NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
545636 | 1ud7 | 4493 | cing | 1-original | 7 | XPLOR/CNS | distance | NOE | ambi |
ASSI { 1707} (segid " " and resid "65 " and name "HN ") (segid " " and resid "63 " and name "HN ") 6.000 6.000 0.000 peak 1707 weight 0.10000E+01 volume 0.10500E+00 ppm1 7.944 ppm2 8.353 ASSI { 1704} (segid " " and resid "65 " and name "HN ") (segid " " and resid "3 " and name "HB ") 6.000 6.000 0.000 peak 1704 weight 0.10000E+01 volume 0.20800E+00 ppm1 7.948 ppm2 2.060 ASSI { 1696} (segid " " and resid "65 " and name "HN ") (segid " " and resid "64 " and name "HN ") 5.000 5.000 0.000 peak 1696 weight 0.10000E+01 volume 0.96500E+00 ppm1 7.947 ppm2 9.311 ASSI { 1694} (segid " " and resid "65 " and name "HN ") (segid " " and resid "65 " and name "HB2 ") 5.000 5.000 0.000 peak 1694 weight 0.10000E+01 volume 0.19540E+01 ppm1 7.947 ppm2 3.689 ASSI { 1699} (segid " " and resid "65 " and name "HN ") (segid " " and resid "64 " and name "HA ") 5.000 5.000 0.000 peak 1699 weight 0.10000E+01 volume 0.63700E+00 ppm1 7.948 ppm2 3.153 ASSI { 1695} (segid " " and resid "65 " and name "HN ") (segid " " and resid "63 " and name "HA ") 5.000 5.000 0.000 peak 1695 weight 0.10000E+01 volume 0.11410E+01 ppm1 7.947 ppm2 3.959 OR { 1695} (segid " " and resid "65 " and name "HN ") (segid " " and resid "65 " and name "HB1 ") ASSI { 1698} (segid " " and resid "65 " and name "HN ") (segid " " and resid "3 " and name "HG11") 5.000 5.000 0.000 peak 1698 weight 0.10000E+01 volume 0.85300E+00 ppm1 7.948 ppm2 0.568 OR { 1698} (segid " " and resid "65 " and name "HN ") (segid " " and resid "3 " and name "HG13") OR { 1698} (segid " " and resid "65 " and name "HN ") (segid " " and resid "3 " and name "HG12") ASSI { 1708} (segid " " and resid "65 " and name "HN ") (segid " " and resid "64 " and name "HB1 ") 6.000 6.000 0.000 peak 1708 weight 0.10000E+01 volume 0.87000E-01 ppm1 7.947 ppm2 2.429 ASSI { 1700} (segid " " and resid "65 " and name "HN ") (segid " " and resid "3 " and name "HA ") 5.000 5.000 0.000 peak 1700 weight 0.10000E+01 volume 0.32700E+00 ppm1 7.946 ppm2 4.183 ASSI { 1697} (segid " " and resid "65 " and name "HN ") (segid " " and resid "65 " and name "HA ") 5.000 5.000 0.000 peak 1697 weight 0.10000E+01 volume 0.91300E+00 ppm1 7.947 ppm2 4.602 ASSI { 1702} (segid " " and resid "65 " and name "HN ") (segid " " and resid "4 " and name "HN ") 6.000 6.000 0.000 peak 1702 weight 0.10000E+01 volume 0.20300E+00 ppm1 7.948 ppm2 8.784 OR { 1702} (segid " " and resid "65 " and name "HN ") (segid " " and resid "66 " and name "HN ") ASSI { 1706} (segid " " and resid "65 " and name "HN ") (segid " " and resid "1 " and name "HE2 ") 6.000 6.000 0.000 peak 1706 weight 0.10000E+01 volume 0.55000E-01 ppm1 7.945 ppm2 1.490 OR { 1706} (segid " " and resid "65 " and name "HN ") (segid " " and resid "63 " and name "HG1 ") OR { 1706} (segid " " and resid "65 " and name "HN ") (segid " " and resid "1 " and name "HE1 ") OR { 1706} (segid " " and resid "65 " and name "HN ") (segid " " and resid "1 " and name "HE3 ") ASSI { 1705} (segid " " and resid "65 " and name "HN ") (segid " " and resid "62 " and name "HB2 ") 6.000 6.000 0.000 peak 1705 weight 0.10000E+01 volume 0.95000E-01 ppm1 7.944 ppm2 1.818 OR { 1705} (segid " " and resid "65 " and name "HN ") (segid " " and resid "63 " and name "HB2 ") ASSI { 1701} (segid " " and resid "65 " and name "HN ") (segid " " and resid "61 " and name "HG22") 6.000 6.000 0.000 peak 1701 weight 0.10000E+01 volume 0.18400E+00 ppm1 7.946 ppm2 0.326 OR { 1701} (segid " " and resid "65 " and name "HN ") (segid " " and resid "61 " and name "HG23") OR { 1701} (segid " " and resid "65 " and name "HN ") (segid " " and resid "61 " and name "HG21") ASSI { 1093} (segid " " and resid "16 " and name "HN ") (segid " " and resid "15 " and name "HD12") 5.000 5.000 0.000 peak 1093 weight 0.10000E+01 volume 0.32900E+00 ppm1 8.263 ppm2 0.641 OR { 1093} (segid " " and resid "16 " and name "HN ") (segid " " and resid "15 " and name "HD11") OR { 1093} (segid " " and resid "16 " and name "HN ") (segid " " and resid "17 " and name "HG12") OR { 1093} (segid " " and resid "16 " and name "HN ") (segid " " and resid "17 " and name "HG13") OR { 1093} (segid " " and resid "16 " and name "HN ") (segid " " and resid "17 " and name "HG11") ASSI { 1097} (segid " " and resid "16 " and name "HN ") (segid " " and resid "15 " and name "HG11") 6.000 6.000 0.000 peak 1097 weight 0.10000E+01 volume 0.13100E+00 ppm1 8.264 ppm2 1.333 ASSI { 1094} (segid " " and resid "16 " and name "HN ") (segid " " and resid "16 " and name "HG1 ") 5.000 5.000 0.000 peak 1094 weight 0.10000E+01 volume 0.32800E+00 ppm1 8.264 ppm2 2.186 ASSI { 1092} (segid " " and resid "16 " and name "HN ") (segid " " and resid "16 " and name "HA ") 5.000 5.000 0.000 peak 1092 weight 0.10000E+01 volume 0.72400E+00 ppm1 8.263 ppm2 4.903 ASSI { 1091} (segid " " and resid "16 " and name "HN ") (segid " " and resid "15 " and name "HG23") 5.000 5.000 0.000 peak 1091 weight 0.10000E+01 volume 0.14690E+01 ppm1 8.263 ppm2 0.927 OR { 1091} (segid " " and resid "16 " and name "HN ") (segid " " and resid "15 " and name "HG21") OR { 1091} (segid " " and resid "16 " and name "HN ") (segid " " and resid "15 " and name "HG22") ASSI { 1095} (segid " " and resid "16 " and name "HN ") (segid " " and resid "15 " and name "HB ") 6.000 6.000 0.000 peak 1095 weight 0.10000E+01 volume 0.21900E+00 ppm1 8.264 ppm2 1.690 OR { 1095} (segid " " and resid "16 " and name "HN ") (segid " " and resid "29 " and name "HD2 ") OR { 1095} (segid " " and resid "16 " and name "HN ") (segid " " and resid "2 " and name "HB2 ") ASSI { 1088} (segid " " and resid "16 " and name "HN ") (segid " " and resid "15 " and name "HA ") 2.700 2.700 0.000 peak 1088 weight 0.10000E+01 volume 0.42370E+01 ppm1 8.263 ppm2 4.409 ASSI { 1090} (segid " " and resid "16 " and name "HN ") (segid " " and resid "16 " and name "HB2 ") 3.300 3.300 0.000 peak 1090 weight 0.10000E+01 volume 0.26080E+01 ppm1 8.263 ppm2 1.911 OR { 1090} (segid " " and resid "16 " and name "HN ") (segid " " and resid "16 " and name "HB1 ") ASSI { 1096} (segid " " and resid "16 " and name "HN ") (segid " " and resid "17 " and name "HN ") 6.000 6.000 0.000 peak 1096 weight 0.10000E+01 volume 0.19600E+00 ppm1 8.264 ppm2 8.899 ASSI { 1451} (segid " " and resid "45 " and name "HN ") (segid " " and resid "45 " and name "HD2 ") 6.000 6.000 0.000 peak 1451 weight 0.10000E+01 volume 0.11700E+00 ppm1 9.192 ppm2 7.458 OR { 1451} (segid " " and resid "45 " and name "HN ") (segid " " and resid "45 " and name "HD1 ") ASSI { 1449} (segid " " and resid "45 " and name "HN ") (segid " " and resid "50 " and name "HD21") 6.000 6.000 0.000 peak 1449 weight 0.10000E+01 volume 0.16400E+00 ppm1 9.194 ppm2 0.145 OR { 1449} (segid " " and resid "45 " and name "HN ") (segid " " and resid "50 " and name "HD23") ASSI { 1453} (segid " " and resid "45 " and name "HN ") (segid " " and resid "44 " and name "HB ") 6.000 6.000 0.000 peak 1453 weight 0.10000E+01 volume 0.12700E+00 ppm1 9.192 ppm2 1.778 OR { 1453} (segid " " and resid "45 " and name "HN ") (segid " " and resid "43 " and name "HB2 ") ASSI { 1446} (segid " " and resid "45 " and name "HN ") (segid " " and resid "48 " and name "HN ") 5.000 5.000 0.000 peak 1446 weight 0.10000E+01 volume 0.71900E+00 ppm1 9.192 ppm2 8.112 OR { 1446} (segid " " and resid "45 " and name "HN ") (segid " " and resid "47 " and name "HN ") ASSI { 1450} (segid " " and resid "45 " and name "HN ") (segid " " and resid "48 " and name "HB1 ") 6.000 6.000 0.000 peak 1450 weight 0.10000E+01 volume 0.21500E+00 ppm1 9.191 ppm2 2.019 ASSI { 1454} (segid " " and resid "45 " and name "HN ") (segid " " and resid "50 " and name "HN ") 6.000 6.000 0.000 peak 1454 weight 0.10000E+01 volume 0.10300E+00 ppm1 9.193 ppm2 8.546 ASSI { 1444} (segid " " and resid "45 " and name "HN ") (segid " " and resid "44 " and name "HG23") 5.000 5.000 0.000 peak 1444 weight 0.10000E+01 volume 0.14180E+01 ppm1 9.192 ppm2 0.679 OR { 1444} (segid " " and resid "45 " and name "HN ") (segid " " and resid "44 " and name "HG21") OR { 1444} (segid " " and resid "45 " and name "HN ") (segid " " and resid "44 " and name "HG22") ASSI { 1447} (segid " " and resid "45 " and name "HN ") (segid " " and resid "45 " and name "HA ") 5.000 5.000 0.000 peak 1447 weight 0.10000E+01 volume 0.63600E+00 ppm1 9.192 ppm2 5.207 ASSI { 1452} (segid " " and resid "45 " and name "HN ") (segid " " and resid "44 " and name "HG12") 6.000 6.000 0.000 peak 1452 weight 0.10000E+01 volume 0.18500E+00 ppm1 9.191 ppm2 1.079 OR { 1452} (segid " " and resid "45 " and name "HN ") (segid " " and resid "43 " and name "HB1 ") ASSI { 1445} (segid " " and resid "45 " and name "HN ") (segid " " and resid "45 " and name "HB2 ") 5.000 5.000 0.000 peak 1445 weight 0.10000E+01 volume 0.93700E+00 ppm1 9.192 ppm2 2.791 ASSI { 1448} (segid " " and resid "45 " and name "HN ") (segid " " and resid "45 " and name "HB1 ") 5.000 5.000 0.000 peak 1448 weight 0.10000E+01 volume 0.58000E+00 ppm1 9.192 ppm2 2.938 ASSI { 1443} (segid " " and resid "45 " and name "HN ") (segid " " and resid "44 " and name "HA ") 2.700 2.700 0.000 peak 1443 weight 0.10000E+01 volume 0.46190E+01 ppm1 9.192 ppm2 4.905 OR { 1443} (segid " " and resid "45 " and name "HN ") (segid " " and resid "49 " and name "HA ") ASSI { 1687} (segid " " and resid "64 " and name "HN ") (segid " " and resid "64 " and name "HG2 ") 5.000 5.000 0.000 peak 1687 weight 0.10000E+01 volume 0.82100E+00 ppm1 9.309 ppm2 2.132 OR { 1687} (segid " " and resid "64 " and name "HN ") (segid " " and resid "64 " and name "HG1 ") OR { 1687} (segid " " and resid "64 " and name "HN ") (segid " " and resid "1 " and name "HB1 ") ASSI { 1684} (segid " " and resid "64 " and name "HN ") (segid " " and resid "64 " and name "HA ") 3.300 3.300 0.000 peak 1684 weight 0.10000E+01 volume 0.26780E+01 ppm1 9.309 ppm2 3.151 ASSI { 1686} (segid " " and resid "64 " and name "HN ") (segid " " and resid "3 " and name "HA ") 5.000 5.000 0.000 peak 1686 weight 0.10000E+01 volume 0.82100E+00 ppm1 9.308 ppm2 4.181 ASSI { 1688} (segid " " and resid "64 " and name "HN ") (segid " " and resid "3 " and name "HG11") 5.000 5.000 0.000 peak 1688 weight 0.10000E+01 volume 0.48200E+00 ppm1 9.310 ppm2 0.568 OR { 1688} (segid " " and resid "64 " and name "HN ") (segid " " and resid "3 " and name "HG12") OR { 1688} (segid " " and resid "64 " and name "HN ") (segid " " and resid "3 " and name "HG13") ASSI { 1691} (segid " " and resid "64 " and name "HN ") (segid " " and resid "64 " and name "HB1 ") 6.000 6.000 0.000 peak 1691 weight 0.10000E+01 volume 0.28600E+00 ppm1 9.308 ppm2 2.444 ASSI { 1680} (segid " " and resid "64 " and name "HN ") (segid " " and resid "63 " and name "HA ") 3.300 3.300 0.000 peak 1680 weight 0.10000E+01 volume 0.38890E+01 ppm1 9.309 ppm2 3.930 ASSI { 1690} (segid " " and resid "64 " and name "HN ") (segid " " and resid "1 " and name "HE1 ") 5.000 5.000 0.000 peak 1690 weight 0.10000E+01 volume 0.31600E+00 ppm1 9.309 ppm2 1.471 OR { 1690} (segid " " and resid "64 " and name "HN ") (segid " " and resid "1 " and name "HE3 ") OR { 1690} (segid " " and resid "64 " and name "HN ") (segid " " and resid "1 " and name "HE2 ") ASSI { 1689} (segid " " and resid "64 " and name "HN ") (segid " " and resid "63 " and name "HB1 ") 5.000 5.000 0.000 peak 1689 weight 0.10000E+01 volume 0.50600E+00 ppm1 9.309 ppm2 1.920 ASSI { 1692} (segid " " and resid "64 " and name "HN ") (segid " " and resid "63 " and name "HN ") 6.000 6.000 0.000 peak 1692 weight 0.10000E+01 volume 0.96000E-01 ppm1 9.309 ppm2 8.380 ASSI { 1622} (segid " " and resid "59 " and name "HN ") (segid " " and resid "59 " and name "HE2 ") 6.000 6.000 0.000 peak 1622 weight 0.10000E+01 volume 0.72000E-01 ppm1 7.455 ppm2 6.884 OR { 1622} (segid " " and resid "59 " and name "HN ") (segid " " and resid "59 " and name "HE1 ") ASSI { 1617} (segid " " and resid "59 " and name "HN ") (segid " " and resid "56 " and name "HA ") 6.000 6.000 0.000 peak 1617 weight 0.10000E+01 volume 0.18400E+00 ppm1 7.457 ppm2 4.038 ASSI { 1620} (segid " " and resid "59 " and name "HN ") (segid " " and resid "61 " and name "HG11") 6.000 6.000 0.000 peak 1620 weight 0.10000E+01 volume 0.18200E+00 ppm1 7.457 ppm2 1.058 ASSI { 1614} (segid " " and resid "59 " and name "HN ") (segid " " and resid "59 " and name "HA ") 5.000 5.000 0.000 peak 1614 weight 0.10000E+01 volume 0.60500E+00 ppm1 7.455 ppm2 4.515 ASSI { 1618} (segid " " and resid "59 " and name "HN ") (segid " " and resid "61 " and name "HN ") 6.000 6.000 0.000 peak 1618 weight 0.10000E+01 volume 0.19800E+00 ppm1 7.457 ppm2 6.675 ASSI { 1611} (segid " " and resid "59 " and name "HN ") (segid " " and resid "59 " and name "HD2 ") 5.000 5.000 0.000 peak 1611 weight 0.10000E+01 volume 0.10820E+01 ppm1 7.456 ppm2 7.253 OR { 1611} (segid " " and resid "59 " and name "HN ") (segid " " and resid "59 " and name "HD1 ") ASSI { 1609} (segid " " and resid "59 " and name "HN ") (segid " " and resid "59 " and name "HB2 ") 5.000 5.000 0.000 peak 1609 weight 0.10000E+01 volume 0.14630E+01 ppm1 7.456 ppm2 2.622 ASSI { 1615} (segid " " and resid "59 " and name "HN ") (segid " " and resid "58 " and name "HB2 ") 5.000 5.000 0.000 peak 1615 weight 0.10000E+01 volume 0.35700E+00 ppm1 7.457 ppm2 3.003 ASSI { 1612} (segid " " and resid "59 " and name "HN ") (segid " " and resid "59 " and name "HB1 ") 5.000 5.000 0.000 peak 1612 weight 0.10000E+01 volume 0.61700E+00 ppm1 7.455 ppm2 3.506 ASSI { 1613} (segid " " and resid "59 " and name "HN ") (segid " " and resid "58 " and name "HA ") 5.000 5.000 0.000 peak 1613 weight 0.10000E+01 volume 0.63800E+00 ppm1 7.456 ppm2 4.324 OR { 1613} (segid " " and resid "59 " and name "HN ") (segid " " and resid "57 " and name "HA ") OR { 1613} (segid " " and resid "59 " and name "HN ") (segid " " and resid "60 " and name "HA ") ASSI { 1610} (segid " " and resid "59 " and name "HN ") (segid " " and resid "58 " and name "HN ") 5.000 5.000 0.000 peak 1610 weight 0.10000E+01 volume 0.11090E+01 ppm1 7.456 ppm2 7.816 ASSI { 1616} (segid " " and resid "59 " and name "HN ") (segid " " and resid "58 " and name "HB1 ") 6.000 6.000 0.000 peak 1616 weight 0.10000E+01 volume 0.25400E+00 ppm1 7.457 ppm2 2.323 OR { 1616} (segid " " and resid "59 " and name "HN ") (segid " " and resid "54 " and name "HB1 ") OR { 1616} (segid " " and resid "59 " and name "HN ") (segid " " and resid "54 " and name "HB2 ") ASSI { 1619} (segid " " and resid "59 " and name "HN ") (segid " " and resid "61 " and name "HD12") 6.000 6.000 0.000 peak 1619 weight 0.10000E+01 volume 0.17600E+00 ppm1 7.455 ppm2 0.369 OR { 1619} (segid " " and resid "59 " and name "HN ") (segid " " and resid "61 " and name "HD11") OR { 1619} (segid " " and resid "59 " and name "HN ") (segid " " and resid "61 " and name "HD13") ASSI { 1608} (segid " " and resid "59 " and name "HN ") (segid " " and resid "60 " and name "HN ") 5.000 5.000 0.000 peak 1608 weight 0.10000E+01 volume 0.17960E+01 ppm1 7.456 ppm2 8.135 ASSI { 1309} (segid " " and resid "33 " and name "HN ") (segid " " and resid "33 " and name "HG2 ") 5.000 5.000 0.000 peak 1309 weight 0.10000E+01 volume 0.81900E+00 ppm1 7.527 ppm2 1.592 OR { 1309} (segid " " and resid "33 " and name "HN ") (segid " " and resid "33 " and name "HG1 ") ASSI { 1306} (segid " " and resid "33 " and name "HN ") (segid " " and resid "33 " and name "HA ") 5.000 5.000 0.000 peak 1306 weight 0.10000E+01 volume 0.14230E+01 ppm1 7.529 ppm2 4.309 ASSI { 1304} (segid " " and resid "33 " and name "HN ") (segid " " and resid "33 " and name "HB2 ") 3.300 3.300 0.000 peak 1304 weight 0.10000E+01 volume 0.26090E+01 ppm1 7.529 ppm2 1.880 ASSI { 1307} (segid " " and resid "33 " and name "HN ") (segid " " and resid "32 " and name "HN ") 5.000 5.000 0.000 peak 1307 weight 0.10000E+01 volume 0.92600E+00 ppm1 7.527 ppm2 7.876 ASSI { 1305} (segid " " and resid "33 " and name "HN ") (segid " " and resid "34 " and name "HN ") 5.000 5.000 0.000 peak 1305 weight 0.10000E+01 volume 0.14710E+01 ppm1 7.529 ppm2 8.809 ASSI { 1308} (segid " " and resid "33 " and name "HN ") (segid " " and resid "32 " and name "HB2 ") 5.000 5.000 0.000 peak 1308 weight 0.10000E+01 volume 0.11150E+01 ppm1 7.529 ppm2 2.779 ASSI { 1310} (segid " " and resid "33 " and name "HN ") (segid " " and resid "30 " and name "HA ") 5.000 5.000 0.000 peak 1310 weight 0.10000E+01 volume 0.35100E+00 ppm1 7.526 ppm2 3.328 ASSI { 1311} (segid " " and resid "33 " and name "HN ") (segid " " and resid "35 " and name "HN ") 6.000 6.000 0.000 peak 1311 weight 0.10000E+01 volume 0.14600E+00 ppm1 7.531 ppm2 8.282 ASSI { 1009} (segid " " and resid "7 " and name "HN ") (segid " " and resid "11 " and name "HN ") 5.000 5.000 0.000 peak 1009 weight 0.10000E+01 volume 0.30300E+00 ppm1 8.658 ppm2 7.206 ASSI { 1010} (segid " " and resid "7 " and name "HN ") (segid " " and resid "6 " and name "HB1 ") 5.000 5.000 0.000 peak 1010 weight 0.10000E+01 volume 0.35800E+00 ppm1 8.658 ppm2 1.634 OR { 1010} (segid " " and resid "7 " and name "HN ") (segid " " and resid "11 " and name "HB2 ") ASSI { 1016} (segid " " and resid "7 " and name "HN ") (segid " " and resid "13 " and name "HN ") 6.000 6.000 0.000 peak 1016 weight 0.10000E+01 volume 0.85000E-01 ppm1 8.659 ppm2 9.270 ASSI { 1007} (segid " " and resid "7 " and name "HN ") (segid " " and resid "7 " and name "HG21") 3.300 3.300 0.000 peak 1007 weight 0.10000E+01 volume 0.22210E+01 ppm1 8.659 ppm2 1.164 OR { 1007} (segid " " and resid "7 " and name "HN ") (segid " " and resid "7 " and name "HG22") OR { 1007} (segid " " and