " " and resid "37 " and name "HB2 ") )( (segid " " and resid "69 " and name "HD2 ") OR (segid " " and resid "69 " and name "HD1 ") OR (segid " " and resid "37 " and name "HA ") ) 5.000 5.000 0.000 peak 10766 weight 0.10000E+01 volume -0.98000E+00 ppm1 1.694 ppm2 4.102 ASSI ( (segid " " and resid "97 " and name "HA ") OR (segid " " and resid "14 " and name "HA ") )( (segid " " and resid "131 " and name "HA ") OR (segid " " and resid "41 " and name "HA ") ) 6.000 6.000 0.000 peak 10767 weight 0.10000E+01 volume 0.21200E+00 ppm1 4.109 ppm2 4.512 ASSI ( (segid " " and resid "140 " and name "HA ") )( (segid " " and resid "139 " and name "HB3 ") OR (segid " " and resid "139 " and name "HB2 ") OR (segid " " and resid "139 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10768 weight 0.10000E+01 volume 0.29700E+00 ppm1 4.504 ppm2 1.400 ASSI ( (segid " " and resid "165 " and name "HB2 ") OR (segid " " and resid "52 " and name "HB1 ") OR (segid " " and resid "49 " and name "HB2 ") )( (segid " " and resid "166 " and name "HG11") OR (segid " " and resid "48 " and name "HB1 ") OR (segid " " and resid "45 " and name "HD1 ") OR (segid " " and resid "45 " and name "HB2 ") OR (segid " " and resid "19 " and name "HB3 ") OR (segid " " and resid "19 " and name "HB2 ") OR (segid " " and resid "19 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10769 weight 0.10000E+01 volume -0.87700E+00 ppm1 2.120 ppm2 1.553 ASSI ( (segid " " and resid "166 " and name "HA ") )( (segid " " and resid "168 " and name "HG2 ") OR (segid " " and resid "168 " and name "HG1 ") ) 6.000 6.000 0.000 peak 10770 weight 0.10000E+01 volume 0.19800E+00 ppm1 4.522 ppm2 2.580 ASSI ( (segid " " and resid "52 " and name "HB1 ") OR (segid " " and resid "49 " and name "HB2 ") )( (segid " " and resid "73 " and name "HB1 ") OR (segid " " and resid "21 " and name "HA2 ") ) 6.000 6.000 0.000 peak 10771 weight 0.10000E+01 volume -0.28700E+00 ppm1 2.127 ppm2 3.568 ASSI ( (segid " " and resid "165 " and name "HB2 ") OR (segid " " and resid "165 " and name "HB1 ") )( (segid " " and resid "167 " and name "HD2 ") ) 5.000 5.000 0.000 peak 10772 weight 0.10000E+01 volume -0.48400E+00 ppm1 2.127 ppm2 3.701 ASSI ( (segid " " and resid "79 " and name "HB2 ") )( (segid " " and resid "53 " and name "HZ ") ) 6.000 6.000 0.000 peak 10773 weight 0.10000E+01 volume -0.11200E+00 ppm1 1.993 ppm2 7.437 ASSI ( (segid " " and resid "79 " and name "HB1 ") )( (segid " " and resid "95 " and name "HD12") OR (segid " " and resid "48 " and name "HD21") OR (segid " " and resid "48 " and name "HD13") OR (segid " " and resid "48 " and name "HD12") OR (segid " " and resid "48 " and name "HD11") ) 5.000 5.000 0.000 peak 10774 weight 0.10000E+01 volume -0.16650E+01 ppm1 2.451 ppm2 0.813 ASSI ( (segid " " and resid "69 " and name "HB2 ") )( (segid " " and resid "100 " and name "HA ") ) 5.000 5.000 0.000 peak 10775 weight 0.10000E+01 volume -0.97900E+00 ppm1 1.700 ppm2 4.242 ASSI ( (segid " " and resid "79 " and name "HB1 ") )( (segid " " and resid "100 " and name "HA ") OR (segid " " and resid "78 " and name "HB2 ") OR (segid " " and resid "52 " and name "HA ") ) 5.000 5.000 0.000 peak 10776 weight 0.10000E+01 volume -0.40400E+00 ppm1 2.447 ppm2 4.252 ASSI ( (segid " " and resid "136 " and name "HB2 ") )( (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") ) 5.000 5.000 0.000 peak 10777 weight 0.10000E+01 volume -0.33500E+00 ppm1 3.060 ppm2 1.194 ASSI ( (segid " " and resid "150 " and name "HA ") OR (segid " " and resid "146 " and name "HA ") )( (segid " " and resid "151 " and name "HD1 ") OR (segid " " and resid "149 " and name "HD2 ") OR (segid " " and resid "149 " and name "HD1 ") ) 5.000 5.000 0.000 peak 10778 weight 0.10000E+01 volume 0.36400E+00 ppm1 3.998 ppm2 3.247 ASSI ( (segid " " and resid "93 " and name "HB2 ") OR (segid " " and resid "69 " and name "HB2 ") )( (segid " " and resid "97 " and name "HG2 ") OR (segid " " and resid "69 " and name "HG1 ") ) 5.000 5.000 0.000 peak 10779 weight 0.10000E+01 volume -0.13650E+01 ppm1 1.700 ppm2 2.127 ASSI ( (segid " " and resid "35 " and name "HB ") )( (segid " " and resid "30 " and name "HA ") ) 5.000 5.000 0.000 peak 10780 weight 0.10000E+01 volume -0.58700E+00 ppm1 1.579 ppm2 4.228 ASSI ( (segid " " and resid "132 " and name "HA ") )( (segid " " and resid "134 " and name "HD22") OR (segid " " and resid "134 " and name "HD21") OR (segid " " and resid "128 " and name "HD13") OR (segid " " and resid "128 " and name "HD12") OR (segid " " and resid "128 " and name "HD11") ) 5.000 5.000 0.000 peak 10781 weight 0.10000E+01 volume 0.34500E+00 ppm1 5.095 ppm2 0.718 ASSI ( (segid " " and resid "132 " and name "HA ") )( (segid " " and resid "102 " and name "HG23") OR (segid " " and resid "102 " and name "HG22") OR (segid " " and resid "102 " and name "HG21") ) 5.000 5.000 0.000 peak 10782 weight 0.10000E+01 volume 0.10700E+01 ppm1 5.099 ppm2 0.870 ASSI ( (segid " " and resid "132 " and name "HA ") )( (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") ) 6.000 6.000 0.000 peak 10783 weight 0.10000E+01 volume 0.13300E+00 ppm1 5.091 ppm2 1.190 ASSI ( (segid " " and resid "97 " and name "HA ") )( (segid " " and resid "131 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10784 weight 0.10000E+01 volume 0.41400E+00 ppm1 4.107 ppm2 1.511 ASSI ( (segid " " and resid "35 " and name "HB ") )( (segid " " and resid "30 " and name "HD23") OR (segid " " and resid "30 " and name "HD21") OR (segid " " and resid "29 " and name "HD22") OR (segid " " and resid "29 " and name "HD21") ) 5.000 5.000 0.000 peak 10785 weight 0.10000E+01 volume -0.87800E+00 ppm1 1.576 ppm2 0.770 ASSI ( (segid " " and resid "97 " and name "HA ") )( (segid " " and resid "96 " and name "HG23") OR (segid " " and resid "96 " and name "HG13") OR (segid " " and resid "96 " and name "HG12") OR (segid " " and resid "96 " and name "HG11") OR (segid " " and resid "93 " and name "HG1 ") ) 5.000 5.000 0.000 peak 10786 weight 0.10000E+01 volume 0.95600E+00 ppm1 4.101 ppm2 1.123 ASSI ( (segid " " and resid "161 " and name "HA ") OR (segid " " and resid "150 " and name "HA ") OR (segid " " and resid "146 " and name "HA ") )( (segid " " and resid "158 " and name "HA ") OR (segid " " and resid "149 " and name "HA ") OR (segid " " and resid "144 " and name "HD1 ") ) 5.000 5.000 0.000 peak 10787 weight 0.10000E+01 volume 0.59700E+00 ppm1 4.012 ppm2 4.343 ASSI ( (segid " " and resid "97 " and name "HA ") )( (segid " " and resid "131 " and name "HA ") OR (segid " " and resid "98 " and name "HA ") ) 6.000 6.000 0.000 peak 10788 weight 0.10000E+01 volume 0.19200E+00 ppm1 4.104 ppm2 4.552 ASSI ( (segid " " and resid "95 " and name "HA ") )( (segid " " and resid "63 " and name "HD13") OR (segid " " and resid "63 " and name "HD12") OR (segid " " and resid "63 " and name "HD11") ) 5.000 5.000 0.000 peak 10789 weight 0.10000E+01 volume 0.19430E+01 ppm1 3.921 ppm2 0.648 ASSI ( (segid " " and resid "161 " and name "HA ") )( (segid " " and resid "164 " and name "HG1 ") ) 5.000 5.000 0.000 peak 10790 weight 0.10000E+01 volume 0.44400E+00 