resid "7 " and name "HN ") (segid " " and resid "7 " and name "HG23") OR { 1007} (segid " " and resid "7 " and name "HN ") (segid " " and resid "6 " and name "HG2 ") ASSI { 1008} (segid " " and resid "7 " and name "HN ") (segid " " and resid "7 " and name "HA ") 5.000 5.000 0.000 peak 1008 weight 0.10000E+01 volume 0.98100E+00 ppm1 8.658 ppm2 4.712 ASSI { 1006} (segid " " and resid "7 " and name "HN ") (segid " " and resid "6 " and name "HA ") 2.700 2.700 0.000 peak 1006 weight 0.10000E+01 volume 0.51020E+01 ppm1 8.659 ppm2 5.198 ASSI { 1011} (segid " " and resid "7 " and name "HN ") (segid " " and resid "8 " and name "HN ") 6.000 6.000 0.000 peak 1011 weight 0.10000E+01 volume 0.29600E+00 ppm1 8.658 ppm2 8.888 ASSI { 1012} (segid " " and resid "7 " and name "HN ") (segid " " and resid "13 " and name "HG13") 6.000 6.000 0.000 peak 1012 weight 0.10000E+01 volume 0.12100E+00 ppm1 8.657 ppm2 0.906 OR { 1012} (segid " " and resid "7 " and name "HN ") (segid " " and resid "13 " and name "HG11") OR { 1012} (segid " " and resid "7 " and name "HN ") (segid " " and resid "13 " and name "HG12") OR { 1012} (segid " " and resid "7 " and name "HN ") (segid " " and resid "13 " and name "HG23") ASSI { 1015} (segid " " and resid "7 " and name "HN ") (segid " " and resid "10 " and name "HA1 ") 6.000 6.000 0.000 peak 1015 weight 0.10000E+01 volume 0.49000E-01 ppm1 8.662 ppm2 4.347 OR { 1015} (segid " " and resid "7 " and name "HN ") (segid " " and resid "11 " and name "HA ") ASSI { 1014} (segid " " and resid "7 " and name "HN ") (segid " " and resid "10 " and name "HN ") 6.000 6.000 0.000 peak 1014 weight 0.10000E+01 volume 0.85000E-01 ppm1 8.658 ppm2 7.869 ASSI { 956} (segid " " and resid "3 " and name "HN ") (segid " " and resid "14 " and name "HA ") 6.000 6.000 0.000 peak 956 weight 0.10000E+01 volume 0.90000E-01 ppm1 8.561 ppm2 5.112 ASSI { 924} (segid " " and resid "3 " and name "HN ") (segid " " and resid "3 " and name "HG23") 3.300 3.300 0.000 peak 924 weight 0.10000E+01 volume 0.24940E+01 ppm1 8.562 ppm2 0.582 OR { 924} (segid " " and resid "3 " and name "HN ") (segid " " and resid "3 " and name "HG21") OR { 924} (segid " " and resid "3 " and name "HN ") (segid " " and resid "3 " and name "HG22") OR { 924} (segid " " and resid "3 " and name "HN ") (segid " " and resid "3 " and name "HG12") ASSI { 930} (segid " " and resid "3 " and name "HN ") (segid " " and resid "14 " and name "HG23") 6.000 6.000 0.000 peak 930 weight 0.10000E+01 volume 0.22800E+00 ppm1 8.563 ppm2 1.121 OR { 930} (segid " " and resid "3 " and name "HN ") (segid " " and resid "14 " and name "HG21") OR { 930} (segid " " and resid "3 " and name "HN ") (segid " " and resid "14 " and name "HG22") ASSI { 928} (segid " " and resid "3 " and name "HN ") (segid " " and resid "2 " and name "HB2 ") 5.000 5.000 0.000 peak 928 weight 0.10000E+01 volume 0.61500E+00 ppm1 8.561 ppm2 1.660 OR { 928} (segid " " and resid "3 " and name "HN ") (segid " " and resid "15 " and name "HB ") ASSI { 926} (segid " " and resid "3 " and name "HN ") (segid " " and resid "15 " and name "HN ") 5.000 5.000 0.000 peak 926 weight 0.10000E+01 volume 0.11250E+01 ppm1 8.561 ppm2 8.860 ASSI { 929} (segid " " and resid "3 " and name "HN ") (segid " " and resid "2 " and name "HG2 ") 5.000 5.000 0.000 peak 929 weight 0.10000E+01 volume 0.50100E+00 ppm1 8.561 ppm2 2.030 OR { 929} (segid " " and resid "3 " and name "HN ") (segid " " and resid "3 " and name "HB ") ASSI { 954} (segid " " and resid "3 " and name "HN ") (segid " " and resid "17 " and name "HG23") 6.000 6.000 0.000 peak 954 weight 0.10000E+01 volume 0.12100E+00 ppm1 8.562 ppm2 0.361 OR { 954} (segid " " and resid "3 " and name "HN ") (segid " " and resid "17 " and name "HG21") OR { 954} (segid " " and resid "3 " and name "HN ") (segid " " and resid "17 " and name "HG22") ASSI { 927} (segid " " and resid "3 " and name "HN ") (segid " " and resid "3 " and name "HA ") 5.000 5.000 0.000 peak 927 weight 0.10000E+01 volume 0.73000E+00 ppm1 8.562 ppm2 4.177 ASSI { 960} (segid " " and resid "3 " and name "HN ") (segid " " and resid "2 " and name "HG1 ") 6.000 6.000 0.000 peak 960 weight 0.10000E+01 volume 0.10800E+00 ppm1 8.562 ppm2 2.310 ASSI { 1357} (segid " " and resid "40 " and name "HN ") (segid " " and resid "39 " and name "HN ") 5.000 5.000 0.000 peak 1357 weight 0.10000E+01 volume 0.11580E+01 ppm1 7.898 ppm2 8.537 ASSI { 1361} (segid " " and resid "40 " and name "HN ") (segid " " and resid "36 " and name "HG23") 5.000 5.000 0.000 peak 1361 weight 0.10000E+01 volume 0.30200E+00 ppm1 7.898 ppm2 0.887 OR { 1361} (segid " " and resid "40 " and name "HN ") (segid " " and resid "36 " and name "HG21") OR { 1361} (segid " " and resid "40 " and name "HN ") (segid " " and resid "36 " and name "HG22") OR { 1361} (segid " " and resid "40 " and name "HN ") (segid " " and resid "71 " and name "HD22") OR { 1361} (segid " " and resid "40 " and name "HN ") (segid " " and resid "71 " and name "HD21") ASSI { 1359} (segid " " and resid "40 " and name "HN ") (segid " " and resid "38 " and name "HB2 ") 5.000 5.000 0.000 peak 1359 weight 0.10000E+01 volume 0.58300E+00 ppm1 7.898 ppm2 1.999 ASSI { 1362} (segid " " and resid "40 " and name "HN ") (segid " " and resid "39 " and name "HB1 ") 6.000 6.000 0.000 peak 1362 weight 0.10000E+01 volume 0.21000E+00 ppm1 7.900 ppm2 2.738 ASSI { 1360} (segid " " and resid "40 " and name "HN ") (segid " " and resid "38 " and name "HA ") 6.000 6.000 0.000 peak 1360 weight 0.10000E+01 volume 0.28000E+00 ppm1 7.895 ppm2 4.071 OR { 1360} (segid " " and resid "40 " and name "HN ") (segid " " and resid "41 " and name "HA ") ASSI { 1355} (segid " " and resid "40 " and name "HN ") (segid " " and resid "40 " and name "HB2 ") 5.000 5.000 0.000 peak 1355 weight 0.10000E+01 volume 0.17500E+01 ppm1 7.898 ppm2 1.773 ASSI { 1356} (segid " " and resid "40 " and name "HN ") (segid " " and resid "40 " and name "HG2 ") 5.000 5.000 0.000 peak 1356 weight 0.10000E+01 volume 0.17820E+01 ppm1 7.898 ppm2 2.409 OR { 1356} (segid " " and resid "40 " and name "HN ") (segid " " and resid "40 " and name "HG1 ") OR { 1356} (segid " " and resid "40 " and name "HN ") (segid " " and resid "37 " and name "HB1 ") ASSI { 1358} (segid " " and resid "40 " and name "HN ") (segid " " and resid "40 " and name "HA ") 5.000 5.000 0.000 peak 1358 weight 0.10000E+01 volume 0.12690E+01 ppm1 7.898 ppm2 4.449 ASSI { 1363} (segid " " and resid "40 " and name "HN ") (segid " " and resid "72 " and name "HG2 ") 6.000 6.000 0.000 peak 1363 weight 0.10000E+01 volume 0.12100E+00 ppm1 7.899 ppm2 1.528 OR { 1363} (segid " " and resid "40 " and name "HN ") (segid " " and resid "72 " and name "HG1 ") OR { 1363} (segid " " and resid "40 " and name "HN ") (segid " " and resid "36 " and name "HB ") OR { 1363} (segid " " and resid "40 " and name "HN ") (segid " " and resid "72 " and name "HB2 ") OR { 1363} (segid " " and resid "40 " and name "HN ") (segid " " and resid "27 " and name "HG2 ") ASSI { 1354} (segid " " and resid "40 " and name "HN ") (segid " " and resid "41 " and name "HN ") 3.300 3.300 0.000 peak 1354 weight 0.10000E+01 volume 0.22670E+01 ppm1 7.898 ppm2 7.342 ASSI { 1026} (segid " " and resid "9 " and name "HN ") (segid " " and resid "9 " and name "HG23") 5.000 5.000 0.000 peak 1026 weight 0.10000E+01 volume 0.78000E+00 ppm1 7.653 ppm2 1.259 OR { 1026} (segid " " and resid "9 " and name "HN ") (segid " " and resid "9 " and name "HG22") OR { 1026} (segid " " and resid "9 " and name "HN ") (segid " " and resid "9 " and name "HG21") ASSI { 1032} (segid " " and resid "9 " and name "HN ") (segid " " and resid "8 " and name "HB1 ") 6.000 6.000 0.000 peak 1032 weight 0.10000E+01 volume 0.17600E+00 ppm1 7.654 ppm2 1.714 ASSI { 1028} (segid " " and resid "9 " and name "HN ") (segid " " and resid "9 " and name "HA ") 5.000 5.000 0.000 peak 1028 weight 0.10000E+01 volume 0.56400E+00 ppm1 7.652 ppm2 4.429 ASSI { 1030} (segid " " and resid "9 " and name "HN ") (segid " " and resid "8 " and name "HB2 ") 6.000 6.000 0.000 peak 1030 weight 0.10000E+01 volume 0.19800E+00 ppm1 7.652 ppm2 1.920 ASSI { 1029} (segid " " and resid "9 " and name "HN ") (segid " " and resid "8 " and name "HN ") 5.000 5.000 0.000 peak 1029 weight 0.10000E+01 volume 0.50500E+00 ppm1 7.653 ppm2 8.894 ASSI { 1031} (segid " " and resid "9 " and name "HN ") (segid " " and resid "11 " and name "HN ") 6.000 6.000 0.000 peak 1031 weight 0.10000E+01 volume 0.13500E+00 ppm1 7.654 ppm2 7.208 ASSI { 1027} (segid " " and resid "9 " and name "HN ") (segid " " and resid "10 " and name "HN ") 5.000 5.000 0.000 peak 1027 weight 0.10000E+01 volume 0.90100E+00 ppm1 7.654 ppm2 7.875 ASSI { 1222} (segid " " and resid "27 " and name "HN ") (segid " " and resid "27 " and name "HB2 ") 5.000 5.000 0.000 peak 1222 weight 0.10000E+01 volume 0.16560E+01 ppm1 8.936 ppm2 2.006 ASSI { 1221} (segid " " and resid "27 " and name "HN ") (segid " " and resid "27 " and name "HG1 ") 3.300 3.300 0.000 peak 1221 weight 0.10000E+01 volume 0.26950E+01 ppm1 8.936 ppm2 1.615 OR { 1221} (segid " " and resid "27 " and name "HN ") (segid " " and resid "27 " and name "HD2 ") ASSI { 1223} (segid " " and resid "27 " and name "HN ") (segid " " and resid "26 " and name "HB1 ") 5.000 5.000 0.000 peak 1223 weight 0.10000E+01 volume 0.13070E+01 ppm1 8.936 ppm2 3.562 ASSI { 1224} (segid " " and resid "27 " and name "HN ") (segid " " and resid "26 " and name "HN ") 5.000 5.000 0.000 peak 1224 weight 0.10000E+01 volume 0.10340E+01 ppm1 8.936 ppm2 8.531 ASSI { 1228} (segid " " and resid "27 " and name "HN ") (segid " " and resid "27 " and name "HB1 ") 5.000 5.000 0.000 peak 1228 weight 0.10000E+01 volume 0.88400E+00 ppm1 8.939 ppm2 1.432 ASSI { 1226} (segid " " and resid "27 " and name "HN ") (segid " " and resid "27 " and name "HA ") 5.000 5.000 0.000 peak 1226 weight 0.10000E+01 volume 0.71300E+00 ppm1 8.936 ppm2 4.362 ASSI { 1231} (segid " " and resid "27 " and name "HN ") (segid " " and resid "26 " and name "HA ") 6.000 6.000 0.000 peak 1231 weight 0.10000E+01 volume 0.27600E+00 ppm1 8.939 ppm2 4.558 OR { 1231} (segid " " and resid "27 " and name "HN ") (segid " " and resid "25 " and name "HA ") ASSI { 1229} (segid " " and resid "27 " and name "HN ") (segid " " and resid "23 " and name "HG12") 5.000 5.000 0.000 peak 1229 weight 0.10000E+01 volume 0.36400E+00 ppm1 8.939 ppm2 0.803 OR { 1229} (segid " " and resid "27 " and name "HN ") (segid " " and resid "23 " and name "HG11") OR { 1229} (segid " " and resid "27 " and name "HN ") (segid " " and resid "23 " and name "HG13") OR { 1229} (segid " " and resid "27 " and name "HN ") (segid " " and resid "43 " and name "HD11") OR { 1229} (segid " " and resid "27 " and name "HN ") (segid " " and resid "43 " and name "HD13") OR { 1229} (segid " " and resid "27 " and name "HN ") (segid " " and resid "43 " and name "HD12") ASSI { 1227} (segid " " and resid "27 " and name "HN ") (segid " " and resid "26 " and name "HB2 ") 5.000 5.000 0.000 peak 1227 weight 0.10000E+01 volume 0.55100E+00 ppm1 8.939 ppm2 3.188 ASSI { 1225} (segid " " and resid "27 " and name "HN ") (segid " " and resid "28 " and name "HN ") 5.000 5.000 0.000 peak 1225 weight 0.10000E+01 volume 0.89800E+00 ppm1 8.936 ppm2 7.882 OR { 1225} (segid " " and resid "27 " and name "HN ") (segid " " and resid "29 " and name "HN ") ASSI { 1230} (segid " " and resid "27 " and name "HN ") (segid " " and resid "24 " and name "HA ") 5.000 5.000 0.000 peak 1230 weight 0.10000E+01 volume 0.38900E+00 ppm1 8.939 ppm2 3.948 ASSI { 1233} (segid " " and resid "27 " and name "HN ") (segid " " and resid "38 " and name "HB1 ") 6.000 6.000 0.000 peak 1233 weight 0.10000E+01 volume 0.88000E-01 ppm1 8.939 ppm2 2.244 OR { 1233} (segid " " and resid "27 " and name "HN ") (segid " " and resid "29 " and name "HB2 ") OR { 1233} (segid " " and resid "27 " and name "HN ") (segid " " and resid "23 " and name "HB ") ASSI { 1232} (segid " " and resid "27 " and name "HN ") (segid " " and resid "25 " and name "HN ") 6.000 6.000 0.000 peak 1232 weight 0.10000E+01 volume 0.10500E+00 ppm1 8.936 ppm2 8.152 OR { 1232} (segid " " and resid "27 " and name "HN ") (segid " " and resid "30 " and name "HN ") ASSI { 1714} (segid " " and resid "66 " and name "HN ") (segid " " and resid "45 " and name "HE2 ") 5.000 5.000 0.000 peak 1714 weight 0.10000E+01 volume 0.57900E+00 ppm1 8.789 ppm2 7.532 OR { 1714} (segid " " and resid "66 " and name "HN ") (segid " " and resid "45 " and name "HE1 ") ASSI { 1710} (segid " " and resid "66 " and name "HN ") (segid " " and resid "66 " and name "HB ") 3.300 3.300 0.000 peak 1710 weight 0.10000E+01 volume 0.21320E+01 ppm1 8.788 ppm2 4.135 ASSI { 1711} (segid " " and resid "66 " and name "HN ") (segid " " and resid "65 " and name "HB1 ") 5.000 5.000 0.000 peak 1711 weight 0.10000E+01 volume 0.92800E+00 ppm1 8.790 ppm2 3.973 ASSI { 1709} (segid " " and resid "66 " and name "HN ") (segid " " and resid "65 " and name "HA ") 3.300 3.300 0.000 peak 1709 weight 0.10000E+01 volume 0.39760E+01 ppm1 8.789 ppm2 4.606 ASSI { 1712} (segid " " and resid "66 " and name "HN ") (segid " " and resid "66 " and name "HA ") 5.000 5.000 0.000 peak 1712 weight 0.10000E+01 volume 0.54900E+00 ppm1 8.788 ppm2 5.325 ASSI { 1715} (segid " " and resid "66 " and name "HN ") (segid " " and resid "66 " and name "HG22") 5.000 5.000 0.000 peak 1715 weight 0.10000E+01 volume 0.30300E+00 ppm1 8.789 ppm2 0.932 OR { 1715} (segid " " and resid "66 " and name "HN ") (segid " " and resid "66 " and name "HG23") OR { 1715} (segid " " and resid "66 " and name "HN ") (segid " " and resid "66 " and name "HG21") ASSI { 1713} (segid " " and resid "66 " and name "HN ") (segid " " and resid "65 " and name "HB2 ") 5.000 5.000 0.000 peak 1713 weight 0.10000E+01 volume 0.52700E+00 ppm1 8.789 ppm2 3.688 ASSI { 1716} (segid " " and resid "66 " and name "HN ") (segid " " and resid "65 " and name "HN ") 6.000 6.000 0.000 peak 1716 weight 0.10000E+01 volume 0.95000E-01 ppm1 8.788 ppm2 7.945 OR { 1716} (segid " " and resid "66 " and name "HN ") (segid " " and resid "68 " and name "HE1 ") ASSI { 1728} (segid " " and resid "67 " and name "HN ") (segid " " and resid "66 " and name "HB ") 6.000 6.000 0.000 peak 1728 weight 0.10000E+01 volume 0.14800E+00 ppm1 9.439 ppm2 4.133 ASSI { 1725} (segid " " and resid "67 " and name "HN ") (segid " " and resid "67 " and name "HG11") 5.000 5.000 0.000 peak 1725 weight 0.10000E+01 volume 0.31400E+00 ppm1 9.437 ppm2 1.474 ASSI { 1729} (segid " " and resid "67 " and name "HN ") (segid " " and resid "4 " and name "HB1 ") 6.000 6.000 0.000 peak 1729 weight 0.10000E+01 volume 0.70000E-01 ppm1 9.441 ppm2 2.807 OR { 1729} (segid " " and resid "67 " and name "HN ") (segid " " and resid "45 " and name "HB2 ") ASSI { 1722} (segid " " and resid "67 " and name "HN ") (segid " " and resid "67 " and name "HD11") 5.000 5.000 0.000 peak 1722 weight 0.10000E+01 volume 0.68300E+00 ppm1 9.439 ppm2 0.685 OR { 1722} (segid " " and resid "67 " and name "HN ") (segid " " and resid "67 " and name "HD12") OR { 1722} (segid " " and resid "67 " and name "HN ") (segid " " and resid "67 " and name "HD13") ASSI { 1726} (segid " " and resid "67 " and name "HN ") (segid " " and resid "67 " and name "HG12") 6.000 6.000 0.000 peak 1726 weight 0.10000E+01 volume 0.25400E+00 ppm1 9.440 ppm2 1.184 ASSI { 1724} (segid " " and resid "67 " and name "HN ") (segid " " and resid "4 " and name "HB2 ") 6.000 6.000 0.000 peak 1724 weight 0.10000E+01 volume 0.28600E+00 ppm1 9.437 ppm2 3.107 ASSI { 1723} (segid " " and resid "67 " and name "HN ") (segid " " and resid "67 " and name "HA ") 5.000 5.000 0.000 peak 1723 weight 0.10000E+01 volume 0.51600E+00 ppm1 9.439 ppm2 4.714 ASSI { 1727} (segid " " and resid "67 " and name "HN ") (segid " " and resid "66 " and name "HN ") 5.000 5.000 0.000 peak 1727 weight 0.10000E+01 volume 0.31600E+00 ppm1 9.439 ppm2 8.817 ASSI { 1721} (segid " " and resid "67 " and name "HN ") (segid " " and resid "66 " and name "HG22") 5.000 5.000 0.000 peak 1721 weight 0.10000E+01 volume 0.13180E+01 ppm1 9.439 ppm2 0.940 OR { 1721} (segid " " and resid "67 " and name "HN ") (segid " " and resid "66 " and name "HG23") OR { 1721} (segid " " and resid "67 " and name "HN ") (segid " " and resid "66 " and name "HG21") ASSI { 1720} (segid " " and resid "67 " and name "HN ") (segid " " and resid "67 " and name "HB ") 5.000 5.000 0.000 peak 1720 weight 0.10000E+01 volume 0.16210E+01 ppm1 9.439 ppm2 1.845 ASSI { 1719} (segid " " and resid "67 " and name "HN ") (segid " " and resid "66 " and name "HA ") 2.700 2.700 0.000 peak 1719 weight 0.10000E+01 volume 0.40860E+01 ppm1 9.439 ppm2 5.316 ASSI { 1648} (segid " " and resid "61 " and name "HN ") (segid " " and resid "59 " and name "HN ") 5.000 5.000 0.000 peak 1648 weight 0.10000E+01 volume 0.31600E+00 ppm1 6.675 ppm2 7.472 OR { 1648} (segid " " and resid "61 " and name "HN ") (segid " " and resid "45 " and name "HD1 ") ASSI { 1646} (segid " " and resid "61 " and name "HN ") (segid " " and resid "61 " and name "HG12") 5.000 5.000 0.000 peak 1646 weight 0.10000E+01 volume 0.48300E+00 ppm1 6.675 ppm2 -0.408 ASSI { 1643} (segid " " and resid "61 " and name "HN ") (segid " " and resid "60 " and name "HN ") 5.000 5.000 0.000 peak 1643 weight 0.10000E+01 volume 0.80400E+00 ppm1 6.674 ppm2 8.132 ASSI { 1645} (segid " " and resid "61 " and name "HN ") (segid " " and resid "61 " and name "HA ") 5.000 5.000 0.000 peak 1645 weight 0.10000E+01 volume 0.77500E+00 ppm1 6.675 ppm2 3.192 ASSI { 1638} (segid " " and resid "61 " and name "HN ") (segid " " and resid "61 " and name "HB ") 3.300 3.300 0.000 peak 1638 weight 