ppm1 4.017 ppm2 2.698 ASSI ( (segid " " and resid "85 " and name "HA ") )( (segid " " and resid "125 " and name "HG23") OR (segid " " and resid "125 " and name "HG22") OR (segid " " and resid "125 " and name "HG21") OR (segid " " and resid "80 " and name "HG23") OR (segid " " and resid "80 " and name "HG22") OR (segid " " and resid "80 " and name "HG21") ) 6.000 6.000 0.000 peak 10791 weight 0.10000E+01 volume 0.28900E+00 ppm1 3.745 ppm2 0.832 ASSI ( (segid " " and resid "85 " and name "HA ") )( (segid " " and resid "124 " and name "HG23") OR (segid " " and resid "124 " and name "HG22") OR (segid " " and resid "124 " and name "HG21") OR (segid " " and resid "124 " and name "HG13") OR (segid " " and resid "124 " and name "HG12") OR (segid " " and resid "124 " and name "HG11") OR (segid " " and resid "115 " and name "HD23") OR (segid " " and resid "115 " and name "HD22") OR (segid " " and resid "115 " and name "HD21") OR (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") ) 5.000 5.000 0.000 peak 10792 weight 0.10000E+01 volume 0.57400E+00 ppm1 3.762 ppm2 0.961 ASSI ( (segid " " and resid "85 " and name "HA ") )( (segid " " and resid "115 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10793 weight 0.10000E+01 volume 0.53800E+00 ppm1 3.750 ppm2 1.354 ASSI ( (segid " " and resid "46 " and name "HA ") )( (segid " " and resid "40 " and name "HD23") OR (segid " " and resid "40 " and name "HD22") OR (segid " " and resid "40 " and name "HD21") ) 5.000 5.000 0.000 peak 10794 weight 0.10000E+01 volume 0.41700E+00 ppm1 4.770 ppm2 0.653 ASSI ( (segid " " and resid "85 " and name "HA ") )( (segid " " and resid "115 " and name "HA ") OR (segid " " and resid "84 " and name "HA ") ) 5.000 5.000 0.000 peak 10795 weight 0.10000E+01 volume 0.85000E+00 ppm1 3.751 ppm2 4.034 ASSI ( (segid " " and resid "85 " and name "HA ") )( (segid " " and resid "121 " and name "HD2 ") ) 6.000 6.000 0.000 peak 10796 weight 0.10000E+01 volume 0.19100E+00 ppm1 3.758 ppm2 7.261 ASSI ( (segid " " and resid "161 " and name "HA ") )( (segid " " and resid "164 " and name "HA ") ) 6.000 6.000 0.000 peak 10797 weight 0.10000E+01 volume 0.17500E+00 ppm1 4.019 ppm2 4.485 ASSI ( (segid " " and resid "85 " and name "HA ") )( (segid " " and resid "119 " and name "HB2 ") OR (segid " " and resid "85 " and name "HG2 ") ) 5.000 5.000 0.000 peak 10798 weight 0.10000E+01 volume 0.86400E+00 ppm1 3.746 ppm2 1.609 ASSI ( (segid " " and resid "85 " and name "HA ") )( (segid " " and resid "85 " and name "HD2 ") ) 6.000 6.000 0.000 peak 10799 weight 0.10000E+01 volume 0.15500E+00 ppm1 3.745 ppm2 3.216 ASSI ( (segid " " and resid "85 " and name "HA ") )( (segid " " and resid "85 " and name "HG1 ") ) 5.000 5.000 0.000 peak 10800 weight 0.10000E+01 volume 0.73700E+00 ppm1 3.755 ppm2 1.756 ASSI ( (segid " " and resid "85 " and name "HA ") )( (segid " " and resid "119 " and name "HG2 ") ) 5.000 5.000 0.000 peak 10801 weight 0.10000E+01 volume 0.33500E+00 ppm1 3.744 ppm2 2.388 ASSI ( (segid " " and resid "85 " and name "HA ") )( (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB1 ") OR (segid " " and resid "84 " and name "HB3 ") OR (segid " " and resid "84 " and name "HB2 ") OR (segid " " and resid "84 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10802 weight 0.10000E+01 volume 0.60600E+00 ppm1 3.744 ppm2 1.480 ASSI ( (segid " " and resid "85 " and name "HA ") )( (segid " " and resid "116 " and name "HA ") ) 5.000 5.000 0.000 peak 10803 weight 0.10000E+01 volume 0.60700E+00 ppm1 3.754 ppm2 4.130 ASSI ( (segid " " and resid "46 " and name "HA ") )( (segid " " and resid "50 " and name "HG23") OR (segid " " and resid "50 " and name "HG22") OR (segid " " and resid "50 " and name "HG21") OR (segid " " and resid "50 " and name "HG11") OR (segid " " and resid "40 " and name "HD13") OR (segid " " and resid "40 " and name "HD12") OR (segid " " and resid "40 " and name "HD11") ) 5.000 5.000 0.000 peak 10805 weight 0.10000E+01 volume 0.36900E+00 ppm1 4.773 ppm2 0.895 ASSI ( (segid " " and resid "85 " and name "HA ") )( (segid " " and resid "115 " and name "HD13") OR (segid " " and resid "115 " and name "HD12") OR (segid " " and resid "115 " and name "HD11") ) 5.000 5.000 0.000 peak 10806 weight 0.10000E+01 volume 0.35000E+00 ppm1 3.745 ppm2 1.232 ASSI ( (segid " " and resid "85 " and name "HA ") )( (segid " " and resid "85 " and name "HD1 ") ) 6.000 6.000 0.000 peak 10807 weight 0.10000E+01 volume 0.19300E+00 ppm1 3.759 ppm2 3.459 ASSI ( (segid " " and resid "24 " and name "HA ") )( (segid " " and resid "28 " and name "HD1 ") OR (segid " " and resid "26 " and name "HA ") OR (segid " " and resid "23 " and name "HA ") ) 6.000 6.000 0.000 peak 10808 weight 0.10000E+01 volume 0.19200E+00 ppm1 4.015 ppm2 3.401 ASSI ( (segid " " and resid "85 " and name "HA ") )( (segid " " and resid "119 " and name "HG1 ") ) 6.000 6.000 0.000 peak 10809 weight 0.10000E+01 volume 0.19300E+00 ppm1 3.739 ppm2 2.986 ASSI ( (segid " " and resid "164 " and name "HG2 ") )( (segid " " and resid "134 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10810 weight 0.10000E+01 volume -0.44800E+00 ppm1 2.343 ppm2 1.601 ASSI ( (segid " " and resid "24 " and name "HA ") )( (segid " " and resid "27 " and name "HD2 ") OR (segid " " and resid "27 " and name "HD1 ") ) 5.000 5.000 0.000 peak 10811 weight 0.10000E+01 volume 0.62200E+00 ppm1 4.019 ppm2 3.103 ASSI ( (segid " " and resid "164 " and name "HG1 ") )( (segid " " and resid "134 " and name "HD13") OR (segid " " and resid "134 " and name "HD12") OR (segid " " and resid "134 " and name "HD11") ) 5.000 5.000 0.000 peak 10812 weight 0.10000E+01 volume -0.75100E+00 ppm1 2.707 ppm2 0.930 ASSI ( (segid " " and resid "164 " and name "HG1 ") )( (segid " " and resid "163 " and name "HB1 ") OR (segid " " and resid "135 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10813 weight 0.10000E+01 volume -0.10200E+00 ppm1 2.709 ppm2 3.267 ASSI ( (segid " " and resid "164 " and name "HG1 ") )( (segid " " and resid "161 " and name "HA ") ) 6.000 6.000 0.000 peak 10814 weight 0.10000E+01 volume -0.14100E+00 ppm1 2.695 ppm2 4.021 ASSI ( (segid " " and resid "164 " and name "HG2 ") )( (segid " " and resid "134 " and name "HB2 ") ) 6.000 6.000 0.000 peak 10817 weight 0.10000E+01 volume 0.10600E+00 ppm1 2.343 ppm2 1.604 ASSI ( (segid " " and resid "164 " and name "HG1 ") )( (segid " " and resid "134 " and name "HD13") OR (segid " " and resid "134 " and name "HD12") OR (segid " " and resid "134 " and name "HD11") ) 6.000 6.000 0.000 peak 10818 weight 0.10000E+01 volume 0.26800E+00 ppm1 2.711 ppm2 0.930 ASSI ( (segid " " and resid "164 " and name "HG1 ") )( (segid " " and resid "134 " and name "HD13") OR (segid " " and resid "134 " and name "HD12") OR (segid " " and resid "134 " and name "HD11") ) 6.000 6.000 0.000 peak 10819 weight 0.10000E+01 volume 0.26800E+00 ppm1 2.714 ppm2 0.930 ASSI ( (segid " " and resid "164 " and name "HG2 ") )( (segid " " and resid "134 " and name "HB2 ") ) 6.000 6.000 0.000 peak 10820 weight 0.10000E+01 volume 0.13800E+00 ppm1 2.343 ppm2 1.606 ASSI ( (segid " " and resid "164 " and name "HG2 ") )( (segid " " and resid "134 " and name "HB2 ") ) 6.000 6.000 0.000 peak 10821 weight 0.10000E+01 volume 0.13800E+00 ppm1 2.342 ppm2 1.608 ASSI ( (segid " " and resid "64 " and name "HA ") OR (segid " " and resid "13 " and name "HA ") )( (segid " " and resid "63 " and name "HD23") OR (segid " " and resid "63 " and name "HD22") OR (segid " " and resid "63 " and name "HD21") OR (segid " " and resid "29 " and name "HD23") OR (segid " " and resid "29 " and name "HD21") ) 5.000 5.000 0.000 peak 9648 weight 0.10000E+01 volume -0.46900E+00 ppm1 4.119 ppm2 0.774 ASSI ( (segid " " and resid "149 " and name "HA ") )( (segid " " and resid "148 " and name "HB3 ") OR (segid " " and resid "148 " and name "HB2 ") OR (segid " " and resid "148 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9651 weight 0.10000E+01 volume -0.39000E+00 ppm1 4.342 ppm2 1.433 ASSI ( (segid " " and resid "50 " and name "HA ") )( (segid " " and resid "45 " and name "HD1 ") OR (segid " " and resid "45 " and name "HB2 ") OR (segid " " and resid "19 " and name "HB3 ") OR (segid " " and resid "19 " and name "HB2 ") OR (segid " " and resid "19 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10822 weight 0.10000E+01 volume -0.24300E+00 ppm1 4.657 ppm2 1.535 ASSI ( (segid " " and resid "149 " and name "HA ") )( (segid " " and resid "152 " and name "HA1 ") OR (segid " " and resid "150 " and name "HA ") OR (segid " " and resid "146 " and name "HA ") ) 5.000 5.000 0.000 peak 10823 weight 0.10000E+01 volume -0.65200E+00 ppm1 4.335 ppm2 4.002 ASSI ( (segid " " and resid "143 " and name "HA ") )( (segid " " and resid "137 " and name "HA ") ) 5.000 5.000 0.000 peak 10824 weight 0.10000E+01 volume -0.44200E+00 ppm1 5.382 ppm2 4.235 ASSI ( (segid " " and resid "143 " and name "HA ") )( (segid " " and resid "144 " and name "HD1 ") ) 5.000 5.000 0.000 peak 10825 weight 0.10000E+01 volume -0.49400E+00 ppm1 5.382 ppm2 4.288 ASSI ( (segid " " and resid "27 " and name "HA ") )( (segid " " and resid "31 " and name "HD2 ") ) 5.000 5.000 0.000 peak 10826 weight 0.10000E+01 volume -0.55800E+00 ppm1 3.672 ppm2 6.950 ASSI ( (segid " " and resid "127 " and name "HA ") )( (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "159 " and name "HG21") OR (segid " " and resid "128 " and name "HD23") OR (segid " " and resid "128 " and name "HD22") OR (segid " " and resid "128 " and name "HD21") OR (segid " " and resid "125 " and name "HG13") OR (segid " " and resid "125 " and name "HG12") OR (segid " " and resid "125 " and name "HG11") OR (segid " " and resid "124 " and name "HG23") OR (segid " " and resid "124 " and name "HG22") OR (segid " " and resid "124 " and name "HG13") OR (segid " " and resid "124 " and name "HG12") OR (segid " " and resid "124 " and name "HG11") OR (segid " " and resid "92 " and name "HD13") OR (segid " " and resid "92 " and name "HD12") OR (segid " " and resid "92 " and name "HD11") ) 5.000 5.000 0.000 peak 10827 weight 0.10000E+01 volume -0.97100E+00 ppm1 4.304 ppm2 0.942 ASSI ( (segid " " and resid "127 " and name "HA ") )( (segid " " and resid "93 " and name "HG2 ") OR (segid " " and resid "89 " and name "HD23") OR (segid " " and resid "89 " and name "HD22") OR (segid " " and resid "89 " and name "HD21") ) 5.000 5.000 0.000 peak 10828 weight 0.10000E+01 volume -0.43700E+00 ppm1 4.303 ppm2 0.605 ASSI ( (segid " " and resid "93 " and name "HA ") )( (segid " " and resid "93 " and name "HG2 ") ) 5.000 5.000 0.000 peak 10829 weight 0.10000E+01 volume -0.11210E+01 ppm1 3.701 ppm2 0.632 ASSI ( (segid " " and resid "93 " and name "HA ") )( (segid " " and resid "96 " and name "HB ") ) 5.000 5.000 0.000 peak 9711 weight 0.10000E+01 volume -0.90200E+00 ppm1 3.701 ppm2 2.340 ASSI ( (segid " " and resid "127 " and name "HA ") )( (segid " " and resid "159 " and name "HA ") OR (segid " " and resid "129 " and name "HA ") OR (segid " " and resid "124 " and name "HA ") OR (segid " " and resid "93 " and name "HA ") OR (segid " " and resid "89 " and name "HA ") ) 5.000 5.000 0.000 peak 10830 weight 0.10000E+01 volume -0.30000E+00 ppm1 4.303 ppm2 3.734 ASSI ( (segid " " and resid "108 " and name "HA ") )( (segid " " and resid "139 " and name "HB3 ") OR (segid " " and resid "139 " and name "HB2 ") OR (segid " " and resid "139 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10831 weight 0.10000E+01 volume -0.12330E+01 ppm1 4.620 ppm2 1.400 ASSI ( (segid " " and resid "123 " and name "HA ") )( (segid " " and resid "159 " and name "HD12") OR (segid " " and resid "159 " and name "HD11") OR (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "159 " and name "HG21") OR (segid " " and resid "124 " and name "HG22") OR (segid " " and resid "124 " and name "HG21") OR (segid " " and resid "124 " and name "HG13") OR (segid " " and resid "124 " and name "HG12") ) 5.000 5.000 0.000 peak 10832 weight 0.10000E+01 volume -0.39000E+00 ppm1 4.336 ppm2 0.922 ASSI ( (segid " " and resid "53 " and name "HA ") )( (segid " " and resid "88 " and name "HD2 ") OR (segid " " and resid "88 " and name "HD1 ") OR (segid " " and resid "53 " and name "HZ ") ) 6.000 6.000 0.000 peak 10833 weight 0.10000E+01 volume -0.94000E-01 ppm1 3.899 ppm2 7.438 ASSI ( (segid " " and resid "53 " and name "HA ") )( (segid " " and resid "53 " and name "HE2 ") OR (segid " " and resid "53 " and name "HE1 ") ) 6.000 6.000 0.000 peak 10834 weight 0.10000E+01 volume -0.14300E+00 ppm1 3.899 ppm2 7.321 ASSI ( (segid " " and resid "53 " and name "HA ") )( (segid " " and resid "88 " and name "HB1 ") OR (segid " " and resid "51 " and name "HA ") ) 6.000 6.000 0.000 peak 10835 weight 0.10000E+01 volume -0.17400E+00 ppm1 3.915 ppm2 3.448 ASSI ( (segid " " and resid "123 " and name "HB2 ") OR (segid " " and resid "123 " and name "HB1 ") )( (segid " " and resid "89 " and name "HD22") OR (segid " " and resid "89 " and name "HD21") ) 6.000 6.000 0.000 peak 10836 weight 0.10000E+01 volume -0.18500E+00 ppm1 4.021 ppm2 0.605 ASSI ( (segid " " and resid "53 " and name "HA ") )( (segid " " and resid "91 " and name "HG23") OR (segid " " and resid "91 " and name "HG22") OR (segid " " and resid "91 " and name "HG21") ) 5.000 5.000 0.000 peak 10837 weight 0.10000E+01 volume -0.11300E+01 ppm1 3.910 ppm2 1.141 ASSI ( (segid " " and resid "53 " and name "HA ") )( (segid " " and resid "58 " and name "HB ") OR (segid " " and resid "51 " and name "HG1 ") ) 6.000 6.000 0.000 peak 10838 weight 0.10000E+01 volume -0.20300E+00 ppm1 3.907 ppm2 2.311 ASSI ( (segid " " and resid "35 " and name "HA ") )( (segid " " and resid "30 " and name "HD23") OR (segid " " and resid "30 " and name "HD22") OR (segid " " and resid "30 " and name "HD21") OR (segid " " and resid "29 " and name "HD23") OR (segid " " and resid "29 " and name "HD22") OR (segid " " and resid "29 " and name "HD21") OR (segid " " and resid "29 " and name "HD12") ) 5.000 5.000 0.000 peak 10840 weight 0.10000E+01 volume -0.17960E+01 ppm1 3.791 ppm2 0.737 ASSI ( (segid " " and resid "126 " and name "HB2 ") OR (segid " " and resid "126 " and name "HB1 ") )( (segid " " and