0.10000E+01 volume 0.30400E+01 ppm1 6.675 ppm2 1.127 ASSI { 1647} (segid " " and resid "61 " and name "HN ") (segid " " and resid "59 " and name "HB2 ") 6.000 6.000 0.000 peak 1647 weight 0.10000E+01 volume 0.21400E+00 ppm1 6.675 ppm2 2.620 ASSI { 1642} (segid " " and resid "61 " and name "HN ") (segid " " and resid "60 " and name "HA ") 5.000 5.000 0.000 peak 1642 weight 0.10000E+01 volume 0.13090E+01 ppm1 6.675 ppm2 4.341 ASSI { 1644} (segid " " and resid "61 " and name "HN ") (segid " " and resid "61 " and name "HD12") 5.000 5.000 0.000 peak 1644 weight 0.10000E+01 volume 0.84000E+00 ppm1 6.675 ppm2 0.354 OR { 1644} (segid " " and resid "61 " and name "HN ") (segid " " and resid "61 " and name "HD11") OR { 1644} (segid " " and resid "61 " and name "HN ") (segid " " and resid "61 " and name "HD13") OR { 1644} (segid " " and resid "61 " and name "HN ") (segid " " and resid "61 " and name "HG22") OR { 1644} (segid " " and resid "61 " and name "HN ") (segid " " and resid "61 " and name "HG21") OR { 1644} (segid " " and resid "61 " and name "HN ") (segid " " and resid "61 " and name "HG23") ASSI { 1651} (segid " " and resid "61 " and name "HN ") (segid " " and resid "59 " and name "HB1 ") 6.000 6.000 0.000 peak 1651 weight 0.10000E+01 volume 0.73000E-01 ppm1 6.676 ppm2 3.502 ASSI { 1650} (segid " " and resid "61 " and name "HN ") (segid " " and resid "62 " and name "HN ") 6.000 6.000 0.000 peak 1650 weight 0.10000E+01 volume 0.93000E-01 ppm1 6.675 ppm2 7.754 ASSI { 1649} (segid " " and resid "61 " and name "HN ") (segid " " and resid "60 " and name "HB2 ") 6.000 6.000 0.000 peak 1649 weight 0.10000E+01 volume 0.55000E-01 ppm1 6.677 ppm2 2.849 ASSI { 1652} (segid " " and resid "61 " and name "HN ") (segid " " and resid "56 " and name "HA ") 6.000 6.000 0.000 peak 1652 weight 0.10000E+01 volume 0.43000E-01 ppm1 6.676 ppm2 4.012 OR { 1652} (segid " " and resid "61 " and name "HN ") (segid " " and resid "19 " and name "HA ") ASSI { 972} (segid " " and resid "4 " and name "HN ") (segid " " and resid "3 " and name "HA ") 3.300 3.300 0.000 peak 972 weight 0.10000E+01 volume 0.27860E+01 ppm1 8.757 ppm2 4.175 ASSI { 977} (segid " " and resid "4 " and name "HN ") (segid " " and resid "66 " and name "HA ") 5.000 5.000 0.000 peak 977 weight 0.10000E+01 volume 0.82000E+00 ppm1 8.757 ppm2 5.330 ASSI { 973} (segid " " and resid "4 " and name "HN ") (segid " " and resid "3 " and name "HB ") 3.300 3.300 0.000 peak 973 weight 0.10000E+01 volume 0.25110E+01 ppm1 8.757 ppm2 2.053 ASSI { 975} (segid " " and resid "4 " and name "HN ") (segid " " and resid "3 " and name "HG23") 5.000 5.000 0.000 peak 975 weight 0.10000E+01 volume 0.10330E+01 ppm1 8.758 ppm2 0.575 OR { 975} (segid " " and resid "4 " and name "HN ") (segid " " and resid "3 " and name "HG21") OR { 975} (segid " " and resid "4 " and name "HN ") (segid " " and resid "3 " and name "HG22") OR { 975} (segid " " and resid "4 " and name "HN ") (segid " " and resid "3 " and name "HG12") OR { 975} (segid " " and resid "4 " and name "HN ") (segid " " and resid "3 " and name "HG11") ASSI { 981} (segid " " and resid "4 " and name "HN ") (segid " " and resid "66 " and name "HG23") 6.000 6.000 0.000 peak 981 weight 0.10000E+01 volume 0.93000E-01 ppm1 8.758 ppm2 0.977 OR { 981} (segid " " and resid "4 " and name "HN ") (segid " " and resid "66 " and name "HG22") OR { 981} (segid " " and resid "4 " and name "HN ") (segid " " and resid "66 " and name "HG21") ASSI { 976} (segid " " and resid "4 " and name "HN ") (segid " " and resid "4 " and name "HB1 ") 5.000 5.000 0.000 peak 976 weight 0.10000E+01 volume 0.53800E+00 ppm1 8.758 ppm2 2.803 ASSI { 974} (segid " " and resid "4 " and name "HN ") (segid " " and resid "4 " and name "HB2 ") 5.000 5.000 0.000 peak 974 weight 0.10000E+01 volume 0.14550E+01 ppm1 8.757 ppm2 3.116 OR { 974} (segid " " and resid "4 " and name "HN ") (segid " " and resid "64 " and name "HA ") ASSI { 978} (segid " " and resid "4 " and name "HN ") (segid " " and resid "4 " and name "HA ") 5.000 5.000 0.000 peak 978 weight 0.10000E+01 volume 0.74400E+00 ppm1 8.757 ppm2 5.428 ASSI { 979} (segid " " and resid "4 " and name "HN ") (segid " " and resid "4 " and name "HD1 ") 5.000 5.000 0.000 peak 979 weight 0.10000E+01 volume 0.30000E+00 ppm1 8.759 ppm2 7.042 OR { 979} (segid " " and resid "4 " and name "HN ") (segid " " and resid "4 " and name "HD2 ") ASSI { 980} (segid " " and resid "4 " and name "HN ") (segid " " and resid "67 " and name "HN ") 6.000 6.000 0.000 peak 980 weight 0.10000E+01 volume 0.26600E+00 ppm1 8.757 ppm2 9.461 OR { 980} (segid " " and resid "4 " and name "HN ") (segid " " and resid "5 " and name "HN ") ASSI { 1371} (segid " " and resid "41 " and name "HN ") (segid " " and resid "39 " and name "HN ") 6.000 6.000 0.000 peak 1371 weight 0.10000E+01 volume 0.15800E+00 ppm1 7.342 ppm2 8.499 OR { 1371} (segid " " and resid "41 " and name "HN ") (segid " " and resid "72 " and name "HN ") ASSI { 1370} (segid " " and resid "41 " and name "HN ") (segid " " and resid "36 " and name "HG21") 5.000 5.000 0.000 peak 1370 weight 0.10000E+01 volume 0.37800E+00 ppm1 7.342 ppm2 0.861 OR { 1370} (segid " " and resid "41 " and name "HN ") (segid " " and resid "36 " and name "HG23") OR { 1370} (segid " " and resid "41 " and name "HN ") (segid " " and resid "36 " and name "HG22") OR { 1370} (segid " " and resid "41 " and name "HN ") (segid " " and resid "69 " and name "HD13") OR { 1370} (segid " " and resid "41 " and name "HN ") (segid " " and resid "71 " and name "HD22") OR { 1370} (segid " " and resid "41 " and name "HN ") (segid " " and resid "71 " and name "HD21") ASSI { 1366} (segid " " and resid "41 " and name "HN ") (segid " " and resid "41 " and name "HG1 ") 5.000 5.000 0.000 peak 1366 weight 0.10000E+01 volume 0.14260E+01 ppm1 7.342 ppm2 2.481 ASSI { 1367} (segid " " and resid "41 " and name "HN ") (segid " " and resid "41 " and name "HA ") 5.000 5.000 0.000 peak 1367 weight 0.10000E+01 volume 0.10470E+01 ppm1 7.342 ppm2 4.078 OR { 1367} (segid " " and resid "41 " and name "HN ") (segid " " and resid "38 " and name "HA ") ASSI { 1368} (segid " " and resid "41 " and name "HN ") (segid " " and resid "40 " and name "HA ") 5.000 5.000 0.000 peak 1368 weight 0.10000E+01 volume 0.63300E+00 ppm1 7.342 ppm2 4.451 ASSI { 1369} (segid " " and resid "41 " and name "HN ") (segid " " and resid "41 " and name "HG2 ") 5.000 5.000 0.000 peak 1369 weight 0.10000E+01 volume 0.72300E+00 ppm1 7.342 ppm2 1.575 OR { 1369} (segid " " and resid "41 " and name "HN ") (segid " " and resid "27 " and name "HG2 ") ASSI { 1365} (segid " " and resid "41 " and name "HN ") (segid " " and resid "41 " and name "HB2 ") 5.000 5.000 0.000 peak 1365 weight 0.10000E+01 volume 0.19330E+01 ppm1 7.342 ppm2 1.915 ASSI { 1372} (segid " " and resid "41 " and name "HN ") (segid " " and resid "27 " and name "HE1 ") 6.000 6.000 0.000 peak 1372 weight 0.10000E+01 volume 0.92000E-01 ppm1 7.342 ppm2 2.742 OR { 1372} (segid " " and resid "41 " and name "HN ") (segid " " and resid "39 " and name "HB1 ") ASSI { 1422} (segid " " and resid "42 " and name "HE ") (segid " " and resid "42 " and name "HD2 ") 6.000 6.000 0.000 peak 1422 weight 0.10000E+01 volume 0.26200E+00 ppm1 7.177 ppm2 3.081 OR { 1422} (segid " " and resid "42 " and name "HE ") (segid " " and resid "42 " and name "HD1 ") ASSI { 1423} (segid " " and resid "42 " and name "HE ") (segid " " and resid "42 " and name "HG1 ") 6.000 6.000 0.000 peak 1423 weight 0.10000E+01 volume 0.11200E+00 ppm1 7.178 ppm2 1.496 OR { 1423} (segid " " and resid "42 " and name "HE ") (segid " " and resid "42 " and name "HB2 ") OR { 1423} (segid " " and resid "42 " and name "HE ") (segid " " and resid "72 " and name "HG1 ") ASSI { 1778} (segid " " and resid "72 " and name "HE ") (segid " " and resid "72 " and name "HD2 ") 6.000 6.000 0.000 peak 1778 weight 0.10000E+01 volume 0.11200E+00 ppm1 7.102 ppm2 3.121 OR { 1778} (segid " " and resid "72 " and name "HE ") (segid " " and resid "72 " and name "HD1 ") ASSI { 1104} (segid " " and resid "17 " and name "HN ") (segid " " and resid "3 " and name "HN ") 6.000 6.000 0.000 peak 1104 weight 0.10000E+01 volume 0.15200E+00 ppm1 8.943 ppm2 8.537 OR { 1104} (segid " " and resid "17 " and name "HN ") (segid " " and resid "18 " and name "HN ") ASSI { 1099} (segid " " and resid "17 " and name "HN ") (segid " " and resid "17 " and name "HG22") 5.000 5.000 0.000 peak 1099 weight 0.10000E+01 volume 0.18660E+01 ppm1 8.943 ppm2 0.369 OR { 1099} (segid " " and resid "17 " and name "HN ") (segid " " and resid "17 " and name "HG21") OR { 1099} (segid " " and resid "17 " and name "HN ") (segid " " and resid "17 " and name "HG23") ASSI { 1100} (segid " " and resid "17 " and name "HN ") (segid " " and resid "17 " and name "HG12") 5.000 5.000 0.000 peak 1100 weight 0.10000E+01 volume 0.10100E+01 ppm1 8.942 ppm2 0.632 OR { 1100} (segid " " and resid "17 " and name "HN ") (segid " " and resid "17 " and name "HG13") OR { 1100} (segid " " and resid "17 " and name "HN ") (segid " " and resid "17 " and name "HG11") OR { 1100} (segid " " and resid "17 " and name "HN ") (segid " " and resid "3 " and name "HG22") OR { 1100} (segid " " and resid "17 " and name "HN ") (segid " " and resid "3 " and name "HG21") ASSI { 1103} (segid " " and resid "17 " and name "HN ") (segid " " and resid "16 " and name "HB2 ") 5.000 5.000 0.000 peak 1103 weight 0.10000E+01 volume 0.58400E+00 ppm1 8.943 ppm2 1.926 OR { 1103} (segid " " and resid "17 " and name "HN ") (segid " " and resid "16 " and name "HB1 ") OR { 1103} (segid " " and resid "17 " and name "HN ") (segid " " and resid "2 " and name "HB1 ") ASSI { 1101} (segid " " and resid "17 " and name "HN ") (segid " " and resid "17 " and name "HA ") 5.000 5.000 0.000 peak 1101 weight 0.10000E+01 volume 0.94300E+00 ppm1 8.943 ppm2 4.612 ASSI { 1102} (segid " " and resid "17 " and name "HN ") (segid " " and resid "16 " and name "HG2 ") 5.000 5.000 0.000 peak 1102 weight 0.10000E+01 volume 0.72400E+00 ppm1 8.943 ppm2 2.120 OR { 1102} (segid " " and resid "17 " and name "HN ") (segid " " and resid "1 " and name "HB1 ") OR { 1102} (segid " " and resid "17 " and name "HN ") (segid " " and resid "17 " and name "HB ") ASSI { 1098} (segid " " and resid "17 " and name "HN ") (segid " " and resid "16 " and name "HA ") 2.700 2.700 0.000 peak 1098 weight 0.10000E+01 volume 0.52190E+01 ppm1 8.943 ppm2 4.902 ASSI { 1106} (segid " " and resid "17 " and name "HN ") (segid " " and resid "1 " and name "HG1 ") 6.000 6.000 0.000 peak 1106 weight 0.10000E+01 volume 0.10400E+00 ppm1 8.945 ppm2 2.487 ASSI { 1107} (segid " " and resid "17 " and name "HN ") (segid " " and resid "15 " and name "HG23") 6.000 6.000 0.000 peak 1107 weight 0.10000E+01 volume 0.67000E-01 ppm1 8.945 ppm2 0.940 OR { 1107} (segid " " and resid "17 " and name "HN ") (segid " " and resid "15 " and name "HG22") OR { 1107} (segid " " and resid "17 " and name "HN ") (segid " " and resid "15 " and name "HG21") ASSI { 1070} (segid " " and resid "14 " and name "HN ") (segid " " and resid "14 " and name "HB ") 5.000 5.000 0.000 peak 1070 weight 0.10000E+01 volume 0.16200E+01 ppm1 8.586 ppm2 4.031 ASSI { 1069} (segid " " and resid "14 " and name "HN ") (segid " " and resid "13 " and name "HA ") 2.700 2.700 0.000 peak 1069 weight 0.10000E+01 volume 0.42830E+01 ppm1 8.586 ppm2 4.661 ASSI { 1071} (segid " " and resid "14 " and name "HN ") (segid " " and resid "13 " and name "HB ") 5.000 5.000 0.000 peak 1071 weight 0.10000E+01 volume 0.13260E+01 ppm1 8.586 ppm2 2.147 ASSI { 1074} (segid " " and resid "14 " and name "HN ") (segid " " and resid "14 " and name "HG22") 5.000 5.000 0.000 peak 1074 weight 0.10000E+01 volume 0.58900E+00 ppm1 8.585 ppm2 1.107 OR { 1074} (segid " " and resid "14 " and name "HN ") (segid " " and resid "14 " and name "HG21") ASSI { 1072} (segid " " and resid "14 " and name "HN ") (segid " " and resid "13 " and name "HG22") 5.000 5.000 0.000 peak 1072 weight 0.10000E+01 volume 0.98900E+00 ppm1 8.586 ppm2 0.924 OR { 1072} (segid " " and resid "14 " and name "HN ") (segid " " and resid "13 " and name "HG23") OR { 1072} (segid " " and resid "14 " and name "HN ") (segid " " and resid "13 " and name "HG21") OR { 1072} (segid " " and resid "14 " and name "HN ") (segid " " and resid "13 " and name "HG13") OR { 1072} (segid " " and resid "14 " and name "HN ") (segid " " and resid "13 " and name "HG12") ASSI { 1073} (segid " " and resid "14 " and name "HN ") (segid " " and resid "14 " and name "HA ") 5.000 5.000 0.000 peak 1073 weight 0.10000E+01 volume 0.67900E+00 ppm1 8.586 ppm2 5.105 ASSI { 1077} (segid " " and resid "14 " and name "HN ") (segid " " and resid "11 " and name "HD1 ") 6.000 6.000 0.000 peak 1077 weight 0.10000E+01 volume 0.47000E-01 ppm1 8.585 ppm2 1.665 OR { 1077} (segid " " and resid "14 " and name "HN ") (segid " " and resid "15 " and name "HB ") OR { 1077} (segid " " and resid "14 " and name "HN ") (segid " " and resid "11 " and name "HD2 ") OR { 1077} (segid " " and resid "14 " and name "HN ") (segid " " and resid "2 " and name "HB2 ") ASSI { 1075} (segid " " and resid "14 " and name "HN ") (segid " " and resid "15 " and name "HN ") 6.000 6.000 0.000 peak 1075 weight 0.10000E+01 volume 0.20300E+00 ppm1 8.585 ppm2 8.826 ASSI { 1076} (segid " " and resid "14 " and name "HN ") (segid " " and resid "13 " and name "HN ") 6.000 6.000 0.000 peak 1076 weight 0.10000E+01 volume 0.83000E-01 ppm1 8.590 ppm2 9.277 ASSI { 1582} (segid " " and resid "56 " and name "HN ") (segid " " and resid "23 " and name "HN ") 6.000 6.000 0.000 peak 1582 weight 0.10000E+01 volume 0.15700E+00 ppm1 8.514 ppm2 8.831 OR { 1582} (segid " " and resid "56 " and name "HN ") (segid " " and resid "55 " and name "HN ") ASSI { 1573} (segid " " and resid "56 " and name "HN ") (segid " " and resid "56 " and name "HG ") 3.300 3.300 0.000 peak 1573 weight 0.10000E+01 volume 0.24040E+01 ppm1 8.514 ppm2 1.654 ASSI { 1576} (segid " " and resid "56 " and name "HN ") (segid " " and resid "56 " and name "HB2 ") 5.000 5.000 0.000 peak 1576 weight 0.10000E+01 volume 0.12780E+01 ppm1 8.514 ppm2 1.872 ASSI { 1579} (segid " " and resid "56 " and name "HN ") (segid " " and resid "56 " and name "HD22") 5.000 5.000 0.000 peak 1579 weight 0.10000E+01 volume 0.69300E+00 ppm1 8.514 ppm2 0.313 OR { 1579} (segid " " and resid "56 " and name "HN ") (segid " " and resid "56 " and name "HD23") OR { 1579} (segid " " and resid "56 " and name "HN ") (segid " " and resid "56 " and name "HD21") ASSI { 1577} (segid " " and resid "56 " and name "HN ") (segid " " and resid "56 " and name "HA ") 5.000 5.000 0.000 peak 1577 weight 0.10000E+01 volume 0.86100E+00 ppm1 8.514 ppm2 4.033 ASSI { 1575} (segid " " and resid "56 " and name "HN ") (segid " " and resid "55 " and name "HB ") 3.300 3.300 0.000 peak 1575 weight 0.10000E+01 volume 0.20930E+01 ppm1 8.514 ppm2 4.479 ASSI { 1578} (segid " " and resid "56 " and name "HN ") (segid " " and resid "56 " and name "HB1 ") 5.000 5.000 0.000 peak 1578 weight 0.10000E+01 volume 0.86500E+00 ppm1 8.514 ppm2 1.072 OR { 1578} (segid " " and resid "56 " and name "HN ") (segid " " and resid "23 " and name "HG21") OR { 1578} (segid " " and resid "56 " and name "HN ") (segid " " and resid "23 " and name "HG23") OR { 1578} (segid " " and resid "56 " and name "HN ") (segid " " and resid "23 " and name "HG22") ASSI { 1583} (segid " " and resid "56 " and name "HN ") (segid " " and resid "21 " and name "HB2 ") 6.000 6.000 0.000 peak 1583 weight 0.10000E+01 volume 0.54000E-01 ppm1 8.513 ppm2 2.909 ASSI { 1574} (segid " " and resid "56 " and name "HN ") (segid " " and resid "55 " and name "HA ") 3.300 3.300 0.000 peak 1574 weight 0.10000E+01 volume 0.22450E+01 ppm1 8.514 ppm2 5.234 ASSI { 1581} (segid " " and resid "56 " and name "HN ") (segid " " and resid "21 " and name "HN ") 6.000 6.000 0.000 peak 1581 weight 0.10000E+01 volume 0.10600E+00 ppm1 8.514 ppm2 7.855 OR { 1581} (segid " " and resid "56 " and name "HN ") (segid " " and resid "58 " and name "HN ") ASSI { 1544} (segid " " and resid "54 " and name "HN ") (segid " " and resid "54 " and name "HA ") 5.000 5.000 0.000 peak 1544 weight 0.10000E+01 volume 0.10460E+01 ppm1 7.492 ppm2 4.820 OR { 1544} (segid " " and resid "54 " and name "HN ") (segid " " and resid "22 " and name "HB ") ASSI { 1550} (segid " " and resid "54 " and name "HN ") (segid " " and resid "23 " and name "HG21") 5.000 5.000 0.000 peak 1550 weight 0.10000E+01 volume 0.40700E+00 ppm1 7.490 ppm2 1.065 OR { 1550} (segid " " and resid "54 " and name "HN ") (segid " " and resid "23 " and name "HG22") OR { 1550} (segid " " and resid "54 " and name "HN ") (segid " " and resid "23 " and name "HG23") ASSI { 1545} (segid " " and resid "54 " and name "HN ") (segid " " and resid "53 " and name "HN ") 5.000 5.000 0.000 peak 1545 weight 0.10000E+01 volume 0.10480E+01 ppm1 7.490 ppm2 10.142 ASSI { 1553} (segid " " and resid "54 " and name "HN ") (segid " " and resid "59 " and name "HE1 ") 6.000 6.000 0.000 peak 1553 weight 0.10000E+01 volume 0.73000E-01 ppm1 7.492 ppm2 6.853 OR { 1553} (segid " " and resid "54 " and name "HN ") (segid " " and resid "59 " and name "HE2 ") ASSI { 1551} (segid " " and resid "54 " and name "HN ") (segid " " and resid "23 " and name "HN ") 6.000 6.000 0.000 peak 1551 weight 0.10000E+01 volume 0.26300E+00 ppm1 7.490 ppm2 8.834 OR { 1551} (segid " " and resid "54 " and name "HN ") (segid " " and resid "55 " and name "HN ") ASSI { 1546} (segid " " and resid "54 " and name "HN ") (segid " " and resid "54 " and name "HG2 ") 5.000 5.000 0.000 peak 1546 weight 0.10000E+01 volume 0.67600E+00 ppm1 7.487 ppm2 