resid "159 " and name "HG11") OR (segid " " and resid "159 " and name "HB ") ) 5.000 5.000 0.000 peak 10841 weight 0.10000E+01 volume -0.30100E+00 ppm1 3.878 ppm2 1.903 ASSI ( (segid " " and resid "126 " and name "HB2 ") OR (segid " " and resid "126 " and name "HB1 ") )( (segid " " and resid "125 " and name "HB ") ) 5.000 5.000 0.000 peak 10842 weight 0.10000E+01 volume -0.57100E+00 ppm1 3.878 ppm2 2.245 ASSI ( (segid " " and resid "126 " and name "HA ") OR (segid " " and resid "107 " and name "HB2 ") OR (segid " " and resid "107 " and name "HB1 ") OR (segid " " and resid "55 " and name "HB1 ") )( (segid " " and resid "128 " and name "HB1 ") OR (segid " " and resid "113 " and name "HB ") OR (segid " " and resid "105 " and name "HG ") OR (segid " " and resid "62 " and name "HG ") OR (segid " " and resid "51 " and name "HE3 ") OR (segid " " and resid "51 " and name "HE2 ") OR (segid " " and resid "51 " and name "HE1 ") OR (segid " " and resid "27 " and name "HG1 ") ) 6.000 6.000 0.000 peak 9756 weight 0.10000E+01 volume -0.21600E+00 ppm1 3.988 ppm2 1.690 ASSI ( (segid " " and resid "55 " and name "HB2 ") )( (segid " " and resid "56 " and name "HG2 ") OR (segid " " and resid "56 " and name "HG1 ") OR (segid " " and resid "56 " and name "HB1 ") OR (segid " " and resid "52 " and name "HE3 ") OR (segid " " and resid "52 " and name "HE2 ") OR (segid " " and resid "52 " and name "HE1 ") ) 5.000 5.000 0.000 peak 10843 weight 0.10000E+01 volume -0.44900E+00 ppm1 3.682 ppm2 2.083 ASSI ( (segid " " and resid "126 " and name "HA ") OR (segid " " and resid "55 " and name "HB1 ") )( (segid " " and resid "165 " and name "HE2 ") OR (segid " " and resid "56 " and name "HG2 ") OR (segid " " and resid "56 " and name "HG1 ") OR (segid " " and resid "52 " and name "HE3 ") OR (segid " " and resid "52 " and name "HE2 ") OR (segid " " and resid "52 " and name "HE1 ") OR (segid " " and resid "52 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10844 weight 0.10000E+01 volume -0.58600E+00 ppm1 3.992 ppm2 2.083 ASSI ( (segid " " and resid "55 " and name "HB1 ") )( (segid " " and resid "58 " and name "HB ") ) 5.000 5.000 0.000 peak 9761 weight 0.10000E+01 volume -0.57900E+00 ppm1 3.988 ppm2 2.319 ASSI ( (segid " " and resid "110 " and name "HB2 ") OR (segid " " and resid "55 " and name "HB2 ") )( (segid " " and resid "109 " and name "HA1 ") OR (segid " " and resid "56 " and name "HA ") OR (segid " " and resid "21 " and name "HA1 ") ) 5.000 5.000 0.000 peak 10845 weight 0.10000E+01 volume -0.42200E+00 ppm1 3.685 ppm2 4.275 ASSI ( (segid " " and resid "35 " and name "HA ") )( (segid " " and resid "10 " and name "HG23") OR (segid " " and resid "10 " and name "HG22") OR (segid " " and resid "10 " and name "HG21") OR (segid " " and resid "10 " and name "HG12") OR (segid " " and resid "10 " and name "HG11") ) 5.000 5.000 0.000 peak 10846 weight 0.10000E+01 volume -0.83000E+00 ppm1 3.796 ppm2 1.121 ASSI ( (segid " " and resid "35 " and name "HA ") )( (segid " " and resid "39 " and name "HB3 ") OR (segid " " and resid "39 " and name "HB2 ") OR (segid " " and resid "39 " and name "HB1 ") OR (segid " " and resid "34 " and name "HG ") OR (segid " " and resid "14 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10847 weight 0.10000E+01 volume -0.31700E+00 ppm1 3.795 ppm2 1.385 ASSI ( (segid " " and resid "69 " and name "HA ") )( (segid " " and resid "100 " and name "HB3 ") OR (segid " " and resid "100 " and name "HB2 ") OR (segid " " and resid "100 " and name "HB1 ") OR (segid " " and resid "95 " and name "HB2 ") OR (segid " " and resid "67 " and name "HB3 ") OR (segid " " and resid "67 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10848 weight 0.10000E+01 volume -0.49800E+00 ppm1 4.406 ppm2 1.135 ASSI ( (segid " " and resid "69 " and name "HA ") )( (segid " " and resid "48 " and name "HD13") OR (segid " " and resid "48 " and name "HD12") OR (segid " " and resid "48 " and name "HD11") ) 3.300 3.300 0.000 peak 10849 weight 0.10000E+01 volume -0.32590E+01 ppm1 4.408 ppm2 0.819 ASSI ( (segid " " and resid "140 " and name "HB1 ") )( (segid " " and resid "142 " and name "HG ") ) 5.000 5.000 0.000 peak 10850 weight 0.10000E+01 volume -0.42000E+00 ppm1 4.102 ppm2 1.513 ASSI ( (segid " " and resid "114 " and name "HA ") )( (segid " " and resid "117 " and name "HG21") OR (segid " " and resid "117 " and name "HG12") OR (segid " " and resid "113 " and name "HG23") OR (segid " " and resid "113 " and name "HG22") OR (segid " " and resid "113 " and name "HG21") ) 5.000 5.000 0.000 peak 10851 weight 0.10000E+01 volume -0.12360E+01 ppm1 3.968 ppm2 0.766 ASSI ( (segid " " and resid "37 " and name "HA ") )( (segid " " and resid "30 " and name "HD23") OR (segid " " and resid "30 " and name "HD21") ) 5.000 5.000 0.000 peak 10852 weight 0.10000E+01 volume -0.12990E+01 ppm1 4.099 ppm2 0.767 ASSI ( (segid " " and resid "37 " and name "HA ") )( (segid " " and resid "67 " and name "HB3 ") OR (segid " " and resid "67 " and name "HB2 ") OR (segid " " and resid "67 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10853 weight 0.10000E+01 volume -0.73000E+00 ppm1 4.101 ppm2 1.121 ASSI ( (segid " " and resid "56 " and name "HA ") )( (segid " " and resid "94 " and name "HA ") OR (segid " " and resid "56 " and name "HD1 ") OR (segid " " and resid "55 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10854 weight 0.10000E+01 volume -0.57100E+00 ppm1 4.314 ppm2 4.011 ASSI ( (segid " " and resid "56 " and name "HA ") )( (segid " " and resid "59 " and name "HB3 ") OR (segid " " and resid "59 " and name "HB2 ") OR (segid " " and resid "59 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10855 weight 0.10000E+01 volume -0.10820E+01 ppm1 4.311 ppm2 1.319 ASSI ( (segid " " and resid "56 " and name "HA ") )( (segid " " and resid "94 " and name "HG22") OR (segid " " and resid "94 " and name "HG21") ) 5.000 5.000 0.000 peak 10856 weight 0.10000E+01 volume -0.53800E+00 ppm1 4.307 ppm2 0.969 ASSI ( (segid " " and resid "117 " and name "HA ") )( (segid " " and resid "156 " and name "HB2 ") OR (segid " " and resid "147 " and name "HD13") OR (segid " " and resid "147 " and name "HD12") OR (segid " " and resid "147 " and name "HD11") ) 6.000 6.000 0.000 peak 10857 weight 0.10000E+01 volume -0.23200E+00 ppm1 3.514 ppm2 1.193 ASSI ( (segid " " and resid "56 " and name "HA ") )( (segid " " and resid "93 " and name "HD2 ") OR (segid " " and resid "57 " and name "HB3 ") OR (segid " " and resid "57 " and name "HB2 ") OR (segid " " and resid "57 " and name "HB1 ") ) 6.000 6.000 0.000 peak 9845 weight 0.10000E+01 volume -0.18700E+00 ppm1 4.315 ppm2 1.433 ASSI ( (segid " " and resid "56 " and name "HA ") )( (segid " " and resid "94 " and name "HB ") ) 6.000 6.000 0.000 peak 10858 weight 0.10000E+01 volume -0.27500E+00 ppm1 4.311 ppm2 2.273 ASSI ( (segid " " and resid "56 " and name "HA ") )( (segid " " and resid "91 " and name "HA ") ) 5.000 5.000 0.000 peak 10859 weight 0.10000E+01 volume -0.91800E+00 ppm1 4.309 ppm2 3.761 ASSI ( (segid " " and resid "130 " and name "HA ") )( (segid " " and resid "134 " and name "HD13") OR (segid " " and resid "134 " and name "HD12") OR (segid " " and resid "134 " and name "HD11") ) 6.000 6.000 0.000 peak 10860 weight 0.10000E+01 volume -0.18100E+00 ppm1 4.156 ppm2 0.919 ASSI ( (segid " " and resid "78 " and name "HB2 ") )( (segid " " and resid "72 " and name "HG2 ") OR (segid " " and resid "72 " and name "HG1 ") ) 5.000 5.000 0.000 peak 10861 weight 0.10000E+01 volume -0.49000E+00 ppm1 4.288 ppm2 2.247 ASSI ( (segid " " and resid "78 " and name "HB1 ") )( (segid " " and resid "80 " and name "HG12") OR (segid " " and resid "80 " and name "HG11") OR (segid " " and resid "71 " and name "HG13") OR (segid " " and resid "71 " and name "HG12") OR (segid " " and resid "71 " and name "HG11") ) 5.000 5.000 0.000 peak 10862 weight 0.10000E+01 volume -0.41000E+00 ppm1 4.456 ppm2 0.852 ASSI ( (segid " " and resid "78 " and name "HB2 ") )( (segid " " and resid "80 " and name "HG13") OR (segid " " and resid "80 " and name "HG12") ) 5.000 5.000 0.000 peak 10863 weight 0.10000E+01 volume -0.45200E+00 ppm1 4.288 ppm2 0.872 ASSI ( (segid " " and resid "78 " and name "HB1 ") )( (segid " " and resid "106 " and name "HB2 ") OR (segid " " and resid "104 " and name "HB3 ") OR (segid " " and resid "104 " and name "HB2 ") OR (segid " " and resid "104 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10864 weight 0.10000E+01 volume -0.19300E+00 ppm1 4.475 ppm2 1.326 ASSI ( (segid " " and resid "78 " and name "HB1 ") )( (segid " " and resid "72 " and name "HG2 ") OR (segid " " and resid "72 " and name "HG1 ") OR (segid " " and resid "49 " and name "HG2 ") ) 6.000 6.000 0.000 peak 10865 weight 0.10000E+01 volume -0.23200E+00 ppm1 4.448 ppm2 2.233 ASSI ( (segid " " and resid "10 " and name "HA ") )( (segid " " and resid "13 " and name "HD2 ") OR (segid " " and resid "13 " and name "HD1 ") ) 5.000 5.000 0.000 peak 10866 weight 0.10000E+01 volume -0.79900E+00 ppm1 3.902 ppm2 3.173 ASSI ( (segid " " and resid "113 " and name "HA ") )( (segid " " and resid "125 " and name "HA ") ) 6.000 6.000 0.000 peak 10867 weight 0.10000E+01 volume -0.27600E+00 ppm1 3.835 ppm2 3.381 ASSI ( (segid " " and resid "132 " and name "HB2 ") OR (segid " " and resid "132 " and name "HB1 ") )( (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") ) 5.000 5.000 0.000 peak 10868 weight 0.10000E+01 volume -0.38000E+00 ppm1 3.514 ppm2 1.166 ASSI ( (segid " " and resid "10 " and name "HA ") )( (segid " " and resid "14 " and name "HA ") OR (segid " " and resid "13 " and name "HA ") ) 5.000 5.000 0.000 peak 10869 weight 0.10000E+01 volume -0.60200E+00 ppm1 3.888 ppm2 4.102 ASSI ( (segid " " and resid "132 " and name "HB2 ") OR (segid " " and resid "132 " and name "HB1 ") )( (segid " " and resid "129 " and name "HA ") ) 5.000 5.000 0.000 peak 10870 weight 0.10000E+01 volume -0.71100E+00 ppm1 3.526 ppm2 3.738 ASSI ( (segid " " and resid "80 " and name "HA ") )( (segid " " and resid "83 " and name "HB3 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "83 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10871 weight 0.10000E+01 volume -0.18170E+01 ppm1 3.687 ppm2 1.329 ASSI ( (segid " " and resid "124 " and name "HA ") )( (segid " " and resid "127 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10872 weight 0.10000E+01 volume -0.47100E+00 ppm1 3.752 ppm2 2.952 ASSI ( (segid " " and resid "91 " and name "HA ") )( (segid " " and resid "56 " and name "HG2 ") OR (segid " " and resid "56 " and name "HG1 ") OR (segid " " and resid "56 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9898 weight 0.10000E+01 volume -0.16230E+01 ppm1 3.765 ppm2 2.050 ASSI ( (segid " " and resid "124 " and name "HA ") )( (segid " " and resid "127 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10873 weight 0.10000E+01 volume -0.61800E+00 ppm1 3.755 ppm2 3.408 ASSI ( (segid " " and resid "94 " and name "HA ") )( (segid " " and resid "59 " and name "HB3 ") OR (segid " " and resid "59 " and name "HB2 ") OR (segid " " and resid "59 " and name "HB1 ") ) 5.000 5.000 0.000 peak 9905 weight 0.10000E+01 volume -0.35000E+00 ppm1 4.048 ppm2 1.312 ASSI ( (segid " " and resid "91 " and name "HA ") )( (segid " " and resid "56 " and name "HA ") ) 5.000 5.000 0.000 peak 10874 weight 0.10000E+01 volume -0.74200E+00 ppm1 3.761 ppm2 4.306 ASSI ( (segid " " and resid "144 " and name "HA ") )( (segid " " and resid "144 " and name "HD1 ") ) 6.000 6.000 0.000 peak 10875 weight 0.10000E+01 volume -0.20200E+00 ppm1 3.680 ppm2 4.296 ASSI ( (segid " " and resid "144 " and name "HA ") )( (segid " " and resid "147 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10876 weight 0.10000E+01 volume -0.48500E+00 ppm1 3.675 ppm2 2.149 ASSI ( (segid " " and resid "144 " and name "HA ") )( (segid " " and resid "114 " and name "HD2 ") ) 6.000 6.000 0.000 peak 10877 weight 0.10000E+01 volume -0.20400E+00 ppm1 3.683 ppm2 6.956 ASSI ( (segid " " and resid "112 " and name "HA ") )( (segid " " and resid "115 " and name "HD22") OR (segid " " and resid "115 " and name "HD21") ) 5.000 5.000 0.000 peak 10878 weight 0.10000E+01 volume -0.60600E+00 ppm1 4.141 ppm2 0.963 ASSI ( (segid " " and resid "112 " and name "HA ") )( (segid " " and resid "112 " and name "HG1 ") ) 5.000 5.000 0.000 peak 10879 weight 0.10000E+01 volume -0.43500E+00 ppm1 4.137 ppm2 1.802 ASSI ( (segid " " and resid "112 " and name "HA ") )( (segid " " and resid "84 " and name "HB3 ") OR (segid " " and resid "84 " and name "HB2 ") OR (segid " " and resid "84 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10880 weight 0.10000E+01 volume -0.74400E+00 ppm1 4.140 ppm2 1.448 ASSI ( (segid " " and resid "112 " and name "HA ") )( (segid " " and resid "115 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10881 weight 0.10000E+01 volume -0.28700E+00 ppm1 4.141 ppm2 2.234 ASSI ( (segid " " and resid "112 " and name "HA ") )( (segid " " and resid "81 " and name "HA ") ) 5.000 5.000 0.000 peak 10882 weight 0.10000E+01 volume -0.91500E+00 ppm1 4.136 ppm2 3.888 ASSI ( (segid " " and resid "127 " and name "HB1 ") OR (segid " " and resid "58 " and name "HA ") )( (segid " " and resid "128 " and name "HD13") OR (segid " " and resid "62 " and name "HD13") OR (segid " " and resid "62 " and name "HD12") OR (segid " " and resid "62 " and name "HD11") OR (segid " " and resid "30 " and name "HD13") OR (segid " " and resid "30 " and name "HD12") OR (segid " " and resid "30 " and name "HD11") ) 6.000 6.000 0.000 peak 10883 weight 0.10000E+01 volume -0.13600E+00 ppm1 3.419 ppm2 0.685 ASSI ( (segid " " and resid "58 " and name "HA ") )( (segid " " and resid "26 " and name "HG23") OR (segid " " and resid "26 " and name "HG21") ) 5.000 5.000 0.000 peak 10884 weight 0.10000E+01 volume -0.73800E+00 ppm1 3.415 ppm2 0.814 ASSI ( (segid " " and resid "127 " and name "HB1 ") OR (segid " " and resid "58 " and name "HA ") )( (segid " " and resid "128 " and name "HA ") OR (segid " " and resid "126 " and name "HB2 ") OR (segid " " and resid "126 " and name "HB1 ") OR (segid " " and resid "61 " and name "HA ") OR (segid " " and resid "18 " and name "HA ") ) 6.000 6.000 0.000 peak 10885 weight 0.10000E+01 volume -0.11000E+00 ppm1 3.420 ppm2 3.851 ASSI ( (segid " " and resid "127 " and name "HB1 ") OR (segid " " and resid "58 " and name "HA ") )( (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "93 " and name "HD2 ") OR (segid " " and resid "93 " and name "HD1 ") OR (segid " " and resid "57 " and name "HB3 ") OR (segid " " and resid "57 " and name "HB2 ") OR (segid " " and resid "57 " and name "HB1 ") OR (segid " " and resid "51 " and name "HB2 ") OR (segid " " and resid "27 " and name "HG2 ") ) 6.000 6.000 0.000 peak 10886 weight 0.10000E+01 volume -0.25900E+00 ppm1 3.417 ppm2 1.447 ASSI ( (segid " " and resid "58 " and name "HA ") )( (segid " " and resid "61 " and name "HB1 ") OR (segid " " and resid "23 " and name "HB ") ) 5.000 5.000 0.000 peak 10887 weight 0.10000E+01 volume -0.49000E+00 ppm1 3.417 ppm2 1.960 ASSI ( (segid " " and resid "58 " and name "HA ") )( (segid " " and resid "26 " and name "HB ") ) 6.000 6.000 0.000 peak 10888 weight 0.10000E+01 volume -0.24800E+00 ppm1 3.413 ppm2 2.146 ASSI ( (segid " " and resid "91 " and name "HB ") )( (segid " " and resid "95 " and name "HD13") OR (segid " " and resid "95 " and name "HD12") OR (segid " " and resid "95 " and name "HD11") ) 6.000 6.000 0.000 peak 10889 weight 0.10000E+01 volume -0.10600E+00 ppm1 4.208 ppm2 0.766 ASSI ( (segid " " and resid "91 " and name "HB ") )( (segid " " and resid "90 " and name "HB2 ") OR (segid " " and resid "88 " and name "HB2 ") ) 6.000 6.000 0.000 peak 10890 weight 0.10000E+01 volume -0.28800E+00 ppm1 4.208 ppm2 2.532 ASSI ( (segid " " and resid "91 " and name "HB ") )( (segid " " and resid "88 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10891 weight 0.10000E+01 volume -0.25800E+00 ppm1 4.208 ppm2 3.434 ASSI ( (segid " " and resid "125 " and name "HA ") OR (segid " " and resid "26 " and name "HA ") )( (segid " " and resid "128 " and name "HA ") OR (segid " " and resid "113 " and name "HA ") OR (segid " " and resid "18 " and name "HA ") ) 5.000 5.000 0.000 peak 10892 weight 0.10000E+01 volume -0.41800E+00 ppm1 3.376 ppm2 3.828 ASSI ( (segid " " and resid "125 " and name "HA ") OR (segid " " and resid "26 " and name "HA ") )( (segid " " and resid "128 " and name "HB1 ") OR (segid " " and resid "113 " and name "HB ") OR (segid " " and resid "62 " and name "HG ") ) 5.000 5.000 0.000 peak 10893 weight 0.10000E+01 volume -0.44200E+00 ppm1 3.372 ppm2 1.728 ASSI ( (segid " " and resid "125 " and name "HA ") OR (segid " " and resid "26 " and name "HA ") )( (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD12") OR (segid " " and resid "113 " and name "HD11") OR (segid " " and resid "29 " and name "HD13") OR (segid " " and resid "29 " and name "HD12") OR (segid " " and resid "29 " and name "HD11") ) 3.300 3.300 0.000 peak 10894 weight 0.10000E+01 volume -0.32160E+01 ppm1 3.367 ppm2 0.740 ASSI ( (segid " " and resid "125 " and name "HA ") OR (segid " " and resid "26 " and name "HA ") )( (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB1 ") OR (segid " " and resid "113 " and name "HG11") OR (segid " " and resid "17 " and name "HB2 ") OR (segid " " and resid "17 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10895 weight 0.10000E+01 volume -0.11540E+01 ppm1 3.367 ppm2 1.477 ASSI ( (segid " " and resid "108 " and name "HB ") )( (segid " " and resid "139 " and name "HB3 ") OR (segid " " and resid "139 " and name "HB2 ") OR (segid " " and resid "139 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10034 weight 0.10000E+01 volume -0.64100E+00 ppm1 4.555 ppm2 1.396 ASSI ( (segid " " and resid "46 " and name "HB ") )( (segid " " and resid "71 " and name "HG23") OR (segid " " and resid "71 " and name "HG22") OR (segid " " and resid "71 " and name "HG21") ) 6.000 6.000 0.000 peak 10896 weight 0.10000E+01 volume -0.18500E+00 ppm1 4.929 ppm2 0.926 ASSI ( (segid " " and resid "31 " and name "HD2 ") )( (segid " " and resid "27 " and name "HB2 ") OR (segid " " and resid "27 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10897 weight 0.10000E+01 volume -0.20700E+00 ppm1 6.957 ppm2 1.886 ASSI ( (segid " " and resid "31 " and name "HD2 ") )( (segid " " and resid "27 " and name "HG1 ") ) 6.000 6.000 0.000 peak 10898 weight 0.10000E+01 volume -0.15900E+00 ppm1 6.957 ppm2 1.713 ASSI ( (segid " " and resid "31 " and name "HD2 ") )( (segid " " and resid "27 " and name "HG2 ") ) 5.000 5.000 0.000 peak 10899 weight 0.10000E+01 volume -0.31700E+00 ppm1 6.958 ppm2 1.485 ASSI ( (segid " " and resid "83 " and name "HB3 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "83 " and name "HB1 ") )( (segid " " and resid "53 " and name "HD2 ") OR (segid " " and resid "53 " and name "HD1 ") ) 5.000 5.000 0.000 peak 10900 weight 0.10000E+01 volume -0.79100E+00 ppm1 1.326 ppm2 7.197 ASSI ( (segid " " and resid "83 " and name "HB3 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "83 " and name "HB1 ") )( (segid " " and resid "53 " and name "HE2 ") OR (segid " " and resid "53 " and name "HE1 ") ) 5.000 5.000 0.000 peak 10901 weight 0.10000E+01 volume -0.47200E+00 ppm1 1.325 ppm2 7.313 ASSI ( (segid " " and resid "83 " and name "HB3 ") OR (segid " " and resid "83 " and name "HB2 ") OR (segid " " and resid "83 " and name "HB1 ") )( (segid " " and resid "53 " and name "HZ ") ) 6.000 6.000 0.000 peak 10902 weight 0.10000E+01 volume -0.17500E+00 ppm1 1.326 ppm2 7.437 ASSI ( (segid " " and resid "94 " and name "HG13") OR (segid " " and resid "94 " and name "HG12") OR (segid " " and resid "94 " and name "HG11") OR (segid " " and resid "46 " and name "HG23") OR (segid " " and resid "46 " and name "HG22") OR (segid " " and resid "46 " and name "HG21") )( (segid " " and resid "93 " and name "HE1 ") OR (segid " " and resid "90 " and name "HB1 ") OR (segid " " and resid "49 " and name "HG1 ") ) 5.000 5.000 0.000 peak 10903 weight 0.10000E+01 volume -0.31000E+00 ppm1 1.193 ppm2 2.740 ASSI ( (segid " " and resid "112 " and name "HD1 ") )( (segid " " and resid "111 " and name "HA ") ) 5.000 5.000 0.000 peak 10905 weight 0.10000E+01 volume 0.70600E+00 ppm1 4.295 ppm2 5.287 ASSI ( (segid " " and resid "112 " and name "HD2 ") )( (segid " " and resid "111 " and name "HA ") ) 6.000 6.000 0.000 peak 10906 weight 0.10000E+01 volume 0.26600E+00 ppm1 3.964 ppm2 5.282 ASSI ( (segid " " and resid "114 " and name "HD2 ") )( (segid " " and resid "147 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10907 weight 0.10000E+01 volume -0.24900E+00 ppm1 6.957 ppm2 2.127 ASSI ( (segid " " and resid "114 " and name "HD2 ") )( (segid " " and resid "147 " and name "HB2 ") ) 5.000 5.000 0.000 peak 10908 weight 0.10000E+01 volume -0.45300E+00 ppm1 6.958 ppm2 1.567 ASSI ( (segid " " and resid "114 " and name "HD2 ") )( (segid " " and resid "147 " and name "HD13") OR (segid " " and resid "147 " and name "HD12") OR (segid " " and resid "147 " and name "HD11") ) 5.000 5.000 0.000 peak 10909 weight 0.10000E+01 volume -0.10140E+01 ppm1 6.962 ppm2 1.187 ASSI ( (segid " " and resid "114 " and name "HD2 ") )( (segid " " and resid "147 " and name "HD23") OR (segid " " and resid "147 " and name "HD22") OR (segid " " and resid "147 " and name "HD21") ) 5.000 5.000 0.000 peak 10910 weight 0.10000E+01 volume -0.39600E+00 ppm1 6.957 ppm2 1.043 ASSI ( (segid " " and resid "16 " and name "HA1 ") )( (segid " " and resid "19 " and name "HB3 ") OR (segid " " and resid "19 " and name "HB2 ") OR (segid " " and resid "19 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10251 weight 0.10000E+01 volume 0.52500E+00 ppm1 3.979 ppm2 1.545 ASSI ( (segid " " and resid "16 " and name "HA2 ") )( (segid " " and resid "19 " and name "HB3 ") OR (segid " " and resid "19 " and name "HB2 ") OR (segid " " and resid "19 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10250 weight 0.10000E+01 volume 0.57700E+00 ppm1 3.838 ppm2 1.547 ASSI ( (segid " " and resid "22 " and name "HB1 ") )( (segid " " and resid "25 " and name "HB1 ") ) 6.000 6.000 0.000 peak 10946 weight 0.10000E+01 volume 0.27700E+00 ppm1 3.082 ppm2 1.963 ASSI ( (segid " " and resid "22 " and name "HB2 ") )( (segid " " and resid "25 " and name "HB1 ") OR (segid " " and resid "20 " and name "HB2 ") OR (segid " " and resid "20 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10947 weight 0.10000E+01 volume 0.44000E+00 ppm1 2.421 ppm2 1.950 ASSI ( (segid " " and resid "22 " and name "HB1 ") )( (segid " " and resid "17 " and name "HB3 ") OR (segid " " and resid "17 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10948 weight 0.10000E+01 volume 0.38500E+00 ppm1 3.071 ppm2 1.515 ASSI ( (segid " " and resid "22 " and name "HB1 ") )( (segid " " and resid "17 " and name "HA ") ) 6.000 6.000 0.000 peak 10949 weight 0.10000E+01 volume 0.24800E+00 ppm1 3.061 ppm2 4.133 ASSI ( (segid " " and resid "22 " and name "HB2 ") )( (segid " " and resid "17 " and name "HB3 ") OR (segid " " and resid "17 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10950 weight 0.10000E+01 volume 0.31500E+00 ppm1 2.441 ppm2 1.514 ASSI ( (segid " " and resid "22 " and name "HB2 ") )( (segid " " and resid "17 " and name "HA ") ) 6.000 6.000 0.000 peak 10951 weight 0.10000E+01 volume 0.19600E+00 ppm1 2.436 ppm2 4.144 ASSI ( (segid " " and resid "23 " and name "HA ") )( (segid " " and resid "58 " and name "HG11") OR (segid " " and resid "26 " and name "HG13") OR (segid " " and resid "26 " and name "HG12") OR (segid " " and resid "23 " and name "HG23") OR (segid " " and resid "23 " and name "HG22") OR (segid " " and resid "23 " and name "HG21") OR (segid " " and resid "23 " and name "HG13") OR (segid " " and resid "23 " and name "HG11") ) 2.700 2.700 0.000 peak 10956 weight 0.10000E+01 volume -0.44560E+01 ppm1 3.381 ppm2 0.926 ASSI ( (segid " " and resid "23 " and name "HA ") )( (segid " " and resid "57 " and name "HB3 ") OR (segid " " and resid "57 " and name "HB2 ") OR (segid " " and resid "57 " and name "HB1 ") OR (segid " " and resid "27 " and name "HG2 ") ) 6.000 6.000 0.000 peak 10957 weight 0.10000E+01 volume -0.18800E+00 ppm1 3.372 ppm2 1.468 ASSI ( (segid " " and resid "23 " and name "HA ") )( (segid " " and resid "26 " and name "HG23") OR (segid " " and resid "26 " and name "HG22") OR (segid " " and resid "26 " and name "HG21") ) 5.000 5.000 0.000 peak 10959 weight 0.10000E+01 volume -0.90900E+00 ppm1 3.372 ppm2 0.809 ASSI ( (segid " " and resid "23 " and name "HA ") )( (segid " " and resid "26 " and name "HB ") ) 5.000 5.000 0.000 peak 10960 weight 0.10000E+01 volume -0.14400E+01 ppm1 3.381 ppm2 2.172 ASSI ( (segid " " and resid "23 " and name "HG23") OR (segid " " and resid "23 " and name "HG22") OR (segid " " and resid "23 " and name "HG21") )( (segid " " and resid "56 " and name "HD1 ") OR (segid " " and resid "55 " and name "HB1 ") OR (segid " " and resid "24 " and name "HA ") ) 5.000 5.000 0.000 peak 10965 weight 0.10000E+01 volume -0.11460E+01 ppm1 0.919 ppm2 4.009 ASSI ( (segid " " and resid "23 " and name "HG23") OR (segid " " and resid "23 " and name "HG22") OR (segid " " and resid "23 " and name "HG21") )( (segid " " and resid "55 " and name "HB2 ") ) 6.000 6.000 0.000 peak 10966 weight 0.10000E+01 volume -0.25400E+00 ppm1 0.913 ppm2 3.673 ASSI ( (segid " " and resid "23 " and name "HG23") OR (segid " " and resid "23 " and name "HG22") OR (segid " " and resid "23 " and name "HG21") )( (segid " " and resid "27 " and name "HD2 ") OR (segid " " and resid "27 " and name "HD1 ") ) 5.000 5.000 0.000 peak 10967 weight 0.10000E+01 volume -0.86000E+00 ppm1 0.916 ppm2 3.100 ASSI ( (segid " " and resid "24 " and name "HG1 ") )( (segid " " and resid "23 " and name "HG21") OR (segid " " and resid "23 " and name "HG13") OR (segid " " and resid "23 " and name "HG11") ) 5.000 5.000 0.000 peak 10968 weight 0.10000E+01 volume 0.10450E+01 ppm1 2.504 ppm2 0.917 ASSI ( (segid " " and resid "24 " and name "HG2 ") )( (segid " " and resid "23 " and name "HG13") OR (segid " " and resid "23 " and name "HG12") OR (segid " " and resid "23 " and name "HG11") ) 5.000 5.000 0.000 peak 10969 weight 0.10000E+01 volume 0.96100E+00 ppm1 2.455 ppm2 0.919 ASSI ( (segid " " and resid "125 " and name "HA ") OR (segid " " and resid "26 " and name "HA ") )( (segid " " and resid "128 " and name "HG ") OR (segid " " and resid "30 " and name "HG ") OR (segid " " and resid "29 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10977 weight 0.10000E+01 volume -0.65200E+00 ppm1 3.389 ppm2 1.983 ASSI ( (segid " " and resid "125 " and name "HA ") OR (segid " " and resid "26 " and name "HA ") )( (segid " " and resid "116 " and name "HB3 ") OR (segid " " and resid "116 " and name "HB2 ") OR (segid " " and resid "116 " and name "HB1 ") OR (segid " " and resid "113 " and name "HG11") OR (segid " " and resid "17 " and name "HB2 ") OR (segid " " and resid "17 " and name "HB1 ") ) 5.000 5.000 0.000 peak 10978 weight 0.10000E+01 volume -0.10670E+01 ppm1 3.392 ppm2 1.505 ASSI ( (segid " " and resid "27 " and name "HB2 ") OR (segid " " and resid "27 " and name "HB1 ") )( (segid " " and resid "31 " and name "HD2 ") ) 6.000 6.000 0.000 peak 10985 weight 0.10000E+01 volume -0.16900E+00 ppm1 1.886 ppm2 6.957 ASSI ( (segid " " and resid "27 " and name "HD2 ") OR (segid " " and resid "27 " and name "HD1 ") )( (segid " " and resid "61 " and name "HG1 ") OR (segid " " and resid "24 " and name "HG2 ") OR (segid " " and resid "24 " and name "HG1 ") ) 6.000 6.000 0.000 peak 10988 weight 0.10000E+01 volume 0.24500E+00 ppm1 3.102 ppm2 2.464 ASSI ( (segid " " and resid "27 " and name "HD2 ") OR (segid " " and resid "27 " and name "HD1 ") )( (segid " " and resid "28 " and name "HA ") OR (segid " " and resid "24 " and name "HA ") ) 5.000 5.000 0.000 peak 10989 weight 0.10000E+01 volume 0.67900E+00 ppm1 3.103 ppm2 4.014 ASSI ( (segid " " and resid "27 " and name "HG1 ") )( (segid " " and resid "31 " and name "HD2 ") ) 6.000 6.000 0.000 peak 10991 weight 0.10000E+01 volume -0.11100E+00 ppm1 1.700 ppm2 6.957 ASSI ( (segid " " and resid "27 " and name "HG2 ") )( (segid " " and resid "31 " and name "HD2 ") ) 6.000 6.000 0.000 peak 10992 weight 0.10000E+01 volume -0.12300E+00 ppm1 1.478 ppm2 6.958 ASSI ( (segid " " and