1.660 ASSI { 1549} (segid " " and resid "54 " and name "HN ") (segid " " and resid "53 " and name "HA2 ") 5.000 5.000 0.000 peak 1549 weight 0.10000E+01 volume 0.39000E+00 ppm1 7.490 ppm2 3.942 ASSI { 1554} (segid " " and resid "54 " and name "HN ") (segid " " and resid "23 " and name "HG11") 6.000 6.000 0.000 peak 1554 weight 0.10000E+01 volume 0.68000E-01 ppm1 7.491 ppm2 0.818 OR { 1554} (segid " " and resid "54 " and name "HN ") (segid " " and resid "23 " and name "HG12") OR { 1554} (segid " " and resid "54 " and name "HN ") (segid " " and resid "23 " and name "HG13") ASSI { 1543} (segid " " and resid "54 " and name "HN ") (segid " " and resid "54 " and name "HB2 ") 3.300 3.300 0.000 peak 1543 weight 0.10000E+01 volume 0.23040E+01 ppm1 7.490 ppm2 2.375 OR { 1543} (segid " " and resid "54 " and name "HN ") (segid " " and resid "54 " and name "HB1 ") ASSI { 1548} (segid " " and resid "54 " and name "HN ") (segid " " and resid "53 " and name "HA1 ") 5.000 5.000 0.000 peak 1548 weight 0.10000E+01 volume 0.65300E+00 ppm1 7.490 ppm2 4.318 ASSI { 1556} (segid " " and resid "54 " and name "HN ") (segid " " and resid "52 " and name "HN ") 6.000 6.000 0.000 peak 1556 weight 0.10000E+01 volume 0.31000E-01 ppm1 7.494 ppm2 8.217 ASSI { 1547} (segid " " and resid "54 " and name "HN ") (segid " " and resid "54 " and name "HG1 ") 5.000 5.000 0.000 peak 1547 weight 0.10000E+01 volume 0.52100E+00 ppm1 7.490 ppm2 1.935 ASSI { 1552} (segid " " and resid "54 " and name "HN ") (segid " " and resid "54 " and name "HD2 ") 6.000 6.000 0.000 peak 1552 weight 0.10000E+01 volume 0.17100E+00 ppm1 7.491 ppm2 3.192 OR { 1552} (segid " " and resid "54 " and name "HN ") (segid " " and resid "54 " and name "HD1 ") ASSI { 1555} (segid " " and resid "54 " and name "HN ") (segid " " and resid "52 " and name "HB1 ") 6.000 6.000 0.000 peak 1555 weight 0.10000E+01 volume 0.73000E-01 ppm1 7.492 ppm2 2.639 OR { 1555} (segid " " and resid "54 " and name "HN ") (segid " " and resid "27 " and name "HE2 ") ASSI { 1299} (segid " " and resid "32 " and name "HN ") (segid " " and resid "31 " and name "HA ") 6.000 6.000 0.000 peak 1299 weight 0.10000E+01 volume 0.26300E+00 ppm1 7.874 ppm2 3.785 ASSI { 1298} (segid " " and resid "32 " and name "HN ") (segid " " and resid "29 " and name "HA ") 5.000 5.000 0.000 peak 1298 weight 0.10000E+01 volume 0.68900E+00 ppm1 7.875 ppm2 4.162 OR { 1298} (segid " " and resid "32 " and name "HN ") (segid " " and resid "28 " and name "HA ") ASSI { 1295} (segid " " and resid "32 " and name "HN ") (segid " " and resid "31 " and name "HB1 ") 5.000 5.000 0.000 peak 1295 weight 0.10000E+01 volume 0.11560E+01 ppm1 7.874 ppm2 2.407 ASSI { 1293} (segid " " and resid "32 " and name "HN ") (segid " " and resid "32 " and name "HA ") 5.000 5.000 0.000 peak 1293 weight 0.10000E+01 volume 0.11910E+01 ppm1 7.875 ppm2 4.323 ASSI { 1296} (segid " " and resid "32 " and name "HN ") (segid " " and resid "31 " and name "HN ") 5.000 5.000 0.000 peak 1296 weight 0.10000E+01 volume 0.91800E+00 ppm1 7.874 ppm2 8.464 ASSI { 1297} (segid " " and resid "32 " and name "HN ") (segid " " and resid "31 " and name "HG2 ") 5.000 5.000 0.000 peak 1297 weight 0.10000E+01 volume 0.88600E+00 ppm1 7.874 ppm2 1.899 OR { 1297} (segid " " and resid "32 " and name "HN ") (segid " " and resid "31 " and name "HB2 ") ASSI { 1292} (segid " " and resid "32 " and name "HN ") (segid " " and resid "32 " and name "HB1 ") 3.300 3.300 0.000 peak 1292 weight 0.10000E+01 volume 0.28800E+01 ppm1 7.874 ppm2 2.800 ASSI { 1302} (segid " " and resid "32 " and name "HN ") (segid " " and resid "34 " and name "HN ") 6.000 6.000 0.000 peak 1302 weight 0.10000E+01 volume 0.69000E-01 ppm1 7.877 ppm2 8.820 ASSI { 1300} (segid " " and resid "32 " and name "HN ") (segid " " and resid "33 " and name "HG2 ") 6.000 6.000 0.000 peak 1300 weight 0.10000E+01 volume 0.15200E+00 ppm1 7.874 ppm2 1.601 OR { 1300} (segid " " and resid "32 " and name "HN ") (segid " " and resid "33 " and name "HG1 ") OR { 1300} (segid " " and resid "32 " and name "HN ") (segid " " and resid "28 " and name "HB2 ") OR { 1300} (segid " " and resid "32 " and name "HN ") (segid " " and resid "28 " and name "HB1 ") OR { 1300} (segid " " and resid "32 " and name "HN ") (segid " " and resid "28 " and name "HB3 ") ASSI { 1301} (segid " " and resid "32 " and name "HN ") (segid " " and resid "30 " and name "HN ") 6.000 6.000 0.000 peak 1301 weight 0.10000E+01 volume 0.15100E+00 ppm1 7.873 ppm2 8.163 ASSI { 1303} (segid " " and resid "32 " and name "HN ") (segid " " and resid "30 " and name "HA ") 6.000 6.000 0.000 peak 1303 weight 0.10000E+01 volume 0.67000E-01 ppm1 7.875 ppm2 3.333 ASSI { 1341} (segid " " and resid "36 " and name "HN ") (segid " " and resid "31 " and name "HG1 ") 6.000 6.000 0.000 peak 1341 weight 0.10000E+01 volume 0.29200E+00 ppm1 6.193 ppm2 2.275 ASSI { 1336} (segid " " and resid "36 " and name "HN ") (segid " " and resid "35 " and name "HN ") 5.000 5.000 0.000 peak 1336 weight 0.10000E+01 volume 0.74700E+00 ppm1 6.193 ppm2 8.300 ASSI { 1342} (segid " " and resid "36 " and name "HN ") (segid " " and resid "34 " and name "HN ") 6.000 6.000 0.000 peak 1342 weight 0.10000E+01 volume 0.12200E+00 ppm1 6.193 ppm2 8.807 ASSI { 1337} (segid " " and resid "36 " and name "HN ") (segid " " and resid "36 " and name "HG23") 5.000 5.000 0.000 peak 1337 weight 0.10000E+01 volume 0.74100E+00 ppm1 6.192 ppm2 0.855 OR { 1337} (segid " " and resid "36 " and name "HN ") (segid " " and resid "36 " and name "HG21") OR { 1337} (segid " " and resid "36 " and name "HN ") (segid " " and resid "36 " and name "HG22") OR { 1337} (segid " " and resid "36 " and name "HN ") (segid " " and resid "69 " and name "HD13") OR { 1337} (segid " " and resid "36 " and name "HN ") (segid " " and resid "71 " and name "HD23") ASSI { 1338} (segid " " and resid "36 " and name "HN ") (segid " " and resid "36 " and name "HG12") 5.000 5.000 0.000 peak 1338 weight 0.10000E+01 volume 0.56800E+00 ppm1 6.192 ppm2 1.136 ASSI { 1334} (segid " " and resid "36 " and name "HN ") (segid " " and resid "31 " and name "HA ") 5.000 5.000 0.000 peak 1334 weight 0.10000E+01 volume 0.14260E+01 ppm1 6.192 ppm2 3.776 ASSI { 1335} (segid " " and resid "36 " and name "HN ") (segid " " and resid "36 " and name "HA ") 5.000 5.000 0.000 peak 1335 weight 0.10000E+01 volume 0.76900E+00 ppm1 6.191 ppm2 4.502 ASSI { 1344} (segid " " and resid "36 " and name "HN ") (segid " " and resid "41 " and name "HE22") 6.000 6.000 0.000 peak 1344 weight 0.10000E+01 volume 0.10800E+00 ppm1 6.192 ppm2 6.443 ASSI { 1343} (segid " " and resid "36 " and name "HN ") (segid " " and resid "30 " and name "HG23") 6.000 6.000 0.000 peak 1343 weight 0.10000E+01 volume 0.11400E+00 ppm1 6.191 ppm2 0.518 OR { 1343} (segid " " and resid "36 " and name "HN ") (segid " " and resid "30 " and name "HG22") OR { 1343} (segid " " and resid "36 " and name "HN ") (segid " " and resid "30 " and name "HG21") ASSI { 1339} (segid " " and resid "36 " and name "HN ") (segid " " and resid "35 " and name "HA1 ") 5.000 5.000 0.000 peak 1339 weight 0.10000E+01 volume 0.33000E+00 ppm1 6.192 ppm2 4.122 ASSI { 1340} (segid " " and resid "36 " and name "HN ") (segid " " and resid "31 " and name "HG2 ") 5.000 5.000 0.000 peak 1340 weight 0.10000E+01 volume 0.31700E+00 ppm1 6.193 ppm2 1.940 ASSI { 1058} (segid " " and resid "12 " and name "HN ") (segid " " and resid "11 " and name "HN ") 6.000 6.000 0.000 peak 1058 weight 0.10000E+01 volume 0.87000E-01 ppm1 8.557 ppm2 7.206 ASSI { 1050} (segid " " and resid "12 " and name "HN ") (segid " " and resid "11 " and name "HA ") 2.700 2.700 0.000 peak 1050 weight 0.10000E+01 volume 0.45960E+01 ppm1 8.558 ppm2 4.355 ASSI { 1055} (segid " " and resid "12 " and name "HN ") (segid " " and resid "11 " and name "HB1 ") 5.000 5.000 0.000 peak 1055 weight 0.10000E+01 volume 0.76400E+00 ppm1 8.557 ppm2 1.767 ASSI { 1052} (segid " " and resid "12 " and name "HN ") (segid " " and resid "12 " and name "HB ") 5.000 5.000 0.000 peak 1052 weight 0.10000E+01 volume 0.16570E+01 ppm1 8.558 ppm2 3.925 ASSI { 1057} (segid " " and resid "12 " and name "HN ") (segid " " and resid "12 " and name "HG23") 6.000 6.000 0.000 peak 1057 weight 0.10000E+01 volume 0.20700E+00 ppm1 8.554 ppm2 1.015 OR { 1057} (segid " " and resid "12 " and name "HN ") (segid " " and resid "12 " and name "HG22") ASSI { 1056} (segid " " and resid "12 " and name "HN ") (segid " " and resid "11 " and name "HG2 ") 5.000 5.000 0.000 peak 1056 weight 0.10000E+01 volume 0.30900E+00 ppm1 8.558 ppm2 1.303 ASSI { 1054} (segid " " and resid "12 " and name "HN ") (segid " " and resid "12 " and name "HA ") 5.000 5.000 0.000 peak 1054 weight 0.10000E+01 volume 0.59100E+00 ppm1 8.557 ppm2 5.291 ASSI { 1059} (segid " " and resid "12 " and name "HN ") (segid " " and resid "13 " and name "HN ") 6.000 6.000 0.000 peak 1059 weight 0.10000E+01 volume 0.93000E-01 ppm1 8.559 ppm2 9.276 ASSI { 1116} (segid " " and resid "18 " and name "HN ") (segid " " and resid "21 " and name "HN ") 6.000 6.000 0.000 peak 1116 weight 0.10000E+01 volume 0.14200E+00 ppm1 8.507 ppm2 7.882 OR { 1116} (segid " " and resid "18 " and name "HN ") (segid " " and resid "25 " and name "HD21") ASSI { 1118} (segid " " and resid "18 " and name "HN ") (segid " " and resid "17 " and name "HN ") 6.000 6.000 0.000 peak 1118 weight 0.10000E+01 volume 0.87000E-01 ppm1 8.507 ppm2 8.946 ASSI { 1119} (segid " " and resid "18 " and name "HN ") (segid " " and resid "19 " and name "HD1 ") 6.000 6.000 0.000 peak 1119 weight 0.10000E+01 volume 0.85000E-01 ppm1 8.507 ppm2 4.016 OR { 1119} (segid " " and resid "18 " and name "HN ") (segid " " and resid "19 " and name "HA ") ASSI { 1111} (segid " " and resid "18 " and name "HN ") (segid " " and resid "56 " and name "HD12") 5.000 5.000 0.000 peak 1111 weight 0.10000E+01 volume 0.10440E+01 ppm1 8.507 ppm2 0.377 OR { 1111} (segid " " and resid "18 " and name "HN ") (segid " " and resid "17 " and name "HG21") OR { 1111} (segid " " and resid "18 " and name "HN ") (segid " " and resid "17 " and name "HG23") OR { 1111} (segid " " and resid "18 " and name "HN ") (segid " " and resid "17 " and name "HG22") OR { 1111} (segid " " and resid "18 " and name "HN ") (segid " " and resid "56 " and name "HD11") ASSI { 1113} (segid " " and resid "18 " and name "HN ") (segid " " and resid "17 " and name "HG13") 5.000 5.000 0.000 peak 1113 weight 0.10000E+01 volume 0.48700E+00 ppm1 8.508 ppm2 0.637 OR { 1113} (segid " " and resid "18 " and name "HN ") (segid " " and resid "17 " and name "HG11") OR { 1113} (segid " " and resid "18 " and name "HN ") (segid " " and resid "17 " and name "HG12") ASSI { 1112} (segid " " and resid "18 " and name "HN ") (segid " " and resid "18 " and name "HA ") 5.000 5.000 0.000 peak 1112 weight 0.10000E+01 volume 0.63000E+00 ppm1 8.506 ppm2 5.013 ASSI { 1108} (segid " " and resid "18 " and name "HN ") (segid " " and resid "17 " and name "HB ") 3.300 3.300 0.000 peak 1108 weight 0.10000E+01 volume 0.35930E+01 ppm1 8.506 ppm2 2.099 ASSI { 1109} (segid " " and resid "18 " and name "HN ") (segid " " and resid "17 " and name "HA ") 3.300 3.300 0.000 peak 1109 weight 0.10000E+01 volume 0.30150E+01 ppm1 8.507 ppm2 4.605 ASSI { 1115} (segid " " and resid "18 " and name "HN ") (segid " " and resid "18 " and name "HG1 ") 5.000 5.000 0.000 peak 1115 weight 0.10000E+01 volume 0.44800E+00 ppm1 8.507 ppm2 2.300 ASSI { 1114} (segid " " and resid "18 " and name "HN ") (segid " " and resid "21 " and name "HB2 ") 5.000 5.000 0.000 peak 1114 weight 0.10000E+01 volume 0.43100E+00 ppm1 8.507 ppm2 2.903 ASSI { 1117} (segid " " and resid "18 " and name "HN ") (segid " " and resid "21 " and name "HB1 ") 6.000 6.000 0.000 peak 1117 weight 0.10000E+01 volume 0.15600E+00 ppm1 8.508 ppm2 2.587 ASSI { 1110} (segid " " and resid "18 " and name "HN ") (segid " " and resid "18 " and name "HB2 ") 5.000 5.000 0.000 peak 1110 weight 0.10000E+01 volume 0.12760E+01 ppm1 8.507 ppm2 1.651 ASSI { 1559} (segid " " and resid "54 " and name "HE ") (segid " " and resid "54 " and name "HB1 ") 6.000 6.000 0.000 peak 1559 weight 0.10000E+01 volume 0.11500E+00 ppm1 7.147 ppm2 2.357 OR { 1559} (segid " " and resid "54 " and name "HE ") (segid " " and resid "58 " and name "HB1 ") ASSI { 1558} (segid " " and resid "54 " and name "HE ") (segid " " and resid "54 " and name "HD1 ") 6.000 6.000 0.000 peak 1558 weight 0.10000E+01 volume 0.14600E+00 ppm1 7.143 ppm2 3.210 OR { 1558} (segid " " and resid "54 " and name "HE ") (segid " " and resid "54 " and name "HD2 ") ASSI { 1023} (segid " " and resid "8 " and name "HN ") (segid " " and resid "69 " and name "HD23") 6.000 6.000 0.000 peak 1023 weight 0.10000E+01 volume 0.26100E+00 ppm1 8.892 ppm2 0.773 OR { 1023} (segid " " and resid "8 " and name "HN ") (segid " " and resid "69 " and name "HD22") OR { 1023} (segid " " and resid "8 " and name "HN ") (segid " " and resid "69 " and name "HD21") ASSI { 1022} (segid " " and resid "8 " and name "HN ") (segid " " and resid "8 " and name "HD22") 5.000 5.000 0.000 peak 1022 weight 0.10000E+01 volume 0.35200E+00 ppm1 8.893 ppm2 0.967 OR { 1022} (segid " " and resid "8 " and name "HN ") (segid " " and resid "8 " and name "HD23") OR { 1022} (segid " " and resid "8 " and name "HN ") (segid " " and resid "8 " and name "HD21") ASSI { 1021} (segid " " and resid "8 " and name "HN ") (segid " " and resid "7 " and name "HG23") 5.000 5.000 0.000 peak 1021 weight 0.10000E+01 volume 0.40400E+00 ppm1 8.892 ppm2 1.174 OR { 1021} (segid " " and resid "8 " and name "HN ") (segid " " and resid "7 " and name "HG21") OR { 1021} (segid " " and resid "8 " and name "HN ") (segid " " and resid "7 " and name "HG22") OR { 1021} (segid " " and resid "8 " and name "HN ") (segid " " and resid "6 " and name "HG2 ") ASSI { 1019} (segid " " and resid "8 " and name "HN ") (segid " " and resid "8 " and name "HA ") 5.000 5.000 0.000 peak 1019 weight 0.10000E+01 volume 0.82500E+00 ppm1 8.892 ppm2 4.293 ASSI { 1018} (segid " " and resid "8 " and name "HN ") (segid " " and resid "8 " and name "HB1 ") 5.000 5.000 0.000 peak 1018 weight 0.10000E+01 volume 0.11380E+01 ppm1 8.892 ppm2 1.741 ASSI { 1017} (segid " " and resid "8 " and name "HN ") (segid " " and resid "8 " and name "HB2 ") 3.300 3.300 0.000 peak 1017 weight 0.10000E+01 volume 0.23670E+01 ppm1 8.892 ppm2 1.893 ASSI { 1024} (segid " " and resid "8 " and name "HN ") (segid " " and resid "10 " and name "HN ") 6.000 6.000 0.000 peak 1024 weight 0.10000E+01 volume 0.55000E-01 ppm1 8.892 ppm2 7.868 ASSI { 1324} (segid " " and resid "35 " and name "HN ") (segid " " and resid "35 " and name "HA2 ") 3.300 3.300 0.000 peak 1324 weight 0.10000E+01 volume 0.20200E+01 ppm1 8.301 ppm2 3.926 ASSI { 1326} (segid " " and resid "35 " and name "HN ") (segid " " and resid "35 " and name "HA1 ") 5.000 5.000 0.000 peak 1326 weight 0.10000E+01 volume 0.11770E+01 ppm1 8.301 ppm2 4.099 ASSI { 1323} (segid " " and resid "35 " and name "HN ") (segid " " and resid "34 " and name "HN ") 3.300 3.300 0.000 peak 1323 weight 0.10000E+01 volume 0.21170E+01 ppm1 8.301 ppm2 8.815 ASSI { 1327} (segid " " and resid "35 " and name "HN ") (segid " " and resid "31 " and name "HG2 ") 5.000 5.000 0.000 peak 1327 weight 0.10000E+01 volume 0.34000E+00 ppm1 8.300 ppm2 1.931 OR { 1327} (segid " " and resid "35 " and name "HN ") (segid " " and resid "31 " and name "HB2 ") ASSI { 1329} (segid " " and resid "35 " and name "HN ") (segid " " and resid "34 " and name "HB1 ") 6.000 6.000 0.000 peak 1329 weight 0.10000E+01 volume 0.22800E+00 ppm1 8.301 ppm2 2.282 ASSI { 1328} (segid " " and resid "35 " and name "HN ") (segid " " and resid "34 " and name "HB2 ") 6.000 6.000 0.000 peak 1328 weight 0.10000E+01 volume 0.26700E+00 ppm1 8.301 ppm2 1.660 ASSI { 1330} (segid " " and resid "35 " and name "HN ") (segid " " and resid "34 " and name "HA ") 6.000 6.000 0.000 peak 1330 weight 0.10000E+01 volume 0.25900E+00 ppm1 8.303 ppm2 4.489 ASSI { 1172} (segid " " and resid "24 " and name "HN ") (segid " " and resid "23 " and name "HN ") 5.000 5.000 0.000 peak 1172 weight 0.10000E+01 volume 0.45100E+00 ppm1 10.599 ppm2 8.797 ASSI { 1175} (segid " " and resid "24 " and name "HN ") (segid " " and resid "24 " and name "HG1 ") 6.000 6.000 0.000 peak 1175 weight 0.10000E+01 volume 0.26600E+00 ppm1 10.600 ppm2 2.512 ASSI { 1169} (segid " " and resid "24 " and name "HN ") (segid " " and resid "24 " and name "HA ") 5.000 5.000 0.000 peak 1169 weight 0.10000E+01 volume 0.59600E+00 ppm1 10.599 ppm2 3.947 ASSI { 1173} (segid " " and resid "24 " and name "HN ") (segid " " and resid "52 " and name "HA ") 6.000 6.000 0.000 peak 1173 weight 0.10000E+01 volume 0.25400E+00 ppm1 10.600 ppm2 4.371 ASSI { 1332} (segid " " and resid "35 " and name "HN ") (segid " " and resid "36 " and name "HG11") 6.000 6.000 0.000 peak 1332 weight 0.10000E+01 volume 0.58000E-01 ppm1 8.301 ppm2 1.411 ASSI { 1167} (segid " " and resid "24 " and name "HN ") (segid " " and resid "24 " and name "HB1 ") 5.000 5.000 0.000 peak 1167 weight 0.10000E+01 volume 0.12140E+01 ppm1 10.599 ppm2 2.037 OR { 1167} (segid " " and resid "24 " and name "HN ") (segid " " and resid "24 " and name "HB2 ") ASSI { 1170} (segid " " and resid "24 " and name "HN ") (segid " " and resid "23 " and name "HB ") 5.000 5.000 0.000 peak 1170 weight 0.10000E+01 volume 0.74900E+00 ppm1 10.599 ppm2 2.288 ASSI { 1177} (segid " " and resid "24 " and name "HN ") (segid " " and resid "23 " and name "HA ") 6.000 6.000 0.000 peak 1177 weight 0.10000E+01 volume 0.11900E+00 ppm1 10.600 ppm2 3.573 OR { 1177} (segid " " and resid "24 " and name "HN ") (segid " " and resid "26 " and name "HB1 ") ASSI { 1168} (segid " " and resid "24 " and name "HN ") (segid " " and resid "22 " and name "HB ") 5.000 5.000 0.000 peak 1168 weight 0.10000E+01 volume 0.93100E+00 ppm1 10.599 ppm2 4.811 ASSI { 1174} (segid " " and resid "24 " and name "HN ") (segid " " and resid "23 " and name "HG13") 6.000 6.000 0.000 peak 1174 weight 0.10000E+01 volume 0.22300E+00 ppm1 10.600 ppm2 0.828 OR { 1174} (segid " " and resid "24 " and name "HN ") (segid " " and resid "23 " and name "HG12") OR { 1174} (segid " " and resid "24 " and name "HN ") (segid " " and resid "23 " and name "HG11") ASSI { 1178} (segid " " and resid "24 " and name "HN ") (segid " " and resid "23 " and name "HG21") 6.000 6.000 0.000 peak 1178 weight 0.10000E+01 volume 0.10700E+00 ppm1 10.599 ppm2 1.063 OR { 1178} (segid " " and resid "24 " and name "HN ") (segid " " and resid "23 " and name "HG23") OR { 1178} (segid " " and resid "24 " and name "HN ") (segid " " and resid "23 " and name "HG22") ASSI { 1179} (segid " " and resid "24 " and name "HN ") (segid " " and resid "53 " and name "HN ") 6.000 6.000 0.000 peak 1179 weight 0.10000E+01 volume 0.11700E+00 ppm1 10.600 ppm2 10.142 ASSI { 1171} (segid " " and resid "24 " and name "HN ") (segid " " and resid "25 " and name "HN ") 5.000 5.000 0.000 peak 1171 weight 0.10000E+01 volume 0.50800E+00 ppm1 10.599 ppm2 8.145 ASSI { 1176} (segid " " and resid "24 " and name "HN ") (segid " " and resid "22 " and name "HG22") 6.000 6.000 0.000 peak 1176 weight 0.10000E+01 volume 0.10200E+00 ppm1 10.600 ppm2 1.332 OR { 1176} (segid " " and resid "24 " and name "HN ") (segid " " and resid "22 " and name "HG23") OR { 1176} (segid " " and resid "24 " and name "HN ") (segid " " and resid "22 " and name "HG21") ASSI { 1251} (segid " " and resid "29 " and name "HN ") (segid " " and resid "29 " and name "HE2 ") 6.000 6.000 0.000 peak 1251 weight 0.10000E+01 volume 0.89000E-01 ppm1 7.922 ppm2 3.119 OR { 1251} (segid " " and resid "29 " and name "HN ") (segid " " and resid "29 " and name "HE1 ") OR { 1251} (segid " " and resid "29 " and name "HN ") (segid " " and resid "25 " and name "HB1 ") ASSI { 1250} (segid " " and resid "29 " and name "HN ") (segid " " and resid "30 " and name "HG11") 6.000 6.000 0.000 peak 1250 weight 0.10000E+01 volume 0.98000E-01 ppm1 7.924 ppm2 1.300 ASSI { 1252} (segid " " and resid "29 " and name "HN ") (segid " " and resid "27 " and name "HN ") 6.000 6.000 0.000 peak 1252 weight 0.10000E+01 volume 0.50000E-01 ppm1 7.920 ppm2 8.922 ASSI { 1245} (segid " " and resid "29 " and name "HN ") (segid " " and resid "29 " and name "HG2 ") 5.000 5.000 0.000 peak 1245 weight 0.10000E+01 volume 0.18940E+01 ppm1 7.922 ppm2 1.609 OR { 1245} (segid " " and resid "29 " and name "HN ") (segid " " and resid "28 " and name "HB3 ") OR { 1245} (segid " " and resid "29 " and name "HN ") (segid " " and resid "28 " and name "HB2 ") ASSI { 1240} (segid " " and resid "29 " and name "HN ") (segid " " and resid "29 " and name "HG1 ") 3.300 3.300 0.000 peak 1240 weight 0.10000E+01 volume 0.25570E+01 ppm1 7.922 ppm2 1.858 OR { 1240} (segid " " and resid "29 " and name "HN ") (segid " " and resid "29 " and name "HD1 ") OR { 1240} (segid " " and resid "29 " and name "HN ") (segid " " and resid "29 " and name "HB1 ") ASSI { 1243} (segid " " and resid "29 " and name "HN ") (segid " " and resid "29 " and name "HB2 ") 5.000 5.000 0.000 peak 1243 weight 0.10000E+01 volume 0.18890E+01 ppm1 7.922 ppm2 2.210 ASSI { 1248} (segid " " and resid "29 " and name "HN ") (segid " " and resid "26 " and name "HA ") 5.000 5.000 0.000 peak 1248 weight 0.10000E+01 volume 0.54200E+00 ppm1 7.921 ppm2 4.558 OR { 1248} (segid " " and resid "29 " and name "HN ") (segid " " and resid "25 " and name "HA ") ASSI { 1246} (segid " " and resid "29 " and name "HN ") (segid " " and resid "29 " and name "HA ") 5.000 5.000 0.000 peak 1246 weight 0.10000E+01 volume 0.12520E+01 ppm1 7.922 ppm2 4.165 OR { 1246} (segid " " and resid "29 " and name "HN ") (segid " " and resid "28 " and name "HA ") ASSI { 1247} (segid " " and resid "29 " and name "HN ") (segid " " and resid "30 " and name "HN ") 5.000 5.000 0.000 peak 1247 weight 0.10000E+01 volume 0.13470E+01 ppm1 7.921 ppm2 8.175 ASSI { 1249} (segid " " and resid "29 " and name "HN ") (segid " " and resid "31 " and name "HN ") 6.000 6.000 0.000 peak 1249 weight 0.10000E+01 volume 0.12700E+00 ppm1 7.922 ppm2 8.464 ASSI { 1682} (segid " " and resid "63 " and name "HN ") (segid " " and resid "62 " and name "HN ") 6.000 6.000 0.000 peak 1682 weight 0.10000E+01 volume 0.58000E-01 ppm1 8.368 ppm2 7.733 ASSI { 1678} (segid " " and resid "63 " and name "HN ") (segid " " and resid "63 " and name "HA ") 5.000 5.000 0.000 peak 1678 weight 0.10000E+01 volume 0.10580E+01 ppm1 8.373 ppm2 3.930 ASSI { 1679} (segid " " and resid "63 " and name "HN ") (segid " " and resid "63 " and name "HG2 ") 5.000 5.000 0.000 peak 1679 weight 0.10000E+01 volume 0.78800E+00 ppm1 8.373 ppm2 1.465 ASSI { 1676} (segid " " and resid "63 " and name "HN ") (segid " " and resid "63 " and name "HB2 ") 3.300 3.300 0.000 peak 1676 weight 0.10000E+01 volume 0.25110E+01 ppm1 8.373 ppm2 1.807 OR { 1676} (segid " " and resid "63 " and name "HN ") (segid " " and resid "62 " and name "HB2 ") ASSI { 1677} (segid " " and resid "63 " and name "HN ") (segid " " and resid "62 " and name "HB1 ") 3.300 3.300 0.000 peak 1677 weight 0.10000E+01 volume 0.20240E+01 ppm1 8.373 ppm2 2.203 ASSI { 1675} (segid " " and resid "63 " and name "HN ") (segid " " and resid "62 " and name "HA ") 3.300 3.300 0.000 peak 1675 weight 0.10000E+01 volume 0.23550E+01 ppm1 8.373 ppm2 4.544 ASSI { 1150} (segid " " and resid "22 " and name "HN ") (segid " " and resid "55 " and name "HA ") 6.000 6.000 0.000 peak 1150 weight 0.10000E+01 volume 0.10400E+00 ppm1 8.153 ppm2 5.234 ASSI { 1153} (segid " " and resid "22 " and name "HN ") (segid " " and resid "23 " and name "HN ") 6.000 6.000 0.000 peak 1153 weight 0.10000E+01 volume 0.70000E-01 ppm1 8.149 ppm2 8.795 OR { 1153} (segid " " and resid "52 " and name "HN ") (segid " " and resid "23 " and name "HN ") ASSI { 1152} (segid " " and resid "22 " and name "HN ") (segid " " and resid "55 " and name "HG21") 6.000 6.000 0.000 peak 1152 weight 0.10000E+01 volume 0.96000E-01 ppm1 8.154 ppm2 1.149 OR { 1152} (segid " " and resid "22 " and name "HN ") (segid " " and resid "55 " and name "HG22") OR { 1152} (segid " " and resid "22 " and name "HN ") (segid " " and resid "55 " and name "HG23") ASSI { 1145} (segid " " and resid "22 " and name "HN ") (segid " " and resid "22 " and name "HG23") 5.000 5.000 0.000 peak 1145 weight 0.10000E+01 volume 0.19710E+01 ppm1 8.153 ppm2 1.338 OR { 1145} (segid " " and resid "22 " and name "HN ") (segid " " and resid "22 " and name "HG21") OR { 1145} (segid " " and resid "22 " and name "HN ") (segid " " and resid "22 " and name "HG22") ASSI { 1146} (segid " " and resid "22 " and name "HN ") (segid " " and resid "21 " and name "HB1 ") 5.000 5.000 0.000 peak 1146 weight 0.10000E+01 volume 0.10070E+01 ppm1 8.153 ppm2 2.589 OR { 1146} (segid " " and resid "52 " and name "HN ") (segid " " and resid "27 " and name "HE2 ") ASSI { 1147} (segid " " and resid "22 " and name "HN ") (segid " " and resid "25 " and name "HB2 ") 5.000 5.000 0.000 peak 1147 weight 0.10000E+01 volume 0.85400E+00 ppm1 8.153 ppm2 2.923 ASSI { 1148} (segid " " and resid "22 " and name "HN ") (segid " " and resid "25 " and name "HB1 ") 5.000 5.000 0.000 peak 1148 weight 0.10000E+01 volume 0.77600E+00 ppm1 8.153 ppm2 3.083 ASSI { 1144} (segid " " and resid "22 " and name "HN ") (segid " " and resid "21 " and name "HA ") 2.700 2.700 0.000 peak 1144 weight 0.10000E+01 volume 0.46880E+01 ppm1 8.153 ppm2 4.684 ASSI { 1151} (segid " " and resid "22 " and name "HN ") (segid " " and resid "26 " and name "HN ") 6.000 6.000 0.000 peak 1151 weight 0.10000E+01 volume 0.13500E+00 ppm1 8.151 ppm2 8.505 OR { 1151} (segid " " and resid "22 " and name "HN ") (segid " " and resid "56 " and name "HN ") OR { 1151} (segid " " and resid "22 " and name "HN ") (segid " " and resid "18 " and name "HN ") ASSI { 1154} (segid " " and resid "22 " and name "HN ") (segid " " and resid "25 " and name "HD22") 6.000 6.000 0.000 peak 1154 weight 0.10000E+01 volume 0.37000E-01 ppm1 8.152 ppm2 6.879 ASSI { 1149} (segid " " and resid "22 " and name "HN ") (segid " " and resid "25 " and name "HD21") 6.000 6.000 0.000 peak 1149 weight 0.10000E+01 volume 0.26700E+00 ppm1 8.154 ppm2 7.862 ASSI { 1040} (segid " " and resid "10 " and name "HN ") (segid " " and resid "11 " and name "HB2 ") 6.000 6.000 0.000 peak 1040 weight 0.10000E+01 volume 0.83000E-01 ppm1 7.863 ppm2 1.687 OR { 1040} (segid " " and resid "10 " and name "HN ") (segid " " and resid "6 " and name "HB1 ") OR { 1040} (segid " " and resid "10 " and name "HN ") (segid " " and resid "8 " and name "HB1 ") ASSI { 1038} (segid " " and resid "10 " and name "HN ") (segid " " and resid "9 " and name "HG23") 6.000 6.000 0.000 peak 1038 weight 0.10000E+01 volume 0.21300E+00 ppm1 7.865 ppm2 1.243 OR { 1038} (segid " " and resid "10 " and name "HN ") (segid " " and resid "9 " and name "HG21") OR { 1038} (segid " " and resid "10 " and name "HN ") (segid " " and resid "6 " and name "HG2 ") OR { 1038} (segid " " and resid "10 " and name "HN ") (segid " " and resid "9 " and name "HG22") ASSI { 1033} (segid " " and resid "10 " and name "HN ") (segid " " and resid "10 " and name "HA2 ") 3.300 3.300 0.000 peak 1033 weight 0.10000E+01 volume 0.25270E+01 ppm1 7.864 ppm2 3.601 ASSI { 1035} (segid " " and resid "10 " and name "HN ") (segid " " and resid "10 " and name "HA1 ") 5.000 5.000 0.000 peak 1035 weight 0.10000E+01 volume 0.17070E+01 ppm1 7.864 ppm2 4.325 ASSI { 1034} (segid " " and resid "10 " and name "HN ") (segid " " and resid "11 " and name "HN ") 5.000 5.000 0.000 peak 1034 weight 0.10000E+01 volume 0.15300E+01 ppm1 7.865 ppm2 7.208 ASSI { 1527} (segid " " and resid "52 " and name "HN ") (segid " " and resid "51 " and name "HB1 ") 5.000 5.000 0.000 peak 1527 weight 0.10000E+01 volume 0.10260E+01 ppm1 8.193 ppm2 2.212 ASSI { 1526} (segid " " and resid "52 " and name "HN ") (segid " " and resid "52 " and name "HA ") 5.000 5.000 0.000 peak 1526 weight 0.10000E+01 volume 0.89200E+00 ppm1 8.193 ppm2 4.365 ASSI { 1530} (segid " " and resid "52 " and name "HN ") (segid " " and resid "23 " and name "HG11") 6.000 6.000 0.000 peak 1530 weight 0.10000E+01 volume 0.23100E+00 ppm1 8.192 ppm2 0.826 OR { 1530} (segid " " and resid "52 " and name "HN ") (segid " " and resid "23 " and name "HG13") OR { 1530} (segid " " and resid "52 " and name "HN ") (segid " " and resid "23 " and name "HG12") ASSI { 1529} (segid " " and resid "52 " and name "HN ") (segid " " and resid "51 " and name "HB2 ") 5.000 5.000 0.000 peak 1529 weight 0.10000E+01 volume 0.34600E+00 ppm1 8.193 ppm2 1.913 ASSI { 1525} (segid " " and resid "52 " and name "HN ") (segid " " and resid "52 " and name "HB2 ") 5.000 5.000 0.000 peak 1525 weight 0.10000E+01 volume 0.17500E+01 ppm1 8.193 ppm2 2.490 ASSI { 1528} (segid " " and resid "52 " and name "HN ") (segid " " and resid "52 " and name "HB1 ") 5.000 5.000 0.000 peak 1528 weight 0.10000E+01 volume 0.72000E+00 ppm1 8.193 ppm2 2.669 ASSI { 1511} (segid " " and resid "52 " and name "HN ") (segid " " and resid "51 " and name "HA ") 2.700 2.700 0.000 peak 1511 weight 0.10000E+01 volume 0.49910E+01 ppm1 8.193 ppm2 4.595 ASSI { 1531} (segid " " and resid "52 " and name "HN ") (segid " " and resid "53 " and name "HN ") 6.000 6.000 0.000 peak 1531 weight 0.10000E+01 volume 0.11500E+00 ppm1 8.193 ppm2 10.146 ASSI { 1051} (segid " " and resid "11 " and name "HN ") (segid " " and resid "6 " and name "HA ") 6.000 6.000 0.000 peak 1051 weight 0.10000E+01 volume 0.57000E-01 ppm1 7.207 ppm2 5.233 ASSI { 1047} (segid " " and resid "11 " and name "HN ") (segid " " and resid "7 " and name "HG21") 5.000 5.000 0.000 peak 1047 weight 0.10000E+01 volume 0.35100E+00 ppm1 7.207 ppm2 1.198 OR { 1047} (segid " " and resid "11 " and name "HN ") (segid " " and resid "7 " and name "HG22") OR { 1047} (segid " " and resid "11 " and name "HN ") (segid " " and resid "7 " and name "HG23") OR { 1047} (segid " " and resid "11 " and name "HN ") (segid " " and resid "6 " and name "HG2 ") ASSI { 1048} (segid " " and resid "11 " and name "HN ") (segid " " and resid "11 " and name "HG1 ") 5.000 5.000 0.000 peak 1048 weight 0.10000E+01 volume 0.33500E+00 ppm1 7.208 ppm2 1.383 OR { 1048} (segid " " and resid "11 " and name "HN ") (segid " " and resid "6 " and name "HG1 ") ASSI { 1044} (segid " " and resid "11 " and name "HN ") (segid " " and resid "10 " and name "HA2 ") 5.000 5.000 0.000 peak 1044 weight 0.10000E+01 volume 0.46800E+00 ppm1 7.209 ppm2 3.604 ASSI { 1043} (segid " " and resid "11 " and name "HN ") (segid " " and resid "11 " and name "HA ") 5.000 5.000 0.000 peak 1043 weight 0.10000E+01 volume 0.15380E+01 ppm1 7.208 ppm2 4.345 OR { 1043} (segid " " and resid "11 " and name "HN ") (segid " " and resid "10 " and name "HA1 ") ASSI { 1041} (segid " " and resid "11 " and name "HN ") (segid " " and resid "11 " and name "HB2 ") 3.300 3.300 0.000 peak 1041 weight 0.10000E+01 volume 0.20740E+01 ppm1 7.208 ppm2 1.688 ASSI { 1461} (segid " " and resid "46 " and name "HN ") (segid " " and resid "45 " and name "HB1 ") 6.000 6.000 0.000 peak 1461 weight 0.10000E+01 volume 0.12000E+00 ppm1 9.024 ppm2 2.927 ASSI { 1460} (segid " " and resid "46 " and name "HN ") (segid " " and resid "45 " and name "HD2 ") 5.000 5.000 0.000 peak 1460 weight 0.10000E+01 volume 0.39300E+00 ppm1 9.023 ppm2 7.452 OR { 1460} (segid " " and resid "46 " and name "HN ") (segid " " and resid "45 " and name "HD1 ") ASSI { 1458} (segid " " and resid "46 " and name "HN ") (segid " " and resid "46 " and name "HB1 ") 5.000 5.000 0.000 peak 1458 weight 0.10000E+01 volume 0.80400E+00 ppm1 9.023 ppm2 0.805 OR { 1458} (segid " " and resid "46 " and name "HN ") (segid " " and resid "46 " and name "HB2 ") OR { 1458} (segid " " and resid "46 " and name "HN ") (segid " " and resid "46 " and name "HB3 ") ASSI { 1455} (segid " " and resid "46 " and name "HN ") (segid " " and resid "46 " and name "HA ") 3.300 3.300 0.000 peak 1455 weight 0.10000E+01 volume 0.26450E+01 ppm1 9.023 ppm2 3.700 ASSI { 1456} (segid " " and resid "46 " and name "HN ") (segid " " and resid "45 " and name "HA ") 3.300 3.300 0.000 peak 1456 weight 0.10000E+01 volume 0.24840E+01 ppm1 9.023 ppm2 5.200 ASSI { 1459} (segid " " and resid "46 " and name "HN ") (segid " " and resid "47 " and name "HN ") 5.000 5.000 0.000 peak 1459 weight 0.10000E+01 volume 0.62000E+00 ppm1 9.023 ppm2 8.075 ASSI { 1290} (segid " " and resid "31 " and name "HE22") (segid " " and resid "37 " and name "HA ") 6.000 6.000 0.000 peak 1290 weight 0.10000E+01 volume 0.11900E+00 ppm1 6.806 ppm2 4.601 ASSI { 1288} (segid " " and resid "31 " and name "HE22") (segid " " and resid "31 " and name "HG2 ") 6.000 6.000 0.000 peak 1288 weight 0.10000E+01 volume 0.28100E+00 ppm1 6.806 ppm2 1.904 OR { 1288} (segid " " and resid "31 " and name "HE22") (segid " " and resid "37 " and name "HB2 ") OR { 1288} (segid " " and resid "31 " and name "HE22") (segid " " and resid "31 " and name "HB2 ") ASSI { 1284} (segid " " and resid "31 " and name "HE21") (segid " " and resid "37 " and name "HA ") 6.000 6.000 0.000 peak 1284 weight 0.10000E+01 volume 0.14000E+00 ppm1 7.644 ppm2 4.605 ASSI { 1283} (segid " " and resid "31 " and name "HE21") (segid " " and resid "31 " and name "HG2 ") 5.000 5.000 0.000 peak 1283 weight 0.10000E+01 volume 0.54300E+00 ppm1 7.644 ppm2 1.902 OR { 1283} (segid " " and resid "31 " and name "HE21") (segid " " and resid "31 " and name "HB2 ") ASSI { 1291} (segid " " and resid "31 " and name "HE22") (segid " " and resid "31 " and name "HB1 ") 6.000 6.000 0.000 peak 1291 weight 0.10000E+01 volume 0.14300E+00 ppm1 6.807 ppm2 2.379 OR { 1291} (segid " " and resid "31 " and name "HE22") (segid " " and resid "37 " and name "HB1 ") ASSI { 1282} (segid " " and resid "31 " and name "HE21") (segid " " and resid "31 " and name "HE22") 2.700 2.700 0.000 peak 1282 weight 0.10000E+01 volume 0.11032E+02 ppm1 7.644 ppm2 6.805 ASSI { 1286} (segid " " and resid "31 " and name "HE21") (segid " " and resid "38 " and name "HD1 ") 6.000 6.000 0.000 peak 1286 weight 0.10000E+01 volume 0.15700E+00 ppm1 7.645 ppm2 3.725 ASSI { 1285} (segid " " and resid "31 " and name "HE21") (segid " " and resid "31 " and name "HG1 ") 6.000 6.000 0.000 peak 1285 weight 0.10000E+01 volume 0.20400E+00 ppm1 7.643 ppm2 2.296 ASSI { 1289} (segid " " and resid "31 " and name "HE22") (segid " " and resid "38 " and name "HD1 ") 6.000 6.000 0.000 peak 1289 weight 0.10000E+01 volume 0.22100E+00 ppm1 6.807 ppm2 3.723 OR { 1289} (segid " " and resid "31 " and name "HE22") (segid " " and resid "38 " and name "HD2 ") ASSI { 1567} (segid " " and resid "55 " and name "HN ") (segid " " and resid "54 " and name "HG1 ") 6.000 6.000 0.000 peak 1567 weight 0.10000E+01 volume 0.12300E+00 ppm1 8.879 ppm2 1.934 ASSI { 1564} (segid " " and resid "55 " and name "HN ") (segid " " and resid "58 " and name "HB2 ") 5.000 5.000 0.000 peak 1564 weight 0.10000E+01 volume 0.74000E+00 ppm1 8.879 ppm2 3.003 ASSI { 1571} (segid " " and resid "55 " and name "HN ") (segid " " and resid "54 " and name "HD2 ") 6.000 6.000 0.000 peak 1571 weight 0.10000E+01 volume 0.12400E+00 ppm1 8.878 ppm2 3.204 ASSI { 1565} (segid " " and resid "55 " and name "HN ") (segid " " and resid "58 " and name "HN ") 6.000 6.000 0.000 peak 1565 weight 0.10000E+01 volume 0.23400E+00 ppm1 8.881 ppm2 7.812 ASSI { 