resid "31 " and name "HD2 ") )( (segid " " and resid "31 " and name "HB2 ") OR (segid " " and resid "31 " and name "HB1 ") OR (segid " " and resid "27 " and name "HD2 ") OR (segid " " and resid "27 " and name "HD1 ") ) 6.000 6.000 0.000 peak 11039 weight 0.10000E+01 volume -0.17600E+00 ppm1 6.954 ppm2 3.110 ASSI ( (segid " " and resid "62 " and name "HD13") OR (segid " " and resid "62 " and name "HD12") OR (segid " " and resid "62 " and name "HD11") )( (segid " " and resid "48 " and name "HA ") OR (segid " " and resid "18 " and name "HA ") ) 3.300 3.300 0.000 peak 11335 weight 0.10000E+01 volume -0.36560E+01 ppm1 0.699 ppm2 3.783 ASSI ( (segid " " and resid "81 " and name "HD2 ") )( (segid " " and resid "81 " and name "HB2 ") ) 6.000 6.000 0.000 peak 11469 weight 0.10000E+01 volume -0.99000E-01 ppm1 6.527 ppm2 3.273 ASSI ( (segid " " and resid "95 " and name "HD13") OR (segid " " and resid "95 " and name "HD12") OR (segid " " and resid "95 " and name "HD11") )( (segid " " and resid "53 " and name "HD2 ") OR (segid " " and resid "53 " and name "HD1 ") ) 6.000 6.000 0.000 peak 11601 weight 0.10000E+01 volume -0.12900E+00 ppm1 0.766 ppm2 7.197 ASSI ( (segid " " and resid "95 " and name "HD13") OR (segid " " and resid "95 " and name "HD12") OR (segid " " and resid "95 " and name "HD11") )( (segid " " and resid "53 " and name "HE2 ") OR (segid " " and resid "53 " and name "HE1 ") ) 6.000 6.000 0.000 peak 11602 weight 0.10000E+01 volume -0.21200E+00 ppm1 0.766 ppm2 7.304 ASSI ( (segid " " and resid "95 " and name "HD12") OR (segid " " and resid "95 " and name "HD11") )( (segid " " and resid "53 " and name "HZ ") ) 6.000 6.000 0.000 peak 11603 weight 0.10000E+01 volume -0.50000E-01 ppm1 0.766 ppm2 7.451 ASSI ( (segid " " and resid "111 " and name "HD13") OR (segid " " and resid "111 " and name "HD12") OR (segid " " and resid "111 " and name "HD11") )( (segid " " and resid "103 " and name "HA ") ) 6.000 6.000 0.000 peak 11706 weight 0.10000E+01 volume -0.29300E+00 ppm1 1.193 ppm2 5.316 ASSI ( (segid " " and resid "113 " and name "HA ") )( (segid " " and resid "128 " and name "HD13") OR (segid " " and resid "128 " and name "HD12") OR (segid " " and resid "128 " and name "HD11") OR (segid " " and resid "113 " and name "HD12") ) 3.300 3.300 0.000 peak 11725 weight 0.10000E+01 volume -0.27790E+01 ppm1 3.835 ppm2 0.744 ASSI ( (segid " " and resid "113 " and name "HB ") )( (segid " " and resid "128 " and name "HD13") OR (segid " " and resid "128 " and name "HD12") OR (segid " " and resid "128 " and name "HD11") OR (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD12") OR (segid " " and resid "113 " and name "HG23") OR (segid " " and resid "113 " and name "HG22") OR (segid " " and resid "113 " and name "HG21") ) 3.300 3.300 0.000 peak 11727 weight 0.10000E+01 volume 0.24040E+01 ppm1 1.735 ppm2 0.735 ASSI ( (segid " " and resid "113 " and name "HG11") )( (segid " " and resid "117 " and name "HG12") OR (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD12") OR (segid " " and resid "113 " and name "HD11") OR (segid " " and resid "113 " and name "HG23") OR (segid " " and resid "113 " and name "HG22") OR (segid " " and resid "113 " and name "HG21") ) 5.000 5.000 0.000 peak 11735 weight 0.10000E+01 volume -0.17210E+01 ppm1 1.438 ppm2 0.741 ASSI ( (segid " " and resid "113 " and name "HG12") )( (segid " " and resid "113 " and name "HD13") OR (segid " " and resid "113 " and name "HD12") OR (segid " " and resid "113 " and name "HD11") OR (segid " " and resid "113 " and name "HG23") OR (segid " " and resid "113 " and name "HG22") OR (segid " " and resid "113 " and name "HG21") ) 5.000 5.000 0.000 peak 11736 weight 0.10000E+01 volume -0.13780E+01 ppm1 1.329 ppm2 0.736 ASSI ( (segid " " and resid "114 " and name "HE1 ") )( (segid " " and resid "111 " and name "HG ") OR (segid " " and resid "111 " and name "HB2 ") ) 6.000 6.000 0.000 peak 11751 weight 0.10000E+01 volume -0.17400E+00 ppm1 7.826 ppm2 1.959 ASSI ( (segid " " and resid "114 " and name "HE1 ") )( (segid " " and resid "144 " and name "HD1 ") ) 6.000 6.000 0.000 peak 11752 weight 0.10000E+01 volume -0.10800E+00 ppm1 7.828 ppm2 4.292 ASSI ( (segid " " and resid "114 " and name "HE1 ") )( (segid " " and resid "113 " and name "HG23") OR (segid " " and resid "113 " and name "HG22") OR (segid " " and resid "113 " and name "HG21") ) 6.000 6.000 0.000 peak 11753 weight 0.10000E+01 volume -0.71000E-01 ppm1 7.830 ppm2 0.736 ASSI ( (segid " " and resid "119 " and name "HB1 ") )( (segid " " and resid "121 " and name "HD2 ") ) 6.000 6.000 0.000 peak 11798 weight 0.10000E+01 volume -0.12800E+00 ppm1 2.072 ppm2 7.277 ASSI ( (segid " " and resid "126 " and name "HB2 ") OR (segid " " and resid "126 " and name "HB1 ") )( (segid " " and resid "160 " and name "HD23") OR (segid " " and resid "160 " and name "HD22") OR (segid " " and resid "160 " and name "HD21") OR (segid " " and resid "156 " and name "HD23") OR (segid " " and resid "156 " and name "HD22") OR (segid " " and resid "156 " and name "HD21") ) 3.300 3.300 0.000 peak 11838 weight 0.10000E+01 volume -0.23170E+01 ppm1 3.880 ppm2 0.731 ASSI ( (segid " " and resid "136 " and name "HD2 ") )( (segid " " and resid "111 " and name "HD23") OR (segid " " and resid "111 " and name "HD22") OR (segid " " and resid "111 " and name "HD21") ) 6.000 6.000 0.000 peak 11938 weight 0.10000E+01 volume -0.50000E-01 ppm1 6.745 ppm2 0.956 ASSI ( (segid " " and resid "137 " and name "HB2 ") )( (segid " " and resid "137 " and name "HG1 ") ) 5.000 5.000 0.000 peak 11954 weight 0.10000E+01 volume -0.63700E+00 ppm1 1.273 ppm2 1.683 ASSI ( (segid " " and resid "147 " and name "HD13") OR (segid " " and resid "147 " and name "HD12") OR (segid " " and resid "147 " and name "HD11") )( (segid " " and resid "114 " and name "HD2 ") ) 5.000 5.000 0.000 peak 12032 weight 0.10000E+01 volume -0.10960E+01 ppm1 1.186 ppm2 6.957 ASSI ( (segid " " and resid "147 " and name "HD23") OR (segid " " and resid "147 " and name "HD22") OR (segid " " and resid "147 " and name "HD21") )( (segid " " and resid "114 " and name "HD2 ") ) 6.000 6.000 0.000 peak 12036 weight 0.10000E+01 volume -0.22800E+00 ppm1 1.048 ppm2 6.961 ASSI ( (segid " " and resid "150 " and name "HG1 ") )( (segid " " and resid "150 " and name "HA ") ) 5.000 5.000 0.000 peak 12052 weight 0.10000E+01 volume 0.15780E+01 ppm1 2.554 ppm2 4.048 ASSI ( (segid " " and resid "159 " and name "HA ") )( (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "159 " and name "HG21") ) 3.300 3.300 0.000 peak 12105 weight 0.10000E+01 volume -0.36490E+01 ppm1 3.760 ppm2 0.904 ASSI ( (segid " " and resid "159 " and name "HB ") )( (segid " " and resid "159 " and name "HD13") OR (segid " " and resid "159 " and name "HD12") OR (segid " " and resid "159 " and name "HD11") OR (segid " " and resid "159 " and name "HG23") OR (segid " " and resid "159 " and name "HG22") OR (segid " " and resid "159 " and name "HG21") ) 3.300 3.300 0.000 peak 12109 weight 0.10000E+01 volume 0.29930E+01 ppm1 1.864 ppm2 0.901
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