1562} (segid " " and resid "55 " and name "HN ") (segid " " and resid "55 " and name "HG23") 5.000 5.000 0.000 peak 1562 weight 0.10000E+01 volume 0.11300E+01 ppm1 8.878 ppm2 1.143 OR { 1562} (segid " " and resid "55 " and name "HN ") (segid " " and resid "55 " and name "HG21") OR { 1562} (segid " " and resid "55 " and name "HN ") (segid " " and resid "55 " and name "HG22") ASSI { 1560} (segid " " and resid "55 " and name "HN ") (segid " " and resid "54 " and name "HB1 ") 3.300 3.300 0.000 peak 1560 weight 0.10000E+01 volume 0.30110E+01 ppm1 8.878 ppm2 2.370 OR { 1560} (segid " " and resid "55 " and name "HN ") (segid " " and resid "54 " and name "HB2 ") ASSI { 1561} (segid " " and resid "55 " and name "HN ") (segid " " and resid "54 " and name "HA ") 3.300 3.300 0.000 peak 1561 weight 0.10000E+01 volume 0.26220E+01 ppm1 8.879 ppm2 4.816 ASSI { 1568} (segid " " and resid "55 " and name "HN ") (segid " " and resid "55 " and name "HB ") 6.000 6.000 0.000 peak 1568 weight 0.10000E+01 volume 0.19400E+00 ppm1 8.879 ppm2 4.451 ASSI { 1563} (segid " " and resid "55 " and name "HN ") (segid " " and resid "55 " and name "HA ") 5.000 5.000 0.000 peak 1563 weight 0.10000E+01 volume 0.54900E+00 ppm1 8.878 ppm2 5.234 ASSI { 1570} (segid " " and resid "55 " and name "HN ") (segid " " and resid "54 " and name "HN ") 6.000 6.000 0.000 peak 1570 weight 0.10000E+01 volume 0.11800E+00 ppm1 8.879 ppm2 7.490 OR { 1570} (segid " " and resid "55 " and name "HN ") (segid " " and resid "59 " and name "HN ") ASSI { 1566} (segid " " and resid "55 " and name "HN ") (segid " " and resid "54 " and name "HG2 ") 6.000 6.000 0.000 peak 1566 weight 0.10000E+01 volume 0.88000E-01 ppm1 8.879 ppm2 1.660 ASSI { 1569} (segid " " and resid "55 " and name "HN ") (segid " " and resid "59 " and name "HE2 ") 6.000 6.000 0.000 peak 1569 weight 0.10000E+01 volume 0.13300E+00 ppm1 8.879 ppm2 6.861 OR { 1569} (segid " " and resid "55 " and name "HN ") (segid " " and resid "59 " and name "HE1 ") ASSI { 1572} (segid " " and resid "55 " and name "HN ") (segid " " and resid "56 " and name "HN ") 6.000 6.000 0.000 peak 1572 weight 0.10000E+01 volume 0.68000E-01 ppm1 8.880 ppm2 8.523 ASSI { 1264} (segid " " and resid "30 " and name "HN ") (segid " " and resid "29 " and name "HG2 ") 5.000 5.000 0.000 peak 1264 weight 0.10000E+01 volume 0.32900E+00 ppm1 8.164 ppm2 1.609 OR { 1264} (segid " " and resid "30 " and name "HN ") (segid " " and resid "33 " and name "HG1 ") OR { 1264} (segid " " and resid "30 " and name "HN ") (segid " " and resid "28 " and name "HB1 ") OR { 1264} (segid " " and resid "30 " and name "HN ") (segid " " and resid "28 " and name "HB3 ") OR { 1264} (segid " " and resid "30 " and name "HN ") (segid " " and resid "28 " and name "HB2 ") OR { 1264} (segid " " and resid "30 " and name "HN ") (segid " " and resid "33 " and name "HG2 ") OR { 1264} (segid " " and resid "30 " and name "HN ") (segid " " and resid "27 " and name "HG1 ") ASSI { 1263} (segid " " and resid "30 " and name "HN ") (segid " " and resid "30 " and name "HG22") 5.000 5.000 0.000 peak 1263 weight 0.10000E+01 volume 0.38000E+00 ppm1 8.165 ppm2 0.539 OR { 1263} (segid " " and resid "30 " and name "HN ") (segid " " and resid "30 " and name "HG21") OR { 1263} (segid " " and resid "30 " and name "HN ") (segid " " and resid "30 " and name "HG23") ASSI { 1259} (segid " " and resid "30 " and name "HN ") (segid " " and resid "30 " and name "HG12") 5.000 5.000 0.000 peak 1259 weight 0.10000E+01 volume 0.77000E+00 ppm1 8.164 ppm2 0.314 ASSI { 1254} (segid " " and resid "30 " and name "HN ") (segid " " and resid "30 " and name "HB ") 3.300 3.300 0.000 peak 1254 weight 0.10000E+01 volume 0.24100E+01 ppm1 8.165 ppm2 1.978 ASSI { 1257} (segid " " and resid "30 " and name "HN ") (segid " " and resid "30 " and name "HA ") 5.000 5.000 0.000 peak 1257 weight 0.10000E+01 volume 0.79300E+00 ppm1 8.164 ppm2 3.322 ASSI { 1262} (segid " " and resid "30 " and name "HN ") (segid " " and resid "29 " and name "HA ") 5.000 5.000 0.000 peak 1262 weight 0.10000E+01 volume 0.30400E+00 ppm1 8.164 ppm2 4.154 OR { 1262} (segid " " and resid "30 " and name "HN ") (segid " " and resid "28 " and name "HA ") ASSI { 1258} (segid " " and resid "30 " and name "HN ") (segid " " and resid "29 " and name "HB2 ") 5.000 5.000 0.000 peak 1258 weight 0.10000E+01 volume 0.77400E+00 ppm1 8.164 ppm2 2.223 ASSI { 1260} (segid " " and resid "30 " and name "HN ") (segid " " and resid "30 " and name "HD13") 5.000 5.000 0.000 peak 1260 weight 0.10000E+01 volume 0.47300E+00 ppm1 8.165 ppm2 0.031 OR { 1260} (segid " " and resid "30 " and name "HN ") (segid " " and resid "30 " and name "HD11") OR { 1260} (segid " " and resid "30 " and name "HN ") (segid " " and resid "30 " and name "HD12") ASSI { 1253} (segid " " and resid "30 " and name "HN ") (segid " " and resid "30 " and name "HG11") 3.300 3.300 0.000 peak 1253 weight 0.10000E+01 volume 0.21140E+01 ppm1 8.165 ppm2 1.300 ASSI { 1261} (segid " " and resid "30 " and name "HN ") (segid " " and resid "27 " and name "HA ") 5.000 5.000 0.000 peak 1261 weight 0.10000E+01 volume 0.36500E+00 ppm1 8.164 ppm2 4.364 ASSI { 1255} (segid " " and resid "30 " and name "HN ") (segid " " and resid "29 " and name "HN ") 5.000 5.000 0.000 peak 1255 weight 0.10000E+01 volume 0.13910E+01 ppm1 8.164 ppm2 7.903 OR { 1255} (segid " " and resid "30 " and name "HN ") (segid " " and resid "28 " and name "HN ") ASSI { 1265} (segid " " and resid "30 " and name "HN ") (segid " " and resid "41 " and name "HE21") 6.000 6.000 0.000 peak 1265 weight 0.10000E+01 volume 0.12900E+00 ppm1 8.165 ppm2 6.556 ASSI { 1256} (segid " " and resid "30 " and name "HN ") (segid " " and resid "31 " and name "HN ") 5.000 5.000 0.000 peak 1256 weight 0.10000E+01 volume 0.98900E+00 ppm1 8.165 ppm2 8.464 ASSI { 1266} (segid " " and resid "30 " and name "HN ") (segid " " and resid "15 " and name "HG22") 6.000 6.000 0.000 peak 1266 weight 0.10000E+01 volume 0.80000E-01 ppm1 8.161 ppm2 0.913 OR { 1266} (segid " " and resid "30 " and name "HN ") (segid " " and resid "15 " and name "HG21") OR { 1266} (segid " " and resid "30 " and name "HN ") (segid " " and resid "15 " and name "HG23") OR { 1266} (segid " " and resid "30 " and name "HN ") (segid " " and resid "13 " and name "HG13") OR { 1266} (segid " " and resid "30 " and name "HN ") (segid " " and resid "13 " and name "HG23") OR { 1266} (segid " " and resid "30 " and name "HN ") (segid " " and resid "13 " and name "HG11") OR { 1266} (segid " " and resid "30 " and name "HN ") (segid " " and resid "13 " and name "HG12") OR { 1266} (segid " " and resid "30 " and name "HN ") (segid " " and resid "13 " and name "HG22") ASSI { 1787} (segid " " and resid "74 " and name "HN ") (segid " " and resid "74 " and name "HB1 ") 5.000 5.000 0.000 peak 1787 weight 0.10000E+01 volume 0.92200E+00 ppm1 8.441 ppm2 1.830 OR { 1787} (segid " " and resid "74 " and name "HN ") (segid " " and resid "74 " and name "HB2 ") ASSI { 1785} (segid " " and resid "74 " and name "HN ") (segid " " and resid "73 " and name "HA ") 3.300 3.300 0.000 peak 1785 weight 0.10000E+01 volume 0.24310E+01 ppm1 8.441 ppm2 4.389 ASSI { 1788} (segid " " and resid "74 " and name "HN ") (segid " " and resid "73 " and name "HG ") 5.000 5.000 0.000 peak 1788 weight 0.10000E+01 volume 0.64500E+00 ppm1 8.442 ppm2 1.571 OR { 1788} (segid " " and resid "74 " and name "HN ") (segid " " and resid "73 " and name "HB2 ") ASSI { 1789} (segid " " and resid "74 " and name "HN ") (segid " " and resid "73 " and name "HD13") 6.000 6.000 0.000 peak 1789 weight 0.10000E+01 volume 0.14000E+00 ppm1 8.442 ppm2 0.894 OR { 1789} (segid " " and resid "74 " and name "HN ") (segid " " and resid "73 " and name "HD22") OR { 1789} (segid " " and resid "74 " and name "HN ") (segid " " and resid "73 " and name "HD23") ASSI { 1477} (segid " " and resid "48 " and name "HN ") (segid " " and resid "46 " and name "HA ") 6.000 6.000 0.000 peak 1477 weight 0.10000E+01 volume 0.26000E-01 ppm1 8.115 ppm2 3.703 ASSI { 1469} (segid " " and resid "48 " and name "HN ") (segid " " and resid "48 " and name "HA ") 5.000 5.000 0.000 peak 1469 weight 0.10000E+01 volume 0.11660E+01 ppm1 8.115 ppm2 4.658 ASSI { 1471} (segid " " and resid "48 " and name "HN ") (segid " " and resid "44 " and name "HG21") 5.000 5.000 0.000 peak 1471 weight 0.10000E+01 volume 0.86300E+00 ppm1 8.117 ppm2 0.677 OR { 1471} (segid " " and resid "48 " and name "HN ") (segid " " and resid "44 " and name "HG23") OR { 1471} (segid " " and resid "48 " and name "HN ") (segid " " and resid "44 " and name "HG22") ASSI { 1474} (segid " " and resid "48 " and name "HN ") (segid " " and resid "47 " and name "HA1 ") 5.000 5.000 0.000 peak 1474 weight 0.10000E+01 volume 0.33100E+00 ppm1 8.116 ppm2 4.118 ASSI { 1479} (segid " " and resid "48 " and name "HN ") (segid " " and resid "45 " and name "HA ") 6.000 6.000 0.000 peak 1479 weight 0.10000E+01 volume 0.42000E-01 ppm1 8.114 ppm2 5.202 ASSI { 1480} (segid " " and resid "48 " and name "HN ") (segid " " and resid "45 " and name "HB2 ") 6.000 6.000 0.000 peak 1480 weight 0.10000E+01 volume 0.16100E+00 ppm1 8.116 ppm2 2.831 ASSI { 1473} (segid " " and resid "48 " and name "HN ") (segid " " and resid "47 " and name "HA2 ") 5.000 5.000 0.000 peak 1473 weight 0.10000E+01 volume 0.38200E+00 ppm1 8.116 ppm2 3.451 ASSI { 1472} (segid " " and resid "48 " and name "HN ") (segid " " and resid "45 " and name "HN ") 5.000 5.000 0.000 peak 1472 weight 0.10000E+01 volume 0.67100E+00 ppm1 8.117 ppm2 9.198 ASSI { 1470} (segid " " and resid "48 " and name "HN ") (segid " " and resid "48 " and name "HG1 ") 5.000 5.000 0.000 peak 1470 weight 0.10000E+01 volume 0.98000E+00 ppm1 8.117 ppm2 1.588 OR { 1470} (segid " " and resid "48 " and name "HN ") (segid " " and resid "48 " and name "HG2 ") ASSI { 1475} (segid " " and resid "48 " and name "HN ") (segid " " and resid "44 " and name "HA ") 6.000 6.000 0.000 peak 1475 weight 0.10000E+01 volume 0.23500E+00 ppm1 8.117 ppm2 4.904 OR { 1475} (segid " " and resid "48 " and name "HN ") (segid " " and resid "49 " and name "HA ") ASSI { 1468} (segid " " and resid "25 " and name "HN ") (segid " " and resid "24 " and name "HB2 ") 3.300 3.300 0.000 peak 1468 weight 0.10000E+01 volume 0.28590E+01 ppm1 8.116 ppm2 2.037 OR { 1468} (segid " " and resid "25 " and name "HN ") (segid " " and resid "24 " and name "HB1 ") OR { 1468} (segid " " and resid "30 " and name "HN ") (segid " " and resid "30 " and name "HB ") OR { 1468} (segid " " and resid "48 " and name "HN ") (segid " " and resid "48 " and name "HB1 ") ASSI { 1476} (segid " " and resid "48 " and name "HN ") (segid " " and resid "49 " and name "HN ") 5.000 5.000 0.000 peak 1476 weight 0.10000E+01 volume 0.39200E+00 ppm1 8.115 ppm2 8.623 ASSI { 1182} (segid " " and resid "25 " and name "HN ") (segid " " and resid "25 " and name "HB2 ") 5.000 5.000 0.000 peak 1182 weight 0.10000E+01 volume 0.13280E+01 ppm1 8.141 ppm2 2.941 ASSI { 1185} (segid " " and resid "25 " and name "HN ") (segid " " and resid "22 " and name "HB ") 5.000 5.000 0.000 peak 1185 weight 0.10000E+01 volume 0.57800E+00 ppm1 8.141 ppm2 4.797 OR { 1185} (segid " " and resid "25 " and name "HN ") (segid " " and resid "22 " and name "HA ") ASSI { 1192} (segid " " and resid "25 " and name "HN ") (segid " " and resid "27 " and name "HN ") 6.000 6.000 0.000 peak 1192 weight 0.10000E+01 volume 0.86000E-01 ppm1 8.139 ppm2 8.899 ASSI { 1180} (segid " " and resid "25 " and name "HN ") (segid " " and resid "25 " and name "HB1 ") 5.000 5.000 0.000 peak 1180 weight 0.10000E+01 volume 0.19170E+01 ppm1 8.140 ppm2 3.086 ASSI { 1187} (segid " " and resid "25 " and name "HN ") (segid " " and resid "24 " and name "HA ") 6.000 6.000 0.000 peak 1187 weight 0.10000E+01 volume 0.23400E+00 ppm1 8.141 ppm2 3.946 ASSI { 1181} (segid " " and resid "25 " and name "HN ") (segid " " and resid "26 " and name "HN ") 5.000 5.000 0.000 peak 1181 weight 0.10000E+01 volume 0.14200E+01 ppm1 8.141 ppm2 8.531 ASSI { 1188} (segid " " and resid "25 " and name "HN ") (segid " " and resid "22 " and name "HG23") 6.000 6.000 0.000 peak 1188 weight 0.10000E+01 volume 0.14200E+00 ppm1 8.141 ppm2 1.339 OR { 1188} (segid " " and resid "25 " and name "HN ") (segid " " and resid "22 " and name "HG22") OR { 1188} (segid " " and resid "25 " and name "HN ") (segid " " and resid "22 " and name "HG21") ASSI { 1186} (segid " " and resid "25 " and name "HN ") (segid " " and resid "24 " and name "HG1 ") 5.000 5.000 0.000 peak 1186 weight 0.10000E+01 volume 0.47400E+00 ppm1 8.140 ppm2 2.542 ASSI { 1189} (segid " " and resid "25 " and name "HN ") (segid " " and resid "23 " and name "HA ") 6.000 6.000 0.000 peak 1189 weight 0.10000E+01 volume 0.21500E+00 ppm1 8.142 ppm2 3.567 OR { 1189} (segid " " and resid "25 " and name "HN ") (segid " " and resid "26 " and name "HB1 ") ASSI { 1183} (segid " " and resid "25 " and name "HN ") (segid " " and resid "25 " and name "HA ") 5.000 5.000 0.000 peak 1183 weight 0.10000E+01 volume 0.10090E+01 ppm1 8.141 ppm2 4.544 ASSI { 1197} (segid " " and resid "25 " and name "HD21") (segid " " and resid "21 " and name "HB1 ") 6.000 6.000 0.000 peak 1197 weight 0.10000E+01 volume 0.31000E-01 ppm1 7.838 ppm2 2.589 ASSI { 1205} (segid " " and resid "25 " and name "HD22") (segid " " and resid "25 " and name "HB2 ") 6.000 6.000 0.000 peak 1205 weight 0.10000E+01 volume 0.10200E+00 ppm1 6.884 ppm2 2.968 ASSI { 1193} (segid " " and resid "25 " and name "HD21") (segid " " and resid "25 " and name "HA ") 6.000 6.000 0.000 peak 1193 weight 0.10000E+01 volume 0.26700E+00 ppm1 7.840 ppm2 4.549 OR { 1193} (segid " " and resid "25 " and name "HD21") (segid " " and resid "26 " and name "HA ") ASSI { 1191} (segid " " and resid "25 " and name "HD21") (segid " " and resid "25 " and name "HB1 ") 5.000 5.000 0.000 peak 1191 weight 0.10000E+01 volume 0.32000E+00 ppm1 7.840 ppm2 3.093 ASSI { 1201} (segid " " and resid "25 " and name "HD22") (segid " " and resid "29 " and name "HE2 ") 6.000 6.000 0.000 peak 1201 weight 0.10000E+01 volume 0.20000E+00 ppm1 6.884 ppm2 3.108 OR { 1201} (segid " " and resid "25 " and name "HD22") (segid " " and resid "25 " and name "HB1 ") ASSI { 1194} (segid " " and resid "25 " and name "HD21") (segid " " and resid "22 " and name "HN ") 6.000 6.000 0.000 peak 1194 weight 0.10000E+01 volume 0.22200E+00 ppm1 7.839 ppm2 8.141 OR { 1194} (segid " " and resid "25 " and name "HD21") (segid " " and resid "25 " and name "HN ") ASSI { 1196} (segid " " and resid "25 " and name "HD21") (segid " " and resid "22 " and name "HA ") 6.000 6.000 0.000 peak 1196 weight 0.10000E+01 volume 0.13600E+00 ppm1 7.841 ppm2 4.734 ASSI { 1190} (segid " " and resid "25 " and name "HD21") (segid " " and resid "25 " and name "HD22") 2.700 2.700 0.000 peak 1190 weight 0.10000E+01 volume 0.13397E+02 ppm1 7.840 ppm2 6.881 ASSI { 1207} (segid " " and resid "25 " and name "HD22") (segid " " and resid "29 " and name "HG2 ") 6.000 6.000 0.000 peak 1207 weight 0.10000E+01 volume 0.37000E-01 ppm1 6.888 ppm2 1.608 OR { 1207} (segid " " and resid "25 " and name "HD22") (segid " " and resid "28 " and name "HB1 ") OR { 1207} (segid " " and resid "25 " and name "HD22") (segid " " and resid "28 " and name "HB2 ") ASSI { 1198} (segid " " and resid "25 " and name "HD21") (segid " " and resid "28 " and name "HB3 ") 6.000 6.000 0.000 peak 1198 weight 0.10000E+01 volume 0.35000E-01 ppm1 7.841 ppm2 1.628 OR { 1198} (segid " " and resid "25 " and name "HD21") (segid " " and resid "18 " and name "HB2 ") OR { 1198} (segid " " and resid "25 " and name "HD21") (segid " " and resid "28 " and name "HB1 ") OR { 1198} (segid " " and resid "25 " and name "HD21") (segid " " and resid "56 " and name "HG ") OR { 1198} (segid " " and resid "25 " and name "HD21") (segid " " and resid "28 " and name "HB2 ") ASSI { 1195} (segid " " and resid "25 " and name "HD21") (segid " " and resid "25 " and name "HB2 ") 6.000 6.000 0.000 peak 1195 weight 0.10000E+01 volume 0.16800E+00 ppm1 7.840 ppm2 2.949 ASSI { 1204} (segid " " and resid "25 " and name "HD22") (segid " " and resid "22 " and name "HN ") 6.000 6.000 0.000 peak 1204 weight 0.10000E+01 volume 0.13400E+00 ppm1 6.884 ppm2 8.146 OR { 1204} (segid " " and resid "25 " and name "HD22") (segid " " and resid "25 " and name "HN ") ASSI { 1202} (segid " " and resid "25 " and name "HD22") (segid " " and resid "25 " and name "HA ") 6.000 6.000 0.000 peak 1202 weight 0.10000E+01 volume 0.11800E+00 ppm1 6.884 ppm2 4.552 OR { 1202} (segid " " and resid "25 " and name "HD22") (segid " " and resid "26 " and name "HA ") ASSI { 1199} (segid " " and resid "25 " and name "HD21") (segid " " and resid "22 " and name "HG23") 6.000 6.000 0.000 peak 1199 weight 0.10000E+01 volume 0.27000E-01 ppm1 7.840 ppm2 1.335 OR { 1199} (segid " " and resid "25 " and name "HD21") (segid " " and resid "22 " and name "HG21") OR { 1199} (segid " " and resid "25 " and name "HD21") (segid " " and resid "22 " and name "HG22") ASSI { 1436} (segid " " and resid "44 " and name "HN ") (segid " " and resid "44 " and name "HB ") 5.000 5.000 0.000 peak 1436 weight 0.10000E+01 volume 0.16250E+01 ppm1 9.113 ppm2 1.775 ASSI { 1438} (segid " " and resid "44 " and name "HN ") (segid " " and resid "44 " and name "HD12") 5.000 5.000 0.000 peak 1438 weight 0.10000E+01 volume 0.90200E+00 ppm1 9.113 ppm2 0.708 OR { 1438} (segid " " and resid "44 " and name "HN ") (segid " " and resid "44 " and name "HD11") OR { 1438} (segid " " and resid "44 " and name "HN ") (segid " " and resid "44 " and name "HD13") ASSI { 1442} (segid " " and resid "44 " and name "HN ") (segid " " and resid "44 " and name "HG11") 5.000 5.000 0.000 peak 1442 weight 0.10000E+01 volume 0.46800E+00 ppm1 9.114 ppm2 1.383 ASSI { 1441} (segid " " and resid "44 " and name "HN ") (segid " " and resid "44 " and name "HA ") 5.000 5.000 0.000 peak 1441 weight 0.10000E+01 volume 0.59600E+00 ppm1 9.115 ppm2 4.913 ASSI { 1437} (segid " " and resid "44 " and name "HN ") (segid " " and resid "67 " and name "HG23") 5.000 5.000 0.000 peak 1437 weight 0.10000E+01 volume 0.14610E+01 ppm1 9.114 ppm2 1.022 OR { 1437} (segid " " and resid "44 " and name "HN ") (segid " " and resid "67 " and name "HG22") OR { 1437} (segid " " and resid "44 " and name "HN ") (segid " " and resid "67 " and name "HG21") ASSI { 1434} (segid " " and resid "44 " and name "HN ") (segid " " and resid "43 " and name "HA ") 2.700 2.700 0.000 peak 1434 weight 0.10000E+01 volume 0.40190E+01 ppm1 9.114 ppm2 5.343 ASSI { 1439} (segid " " and resid "44 " and name "HN ") (segid " " and resid "68 " and name "HN ") 5.000 5.000 0.000 peak 1439 weight 0.10000E+01 volume 0.62800E+00 ppm1 9.114 ppm2 9.360 ASSI { 1440} (segid " " and resid "44 " and name "HN ") (segid " " and resid "68 " and name "HB2 ") 5.000 5.000 0.000 peak 1440 weight 0.10000E+01 volume 0.55700E+00 ppm1 9.114 ppm2 3.097 OR { 1440} (segid " " and resid "44 " and name "HN ") (segid " " and resid "68 " and name "HB1 ") ASSI { 1794} (segid " " and resid "75 " and name "HN ") (segid " " and resid "74 " and name "HB1 ") 6.000 6.000 0.000 peak 1794 weight 0.10000E+01 volume 0.77000E-01 ppm1 8.480 ppm2 1.820 OR { 1794} (segid " " and resid "75 " and name "HN ") (segid " " and resid "74 " and name "HB2 ") ASSI { 1793} (segid " " and resid "75 " and name "HN ") (segid " " and resid "74 " and name "HA ") 5.000 5.000 0.000 peak 1793 weight 0.10000E+01 volume 0.69500E+00 ppm1 8.481 ppm2 4.289 ASSI { 1792} (segid " " and resid "75 " and name "HN ") (segid " " and resid "75 " and name "HA2 ") 5.000 5.000 0.000 peak 1792 weight 0.10000E+01 volume 0.70600E+00 ppm1 8.481 ppm2 3.965 OR { 1792} (segid " " and resid "75 " and name "HN ") (segid " " and resid "75 " and name "HA1 ") ASSI { 1795} (segid " " and resid "75 " and name "HN ") (segid " " and resid "73 " and name "HB2 ") 6.000 6.000 0.000 peak 1795 weight 0.10000E+01 volume 0.56000E-01 ppm1 8.481 ppm2 1.597 OR { 1795} (segid " " and resid "75 " and name "HN ") (segid " " and resid "73 " and name "HB1 ") ASSI { 1166} (segid " " and resid "23 " and name "HN ") (segid " " and resid "56 " and name "HD23") 6.000 6.000 0.000 peak 1166 weight 0.10000E+01 volume 0.68000E-01 ppm1 8.794 ppm2 0.307 OR { 1166} (segid " " and resid "23 " and name "HN ") (segid " " and resid "56 " and name "HD21") OR { 1166} (segid " " and resid "23 " and name "HN ") (segid " " and resid "56 " and name "HD22") ASSI { 1159} (segid " " and resid "23 " and name "HN ") (segid " " and resid "23 " and name "HA ") 5.000 5.000 0.000 peak 1159 weight 0.10000E+01 volume 0.87200E+00 ppm1 8.796 ppm2 3.569 ASSI { 1162} (segid " " and resid "23 " and name "HN ") (segid " " and resid "23 " and name "HG13") 5.000 5.000 0.000 peak 1162 weight 0.10000E+01 volume 0.35800E+00 ppm1 8.795 ppm2 0.824 OR { 1162} (segid " " and resid "23 " and name "HN ") (segid " " and resid "23 " and name "HG11") OR { 1162} (segid " " and resid "23 " and name "HN ") (segid " " and resid "23 " and name "HG12") ASSI { 1156} (segid " " and resid "23 " and name "HN ") (segid " " and resid "23 " and name "HB ") 3.300 3.300 0.000 peak 1156 weight 0.10000E+01 volume 0.23210E+01 ppm1 8.796 ppm2 2.263 ASSI { 1157} (segid " " and resid "23 " and name "HN ") (segid " " and resid "22 " and name "HA ") 3.300 3.300 0.000 peak 1157 weight 0.10000E+01 volume 0.25190E+01 ppm1 8.796 ppm2 4.793 OR { 1157} (segid " " and resid "23 " and name "HN ") (segid " " and resid "22 " and name "HB ") ASSI { 1158} (segid " " and resid "23 " and name "HN ") (segid " " and resid "55 " and name "HA ") 5.000 5.000 0.000 peak 1158 weight 0.10000E+01 volume 0.84600E+00 ppm1 8.797 ppm2 5.234 ASSI { 1155} (segid " " and resid "23 " and name "HN ") (segid " " and resid "23 " and name "HG21") 3.300 3.300 0.000 peak 1155 weight 0.10000E+01 volume 0.23400E+01 ppm1 8.796 ppm2 1.059 OR { 1155} (segid " " and resid "23 " and name "HN ") (segid " " and resid "23 " and name "HG22") OR { 1155} (segid " " and resid "23 " and name "HN ") (segid " " and resid "23 " and name "HG23") ASSI { 1161} (segid " " and resid "23 " and name "HN ") (segid " " and resid "22 " and name "HG23") 5.000 5.000 0.000 peak 1161 weight 0.10000E+01 volume 0.41400E+00 ppm1 8.796 ppm2 1.328 OR { 1161} (segid " " and resid "23 " and name "HN ") (segid " " and resid "22 " and name "HG22") OR { 1161} (segid " " and resid "23 " and name "HN ") (segid " " and resid "22 " and name "HG21") ASSI { 1163} (segid " " and resid "23 " and name "HN ") (segid " " and resid "52 " and name "HA ") 6.000 6.000 0.000 peak 1163 weight 0.10000E+01 volume 0.19000E+00 ppm1 8.796 ppm2 4.394 ASSI { 1165} (segid " " and resid "23 " and name "HN ") (segid " " and resid "54 " and name "HN ") 6.000 6.000 0.000 peak 1165 weight 0.10000E+01 volume 0.80000E-01 ppm1 8.796 ppm2 7.497 ASSI { 1164} (segid " " and resid "23 " and name "HN ") (segid " " and resid "25 " and name "HN ") 6.000 6.000 0.000 peak 1164 weight 0.10000E+01 volume 0.14500E+00 ppm1 8.797 ppm2 8.161 OR { 1164} (segid " " and resid "23 " and name "HN ") (segid " " and resid "22 " and name "HN ") ASSI { 1483} (segid " " and resid "49 " and name "HN ") (segid " " and resid "48 " and name "HG1 ") 5.000 5.000 0.000 peak 1483 weight 0.10000E+01 volume 0.30000E+00 ppm1 8.617 ppm2 1.583 OR { 1483} (segid " " and resid "49 " and name "HN ") (segid " " and resid "48 " and name "HG2 ") ASSI { 1482} (segid " " and resid "49 " and name "HN ") (segid " " and resid "49 " and name "HA ") 5.000 5.000 0.000 peak 1482 weight 0.10000E+01 volume 0.96500E+00 ppm1 8.617 ppm2 4.901 ASSI { 1481} (segid " " and resid "49 " and name "HN ") (segid " " and resid "49 " and name "HB2 ") 2.700 2.700 0.000 peak 1481 weight 0.10000E+01 volume 0.43030E+01 ppm1 8.617 ppm2 1.971 OR { 1481} (segid " " and resid "49 " and name "HN ") (segid " " and resid "49 " and name "HB1 ") ASSI { 1484} (segid " " and resid "49 " and name "HN ") (segid " " and resid "49 " and name "HG1 ") 5.000 5.000 0.000 peak 1484 weight 0.10000E+01 volume 0.39300E+00 ppm1 8.616 ppm2 2.257 OR { 1484} (segid " " and resid "49 " and name "HN ") (segid " " and resid "49 " and name "HG2 ") ASSI { 1478} (segid " " and resid "49 " and name "HN ") (segid " " and resid "48 " and name "HA ") 2.700 2.700 0.000 peak 1478 weight 0.10000E+01 volume 0.47200E+01 ppm1 8.617 ppm2 4.654 ASSI { 1485} (segid " " and resid "49 " and name "HN ") (segid " " and resid "44 " and name "HG21") 6.000 6.000 0.000 peak 1485 weight 0.10000E+01 volume 0.19200E+00 ppm1 8.616 ppm2 0.660 OR { 1485} (segid " " and resid "49 " and name "HN ") (segid " " and resid "44 " and name "HG22") OR { 1485} (segid " " and resid "49 " and name "HN ") (segid " " and resid "44 " and name "HG23") OR { 1485} (segid " " and resid "49 " and name "HN ") (segid " " and resid "44 " and name "HD13") OR { 1485} (segid " " and resid "49 " and name "HN ") (segid " " and resid "44 " and name "HD12") ASSI { 1540} (segid " " and resid "53 " and name "HN ") (segid " " and resid "23 " and name "HG11") 6.000 6.000 0.000 peak 1540 weight 0.10000E+01 volume 0.70000E-01 ppm1 10.142 ppm2 0.821 OR { 1540} (segid " " and resid "53 " and name "HN ") (segid " " and resid "23 " and name "HG13") OR { 1540} (segid " " and resid "53 " and name "HN ") (segid " " and resid "23 " and name "HG12") ASSI { 1375} (segid " " and resid "40 " and name "HE21") (segid " " and resid "37 " and name "HG2 ") 6.000 6.000 0.000 peak 1375 weight 0.10000E+01 volume 0.25500E+00 ppm1 7.671 ppm2 2.040 ASSI { 1536} (segid " " and resid "53 " and name "HN ") (segid " " and resid "23 " and name "HB ") 5.000 5.000 0.000 peak 1536 weight 0.10000E+01 volume 0.33500E+00 ppm1 10.142 ppm2 2.263 ASSI { 1538} (segid " " and resid "53 " and name "HN ") (segid " " and resid "54 " and name "HA ") 6.000 6.000 0.000 peak 1538 weight 0.10000E+01 volume 0.16800E+00 ppm1 10.144 ppm2 4.793 OR { 1538} (segid " " and resid "53 " and name "HN ") (segid " " and resid "22 " and name "HB ") ASSI { 1537} (segid " " and resid "53 " and name "HN ") (segid " " and resid "52 " and name "HB2 ") 5.000 5.000 0.000 peak 1537 weight 0.10000E+01 volume 0.30000E+00 ppm1 10.142 ppm2 2.487 OR { 1537} (segid " " and resid "53 " and name "HN ") (segid " " and resid "24 " and name "HG1 ") ASSI { 1535} (segid " " and resid "53 " and name "HN ") (segid " " and resid "52 " and name "HB1 ") 5.000 5.000 0.000 peak 1535 weight 0.10000E+01 volume 0.48800E+00 ppm1 10.143 ppm2 2.668 ASSI { 1533} (segid " " and resid "53 " and name "HN ") (segid " " and resid "53 " and name "HA2 ") 5.000 5.000 0.000 peak 1533 weight 0.10000E+01 volume 0.14920E+01 ppm1 10.143 ppm2 3.942 ASSI { 1532} (segid " " and resid "53 " and name "HN ") (segid " " and resid "52 " and name "HA ") 3.300 3.300 0.000 peak 1532 weight 0.10000E+01 volume 0.26010E+01 ppm1 10.143 ppm2 4.360 ASSI { 1381} (segid " " and resid "40 " and name "HE22") (segid " " and resid "40 " and name "HG2 ") 5.000 5.000 0.000 peak 1381 weight 0.10000E+01 volume 0.42600E+00 ppm1 6.760 ppm2 2.376 OR { 1381} (segid " " and resid "40 " and name "HE22") (segid " " and resid "40 " and name "HG1 ") OR { 1381} (segid " " and resid "40 " and name "HE22") (segid " " and resid "37 " and name "HB1 ") ASSI { 1640} (segid " " and resid "60 " and name "HD22") (segid " " and resid "60 " and name "HB2 ") 6.000 6.000 0.000 peak 1640 weight 0.10000E+01 volume 0.76000E-01 ppm1 6.824 ppm2 2.850 ASSI { 1373} (segid " " and resid "40 " and name "HE21") (segid " " and resid "40 " and name "HE22") 2.700 2.700 0.000 peak 1373 weight 0.10000E+01 volume 0.14911E+02 ppm1 7.671 ppm2 6.761 ASSI { 1376} (segid " " and resid "40 " and name "HE21") (segid " " and resid "71 " and name "HD22") 6.000 6.000 0.000 peak 1376 weight 0.10000E+01 volume 0.68000E-01 ppm1 7.676 ppm2 0.908 OR { 1376} (segid " " and resid "40 " and name "HE21") (segid " " and resid "71 " and name "HD23") OR { 1376} (segid " " and resid "40 " and name "HE21") (segid " " and resid "36 " and name "HG22") OR { 1376} (segid " " and resid "40 " and name "HE21") (segid " " and resid "71 " and name "HD21") ASSI { 1374} (segid " " and resid "40 " and name "HE21") (segid " " and resid "40 " and name "HG1 ") 5.000 5.000 0.000 peak 1374 weight 0.10000E+01 volume 0.77500E+00 ppm1 7.670 ppm2 2.372 OR { 1374} (segid " " and resid "40 " and name "HE21") (segid " " and resid "40 " and name "HG2 ") ASSI { 1767} (segid " " and resid "71 " and name "HN ") (segid " " and resid "70 " and name "HN ") 6.000 6.000 0.000 peak 1767 weight 0.10000E+01 volume 0.94000E-01 ppm1 8.106 ppm2 9.130 ASSI { 1766} (segid " " and resid "71 " and name "HN ") (segid " " and resid "72 " and name "HN ") 6.000 6.000 0.000 peak 1766 weight 0.10000E+01 volume 0.15500E+00 ppm1 8.106 ppm2 8.510 ASSI { 1383} (segid " " and resid "40 " and name "HE22") (segid " " and resid "37 " and name "HG2 ") 6.000 6.000 0.000 peak 1383 weight 0.10000E+01 volume 0.19000E+00 ppm1 6.760 ppm2 2.046 ASSI { 1764} (segid " " and resid "71 " and name "HN ") (segid " " and resid "70 " and name "HG12") 5.000 5.000 0.000 peak 1764 weight 0.10000E+01 volume 0.14850E+01 ppm1 8.106 ppm2 0.946 OR { 1764} (segid " " and resid "71 " and name "HN ") (segid " " and resid "70 " and name "HG11") OR { 1764} (segid " " and resid "71 " and name "HN ") (segid " " and resid "70 " and name "HG13") OR { 1764} (segid " " and resid "71 " and name "HN ") (segid " " and resid "8 " and name "HD21") OR { 1764} (segid " " and resid "71 " and name "HN ") (segid " " and resid "8 " and name "HD23") OR { 1764} (segid " " and resid "71 " and name "HN ") (segid " " and resid "8 " and name "HD22") ASSI { 1378} (segid " " and resid "40 " and name "HE21") (segid " " and resid "40 " and name "HB2 ") 6.000 6.000 0.000 peak 1378 weight 0.10000E+01 volume 0.58000E-01 ppm1 7.676 ppm2 1.791 ASSI { 1763} (segid " " and resid "71 " and name "HN ") (segid " " and resid "70 " and name "HB ") 5.000 5.000 0.000 peak 1763 weight 0.10000E+01 volume 0.11320E+01 ppm1 8.105 ppm2 2.080 ASSI { 1635} (segid " " and resid "60 " and name "HD21") (segid " " and resid "60 " and name "HB2 ") 6.000 6.000 0.000 peak 1635 weight 0.10000E+01 volume 0.17000E+00 ppm1 7.532 ppm2 2.862 ASSI { 1639} (segid " " and resid "60 " and name "HD22") (segid " " and resid "60 " and name "HB1 ") 6.000 6.000 0.000 peak 1639 weight 0.10000E+01 volume 0.14000E+00 ppm1 6.826 ppm2 3.303 ASSI { 1762} (segid " " and resid "71 " and name "HN ") (segid " " and resid "71 " and name "HB2 ") 3.300 3.300 0.000 peak 1762 weight 0.10000E+01 volume 0.34330E+01 ppm1 8.106 ppm2 1.612 OR { 1762} (segid " " and resid "71 " and name "HN ") (segid " " and resid "71 " and name "HB1 ") ASSI { 1633} (segid " " and resid "60 " and name "HD21") (segid " " and resid "60 " and name "HD22") 2.700 2.700 0.000 peak 1633 weight 0.10000E+01 volume 0.14798E+02 ppm1 7.532 ppm2 6.824 ASSI { 1760} (segid " " and resid "71 " and name "HN ") (segid " " and resid "70 " and name "HA ") 3.300 3.300 0.000 peak 1760 weight 0.10000E+01 volume 0.35800E+01 ppm1 8.106 ppm2 4.386 ASSI { 1634} (segid " " and resid "60 " and name "HD21") (segid " " and resid "60 " and name "HB1 ") 6.000 6.000 0.000 peak 1634 weight 0.10000E+01 volume 0.29000E+00 ppm1 7.532 ppm2 3.305 ASSI { 1384} (segid " " and resid "40 " and name "HE22") (segid " " and resid "71 " and name "HD22") 6.000 6.000 0.000 peak 1384 weight 0.10000E+01 volume 0.51000E-01 ppm1 6.760 ppm2 0.900 OR { 1384} (segid " " and resid "40 " and name "HE22") (segid " " and resid "71 " and name "HD21") OR { 1384} (segid " " and resid "40 " and name "HE22") (segid " " and resid "71 " and name "HD23") OR { 1384} (segid " " and resid "40 " and name "HE22") (segid " " and resid "36 " and name "HG22") ASSI { 1379} (segid " " and resid "40 " and name "HE21") (segid " " and resid "37 " and name "HD2 ") 6.000 6.000 0.000 peak 1379 weight 0.10000E+01 volume 0.14000E-01 ppm1 7.676 ppm2 3.543 ASSI { 1542} (segid " " and resid "53 " and name "HN ") (segid " " and resid "23 " and name "HG21") 6.000 6.000 0.000 peak 1542 weight 0.10000E+01 volume 0.41000E-01 ppm1 10.141 ppm2 1.070 OR { 1542} (segid " " and resid "53 " and name "HN ") (segid " " and resid "23 " and name "HG22") OR { 1542} (segid " " and resid "53 " and name "HN ") (segid " " and resid "23 " and name "HG23") ASSI { 1377} (segid " " and resid "40 " and name "HE21") (segid " " and resid "40 " and name "HA ") 6.000 6.000 0.000 peak 1377 weight 0.10000E+01 volume 0.58000E-01 ppm1 7.676 ppm2 4.464 OR { 1377} (segid " " and resid "40 " and name "HE21") (segid " " and resid "36 " and name "HA ") ASSI { 1217} (segid " " and resid "26 " and name "HN ") (segid " " and resid "26 " and name "HD1 ") 6.000 6.000 0.000 peak 1217 weight 0.10000E+01 volume 0.11100E+00 ppm1 8.535 ppm2 7.068 OR { 1217} (segid " " and resid "26 " and name "HN ") (segid " " and resid "26 " and name "HD2 ") ASSI { 1219} (segid " " and resid "26 " and name "HN ") (segid " " and resid "23 " and name "HG12") 6.000 6.000 0.000 peak 1219 weight 0.10000E+01 volume 0.82000E-01 ppm1 8.535 ppm2 0.811 OR { 1219} (segid " " and resid "26 " and name "HN ") (segid " " and resid "23 " and name "HG11") OR { 1219} (segid " " and resid "26 " and name "HN ") (segid " " and resid "23 " and name "HG13") OR { 1219} (segid " " and resid "26 " and name "HN ") (segid " " and resid "43 " and name "HD13") OR { 1219} (segid " " and resid "26 " and name "HN ") (segid " " and resid "43 " and name "HD12") ASSI { 1215} (segid " " and resid "26 " and name "HN ") (segid " " and resid "21 " and name "HB1 ") 6.000 6.000 0.000 peak 1215 weight 0.10000E+01 volume 0.13900E+00 ppm1 8.535 ppm2 2.580 ASSI { 1210} (segid " " and resid "26 " and name "HN ") (segid " " and resid "26 " and name "HA ") 5.000 5.000 0.000 peak 1210 weight 0.10000E+01 volume 0.13010E+01 ppm1 8.535 ppm2 4.552 OR { 1210} (segid " " and resid "26 " and name "HN ") (segid " " and resid "25 " and name "HA ") ASSI { 1216} (segid " " and resid "26 " and name "HN ") (segid " " and resid "28 " and name "HN ") 6.000 6.000 0.000 peak 1216 weight 0.10000E+01 volume 0.14000E+00 ppm1 8.535 ppm2 7.880 OR { 1216} (segid " " and resid "26 " and name "HN ") (segid " " and resid "25 " and name "HD21") ASSI { 1208} (segid " " and resid "26 " and name "HN ") (segid " " and resid "26 " and name "HB2 ") 3.300 3.300 0.000 peak 1208 weight 0.10000E+01 volume 0.25520E+01 ppm1 8.535 ppm2 3.184 ASSI { 1206} (segid " " and resid "26 " and name "HN ") (segid " " and resid "26 " and name "HB1 ") 3.300 3.300 0.000 peak 1206 weight 0.10000E+01 volume 0.28840E+01 ppm1 8.535 ppm2 3.561 OR { 1206} (segid " " and resid "26 " and name "HN ") (segid " " and resid "23 " and name "HA ") ASSI { 1212} (segid " " and resid "26 " and name "HN ") (segid " " and resid "25 " and name "HB2 ") 5.000 5.000 0.000 peak 1212 weight 0.10000E+01 volume 0.83100E+00 ppm1 8.535 ppm2 2.942 ASSI { 1213} (segid " " and resid "26 " and name "HN ") (segid " " and resid "27 " and name "HG1 ") 6.000 6.000 0.000 peak 1213 weight 0.10000E+01 volume 0.22800E+00 ppm1 8.536 ppm2 1.622 OR { 1213} (segid " " and resid "26 " and name "HN ") (segid " " and resid "28 " and name "HB2 ") OR { 1213} (segid " " and resid "26 " and name "HN ") (segid " " and resid "28 " and name "HB3 ") OR { 1213} (segid " " and resid "26 " and name "HN ") (segid " " and resid "28 " and name "HB1 ") OR { 1213} (segid " " and resid "26 " and name "HN ") (segid " " and resid "27 " and name "HD2 ") OR { 1213} (segid " " and resid "26 " and name "HN ") (segid " " and resid "27 " and name "HD1 ") ASSI { 1214} (segid " " and resid "26 " and name "HN ") (segid " " and resid "56 " and name "HD22") 6.000 6.000 0.000 peak 1214 weight 0.10000E+01 volume 0.18200E+00 ppm1 8.535 ppm2 0.339 OR { 1214} (segid " " and resid "26 " and name "HN ") (segid " " and resid "56 " and name "HD23") OR { 1214} (segid " " and resid "26 " and name "HN ") (segid " " and resid "56 " and name "HD21") OR { 1214} (segid " " and resid "26 " and name "HN ") (segid " " and resid "30 " and name "HG12") ASSI { 1220} (segid " " and resid "26 " and name "HN ") (segid " " and resid "24 " and name "HA ") 6.000 6.000 0.000 peak 1220 weight 0.10000E+01 volume 0.51000E-01 ppm1 8.535 ppm2 3.961 ASSI { 1218} (segid " " and resid "26 " and name "HN ") (segid " " and resid "27 " and name "HB2 ") 6.000 6.000 0.000 peak 1218 weight 0.10000E+01 volume 0.10400E+00 ppm1 8.536 ppm2 2.042 OR { 1218} (segid " " and resid "26 " and name "HN ") (segid " " and resid "24 " and name "HB2 ") OR { 1218} (segid " " and resid "26 " and name "HN ") (segid " " and resid "24 " and name "HB1 ") ASSI { 923} (segid " " and resid "2 " and name "HE22") (segid " " and resid "2 " and name "HG1 ") 6.000 6.000 0.000 peak 923 weight 0.10000E+01 volume 0.83000E-01 ppm1 6.726 ppm2 2.300 ASSI { 918} (segid " " and resid "2 " and name "HE21") (segid " " and resid "14 " and name "HG22") 6.000 6.000 0.000 peak 918 weight 0.10000E+01 volume 0.13400E+00 ppm1 7.650 ppm2 1.109 OR { 918} (segid " " and resid "2 " and name "HE21") (segid " " and resid "14 " and name "HG21") OR { 918} (segid " " and resid "2 " and name "HE21") (segid " " and resid "14 " and name "HG23") ASSI { 919} (segid " " and resid "2 " and name "HE21") (segid " " and resid "2 " and name "HG1 ") 6.000 6.000 0.000 peak 919 weight 0.10000E+01 volume 0.25700E+00 ppm1 7.650 ppm2 2.293 ASSI { 915} (segid " " and resid "40 " and name "HE22") (segid " " and resid "40 " and name "HE21") 2.700 2.700 0.000 peak 915 weight 0.10000E+01 volume 0.13768E+02 ppm1 6.723 ppm2 7.649 OR { 915} (segid " " and resid "2 " and name "HE22") (segid " " and resid "2 " and name "HE21") ASSI { 922} (segid " " and resid "2 " and name "HE22") (segid " " and resid "14 " and name "HG23") 6.000 6.000 0.000 peak 922 weight 0.10000E+01 volume 0.13500E+00 ppm1 6.726 ppm2 1.109 OR { 922} (segid " " and resid "2 " and name "HE22") (segid " " and resid "14 " and name "HG21") ASSI { 920} (segid " " and resid "2 " and name "HE22") (segid " " and resid "16 " and name "HB1 ") 6.000 6.000 0.000 peak 920 weight 0.10000E+01 volume 0.17000E+00 ppm1 6.722 ppm2 1.965 OR { 920} (segid " " and resid "2 " and name "HE22") (segid " " and resid "2 " and name "HG2 ") OR { 920} (segid " " and resid "40 " and name "HE22") (segid " " and resid "37 " and name "HB2 ") ASSI { 917} (segid " " and resid "2 " and name "HE21") (segid " " and resid "2 " and name "HG2 ") 5.000 5.000 0.000 peak 917 weight 0.10000E+01 volume 0.35900E+00 ppm1 7.650 ppm2 1.971 OR { 917} (segid " " and resid "40 " and name "HE21") (segid " " and resid "37 " and name "HB2 ") ASSI { 1280} (segid " " and resid "31 " and name "HN ") (segid " " and resid "32 " and name "HB2 ") 6.000 6.000 0.000 peak 1280 weight 0.10000E+01 volume 0.58000E-01 ppm1 8.456 ppm2 2.780 OR { 1280} (segid " " and resid "31 " and name "HN ") (segid " " and resid "32 " and name "HB1 ") ASSI { 1281} (segid " " and resid "31 " and name "HN ") (segid " " and resid "30 " and name "HD12") 6.000 6.000 0.000 peak 1281 weight 0.10000E+01 volume 0.55000E-01 ppm1 8.457 ppm2 0.035 OR { 1281} (segid " " and resid "31 " and name "HN ") (segid " " and resid "30 " and name "HD11") OR { 1281} (segid " " and resid "31 " and name "HN ") (segid " " and resid "30 " and name "HD13") ASSI { 1271} (segid " " and resid "31 " and name "HN ") (segid " " and resid "31 " and name "HA ") 5.000 5.000 0.000 peak 1271 weight 0.10000E+01 volume 0.84900E+00 ppm1 8.457 ppm2 3.777 ASSI { 1244} (segid " " and resid "28 " and name "HN ") (segid " " and resid "24 " and name "HA ") 6.000 6.000 0.000 peak 1244 weight 0.10000E+01 volume 0.15300E+00 ppm1 7.880 ppm2 3.930 ASSI { 1276} (segid " " and resid "31 " and name "HN ") (segid " " and resid "30 " and name "HA ") 6.000 6.000 0.000 peak 1276 weight 0.10000E+01 volume 0.17400E+00 ppm1 8.457 ppm2 3.327 ASSI { 1238} (segid " " and resid "28 " and name "HN ") (segid " " and resid "25 " and name "HA ") 5.000 5.000 0.000 peak 1238 weight 0.10000E+01 volume 0.74400E+00 ppm1 7.880 ppm2 4.562 OR { 1238} (segid " " and resid "28 " and name "HN ") (segid " " and resid "26 " and name "HA ") ASSI { 1272} (segid " " and resid "31 " and name "HN ") (segid " " and resid "41 " and name "HE21") 5.000 5.000 0.000 peak 1272 weight 0.10000E+01 volume 0.68700E+00 ppm1 8.457 ppm2 6.572 ASSI { 1274} (segid " " and resid "31 " and name "HN ") (segid " " and resid "30 " and name "HG23") 6.000 6.000 0.000 peak 1274 weight 0.10000E+01 volume 0.29400E+00 ppm1 8.456 ppm2 0.527 OR { 1274} (segid " " and resid "31 " and name "HN ") (segid " " and resid "30 " and name "HG22") OR { 1274} (segid " " and resid "31 " and name "HN ") (segid " " and resid "30 " and name "HG21") ASSI { 1278} (segid " " and resid "31 " and name "HN ") (segid " " and resid "27 " and name "HA ") 6.000 6.000 0.000 peak 1278 weight 0.10000E+01 volume 0.12200E+00 ppm1 8.456 ppm2 4.344 OR { 1278} (segid " " and resid "31 " and name "HN ") (segid " " and resid "32 " and name "HA ") ASSI { 1273} (segid " " and resid "31 " and name "HN ") (segid " " and resid "28 " and name "HA ") 5.000 5.000 0.000 peak 1273 weight 0.10000E+01 volume 0.58200E+00 ppm1 8.457 ppm2 4.149 OR { 1273} (segid " " and resid "31 " and name "HN ") (segid " " and resid "29 " and name "HA ") ASSI { 1275} (segid " " and resid "31 " and name "HN ") (segid " " and resid "41 " and name "HE22") 6.000 6.000 0.000 peak 1275 weight 0.10000E+01 volume 0.27200E+00 ppm1 8.457 ppm2 6.414 ASSI { 1279} (segid " " and resid "31 " and name "HN ") (segid " " and resid "30 " and name "HG11") 6.000 6.000 0.000 peak 1279 weight 0.10000E+01 volume 0.14200E+00 ppm1 8.458 ppm2 1.322 ASSI { 1277} (segid " " and resid "31 " and name "HN ") (segid " " and resid "38 " and name "HG2 ") 6.000 6.000 0.000 peak 1277 weight 0.10000E+01 volume 0.21500E+00 ppm1 8.457 ppm2 1.591 OR { 1277} (segid " " and resid "31 " and name "HN ") (segid " " and resid "28 " and name "HB1 ") OR { 1277} (segid " " and resid "31 " and name "HN ") (segid " " and resid "33 " and name "HG1 ") OR { 1277} (segid " " and resid "31 " and name "HN ") (segid " " and resid "28 " and name "HB2 ") OR { 1277} (segid " " and resid "31 " and name "HN ") (segid " " and resid "41 " and name "HG2 ") OR { 1277} (segid " " and resid "31 " and name "HN ") (segid " " and resid "28 " and name "HB3 ") OR { 1277} (segid " " and resid "31 " and name "HN ") (segid " " and resid "33 " and name "HG2 ") OR { 1277} (segid " " and resid "31 " and name "HN ") (segid " " and resid "29 " and name "HG2 ") ASSI { 1268} (segid " " and resid "31 " and name "HN ") (segid " " and resid "31 " and name "HB1 ") 5.000 5.000 0.000 peak 1268 weight 0.10000E+01 volume 0.15370E+01 ppm1 8.457 ppm2 2.415 ASSI { 1237} (segid " " and resid "28 " and name "HN ") (segid " " and resid "27 " and name "HB2 ") 5.000 5.000 0.000 peak 1237 weight 0.10000E+01 volume 0.10280E+01 ppm1 7.881 ppm2 2.000 ASSI { 1242} (segid " " and resid "28 " and name "HN ") (segid " " and resid "29 " and name "HB2 ") 6.000 6.000 0.000 peak 1242 weight 0.10000E+01 volume 0.20500E+00 ppm1 7.880 ppm2 2.244 OR { 1242} (segid " " and resid "28 " and name "HN ") (segid " " and resid "38 " and name "HB1 ") OR { 1242} (segid " " and resid "21 " and name "HN ") (segid " " and resid "18 " and name "HG2 ") OR { 1242} (segid " " and resid "21 " and name "HN ") (segid " " and resid "19 " and name "HG1 ") ASSI { 1235} (segid " " and resid "28 " and name "HN ") (segid " " and resid "28 " and name "HA ") 5.000 5.000 0.000 peak 1235 weight 0.10000E+01 volume 0.10250E+01 ppm1 7.881 ppm2 4.154 OR { 1235} (segid " " and resid "21 " and name "HN ") (segid " " and resid "20 " and name "HB2 ") ASSI { 1267} (segid " " and resid "31 " and name "HN ") (segid " " and resid "31 " and name "HB2 ") 3.300 3.300 0.000 peak 1267 weight 0.10000E+01 volume 0.22260E+01 ppm1 8.456 ppm2 1.910 ASSI { 1234} (segid " " and resid "28 " and name "HN ") (segid " " and resid "28 " and name "HB1 ") 2.700 2.700 0.000 peak 1234 weight 0.10000E+01 volume 0.41740E+01 ppm1 7.881 ppm2 1.629 OR { 1234} (segid " " and resid "28 " and name "HN ") (segid " " and resid "28 " and name "HB3 ") OR { 1234} (segid " " and resid "28 " and name "HN ") (segid " " and resid "28 " and name "HB2 ") OR { 1234} (segid " " and resid "21 " and name "HN ") (segid " " and resid "18 " and name "HB2 ") ASSI { 1239} (segid " " and resid "28 " and name "HN ") (segid " " and resid "27 " and name "HB1 ") 5.000 5.000 0.000 peak 1239 weight 0.10000E+01 volume 0.33600E+00 ppm1 7.880 ppm2 1.400 ASSI { 1269} (segid " " and resid "31 " and name "HN ") (segid " " and resid "32 " and name "HN ") 5.000 5.000 0.000 peak 1269 weight 0.10000E+01 volume 0.10920E+01 ppm1 8.457 ppm2 7.875 OR { 1269} (segid " " and resid "31 " and name "HN ") (segid " " and resid "29 " and name "HN ") ASSI { 1241} (segid " " and resid "28 " and name "HN ") (segid " " and resid "30 " and name "HN ") 5.000 5.000 0.000 peak 1241 weight 0.10000E+01 volume 0.39000E+00 ppm1 7.880 ppm2 8.159 OR { 1241} (segid " " and resid "21 " and name "HN ") (segid " " and resid "22 " and name "HN ") OR { 1241} (segid " " and resid "28 " and name "HN ") (segid " " and resid "25 " and name "HN ") ASSI { 1236} (segid " " and resid "28 " and name "HN ") (segid " " and resid "27 " and name "HN ") 5.000 5.000 0.000 peak 1236 weight 0.10000E+01 volume 0.92700E+00 ppm1 7.880 ppm2 8.936 ASSI { 911} (segid " " and resid "2 " and name "HN ") (segid " " and resid "1 " and name "HG1 ") 6.000 6.000 0.000 peak 911 weight 0.10000E+01 volume 0.13700E+00 ppm1 8.905 ppm2 2.494 ASSI { 913} (segid " " and resid "2 " and name "HN ") (segid " " and resid "63 " and name "HA ") 6.000 6.000 0.000 peak 913 weight 0.10000E+01 volume 0.11200E+00 ppm1 8.905 ppm2 3.936 ASSI { 909} (segid " " and resid "2 " and name "HN ") (segid " " and resid "2 " and name "HB2 ") 5.000 5.000 0.000 peak 909 weight 0.10000E+01 volume 0.75700E+00 ppm1 8.906 ppm2 1.651 ASSI { 907} (segid " " and resid "2 " and name "HN ") (segid " " and resid "2 " and name "HB1 ") 5.000 5.000 0.000 peak 907 weight 0.10000E+01 volume 0.19810E+01 ppm1 8.906 ppm2 1.913 OR { 907} (segid " " and resid "2 " and name "HN ") (segid " " and resid "63 " and name "HB1 ") ASSI { 906} (segid " " and resid "2 " and name "HN ") (segid " " and resid "1 " and name "HA ") 3.300 3.300 0.000 peak 906 weight 0.10000E+01 volume 0.37870E+01 ppm1 8.906 ppm2 4.175 ASSI { 916} (segid " " and resid "2 " and name "HN ") (segid " " and resid "3 " and name "HN ") 6.000 6.000 0.000 peak 916 weight 0.10000E+01 volume 0.82000E-01 ppm1 8.908 ppm2 8.592 ASSI { 910} (segid " " and resid "2 " and name "HN ") (segid " " and resid "2 " and name "HG1 ") 5.000 5.000 0.000 peak 910 weight 0.10000E+01 volume 0.52300E+00 ppm1 8.906 ppm2 2.294 ASSI { 914} (segid " " and resid "2 " and name "HN ") (segid " " and resid "64 " and name "HN ") 6.000 6.000 0.000 peak 914 weight 0.10000E+01 volume 0.12100E+00 ppm1 8.904 ppm2 9.298 ASSI { 1524} (segid " " and resid "51 " and name "HN ") (segid " " and resid "50 " and name "HN ") 6.000 6.000 0.000 peak 1524 weight 0.10000E+01 volume 0.16700E+00 ppm1 8.291 ppm2 8.535 ASSI { 1523} (segid " " and resid "51 " and name "HN ") (segid " " and resid "23 " and name "HG12") 6.000 6.000 0.000 peak 1523 weight 0.10000E+01 volume 0.10800E+00 ppm1 8.295 ppm2 0.821 OR { 1523} (segid " " and resid "51 " and name "HN ") (segid " " and resid "23 " and name "HG11") OR { 1523} (segid " " and resid "51 " and name "HN ") (segid " " and resid "23 " and name "HG13") ASSI { 1519} (segid " " and resid "51 " and name "HN ") (segid " " and resid "23 " and name "HG21") 5.000 5.000 0.000 peak 1519 weight 0.10000E+01 volume 0.45700E+00 ppm1 8.294 ppm2 1.061 OR { 1519} (segid " " and resid "51 " and name "HN ") (segid " " and resid "23 " and name "HG23") OR { 1519} (segid " " and resid "51 " and name "HN ") (segid " " and resid "23 " and name "HG22") ASSI { 1518} (segid " " and resid "51 " and name "HN ") (segid " " and resid "50 " and name "HB1 ") 5.000 5.000 0.000 peak 1518 weight 0.10000E+01 volume 0.48600E+00 ppm1 8.294 ppm2 1.222 ASSI { 1513} (segid " " and resid "51 " and name "HN ") (segid " " and resid "51 " and name "HB2 ") 5.000 5.000 0.000 peak 1513 weight 0.10000E+01 volume 0.15790E+01 ppm1 8.294 ppm2 1.922 ASSI { 1512} (segid " " and resid "51 " and name "HN ") (segid " " and resid "50 " and name "HA ") 3.300 3.300 0.000 peak 1512 weight 0.10000E+01 volume 0.38030E+01 ppm1 8.294 ppm2 3.822 ASSI { 1515} (segid " " and resid "51 " and name "HN ") (segid " " and resid "51 " and name "HA ") 5.000 5.000 0.000 peak 1515 weight 0.10000E+01 volume 0.65700E+00 ppm1 8.293 ppm2 4.593 ASSI { 1514} (segid " " and resid "51 " and name "HN ") (segid " " and resid "59 " and name "HE2 ") 5.000 5.000 0.000 peak 1514 weight 0.10000E+01 volume 0.65000E+00 ppm1 8.293 ppm2 6.859 OR { 1514} (segid " " and resid "51 " and name "HN ") (segid " " and resid "59 " and name "HE1 ") ASSI { 1516} (segid " " and resid "51 " and name "HN ") (segid " " and resid "51 " and name "HB1 ") 5.000 5.000 0.000 peak 1516 weight 0.10000E+01 volume 0.78300E+00 ppm1 8.294 ppm2 2.221 ASSI { 1517} (segid " " and resid "51 " and name "HN ") (segid " " and resid "51 " and name "HG1 ") 5.000 5.000 0.000 peak 1517 weight 0.10000E+01 volume 0.79800E+00 ppm1 8.294 ppm2 2.421 OR { 1517} (segid " " and resid "51 " and name "HN ") (segid " " and resid "54 " and name "HB2 ") ASSI { 1522} (segid " " and resid "51 " and name "HN ") (segid " " and resid "54 " and name "HA ") 6.000 6.000 0.000 peak 1522 weight 0.10000E+01 volume 0.17600E+00 ppm1 8.296 ppm2 4.797 OR { 1522} (segid " " and resid "51 " and name "HN ") (segid " " and resid "22 " and name "HA ") OR { 1522} (segid " " and resid "51 " and name "HN ") (segid " " and resid "22 " and name "HB ") ASSI { 1521} (segid " " and resid "51 " and name "HN ") (segid " " and resid "50 " and name "HD21") 6.000 6.000 0.000 peak 1521 weight 0.10000E+01 volume 0.15600E+00 ppm1 8.293 ppm2 0.137 OR { 1521} (segid " " and resid "51 " and name "HN ") (segid " " and resid "50 " and name "HD22") ASSI { 1520} (segid " " and resid "51 " and name "HN ") (segid " " and resid "50 " and name "HB2 ") 6.000 6.000 0.000 peak 1520 weight 0.10000E+01 volume 0.19500E+00 ppm1 8.294 ppm2 1.543 ASSI { 1671} (segid " " and resid "62 " and name "HE21") (segid " " and resid "60 " and name "HB1 ") 6.000 6.000 0.000 peak 1671 weight 0.10000E+01 volume 0.32000E-01 ppm1 7.271 ppm2 3.292 ASSI { 1669} (segid " " and resid "62 " and name "HE21") (segid " " and resid "62 " and name "HE22") 2.700 2.700 0.000 peak 1669 weight 0.10000E+01 volume 0.14426E+02 ppm1 7.272 ppm2 6.796 ASSI { 1670} (segid " " and resid "62 " and name "HE21") (segid " " and resid "62 " and name "HG1 ") 5.000 5.000 0.000 peak 1670 weight 0.10000E+01 volume 0.36200E+00 ppm1 7.271 ppm2 2.295 OR { 1670} (segid " " and resid "62 " and name "HE21") (segid " " and resid "62 " and name "HG2 ") ASSI { 1674} (segid " " and resid "62 " and name "HE22") (segid " " and resid "62 " and name "HG2 ") 6.000 6.000 0.000 peak 1674 weight 0.10000E+01 volume 0.16300E+00 ppm1 6.798 ppm2 2.300 OR { 1674} (segid " " and resid "62 " and name "HE22") (segid " " and resid "62 " and name "HG1 ") OR { 1674} (segid " " and resid "62 " and name "HE22") (segid " " and resid "19 " and name "HB1 ") ASSI { 1672} (segid " " and resid "62 " and name "HE21") (segid " " and resid "60 " and name "HA ") 6.000 6.000 0.000 peak 1672 weight 0.10000E+01 volume 0.36000E-01 ppm1 7.271 ppm2 4.365 ASSI { 1143} (segid " " and resid "28 " and name "HN ") (segid " " and resid "24 " and name "HG2 ") 6.000 6.000 0.000 peak 1143 weight 0.10000E+01 volume 0.11900E+00 ppm1 7.887 ppm2 2.326 OR { 1143} (segid " " and resid "21 " and name "HN ") (segid " " and resid "19 " and name "HB1 ") OR { 1143} (segid " " and resid "21 " and name "HN ") (segid " " and resid "18 " and name "HG1 ") ASSI { 1130} (segid " " and resid "21 " and name "HN ") (segid " " and resid "20 " and name "HN ") 5.000 5.000 0.000 peak 1130 weight 0.10000E+01 volume 0.14910E+01 ppm1 7.888 ppm2 7.071 ASSI { 1135} (segid " " and resid "21 " and name "HN ") (segid " " and resid "56 " and name "HD13") 5.000 5.000 0.000 peak 1135 weight 0.10000E+01 volume 0.36700E+00 ppm1 7.888 ppm2 0.386 OR { 1135} (segid " " and resid "21 " and name "HN ") (segid " " and resid "56 " and name "HD12") OR { 1135} (segid " " and resid "21 " and name "HN ") (segid " " and resid "56 " and name "HD11") ASSI { 1136} (segid " " and resid "21 " and name "HN ") (segid " " and resid "18 " and name "HB1 ") 5.000 5.000 0.000 peak 1136 weight 0.10000E+01 volume 0.69600E+00 ppm1 7.889 ppm2 2.104 OR { 1136} (segid " " and resid "21 " and name "HN ") (segid " " and resid "17 " and name "HB ") ASSI { 1127} (segid " " and resid "21 " and name "HN ") (segid " " and resid "21 " and name "HB2 ") 3.300 3.300 0.000 peak 1127 weight 0.10000E+01 volume 0.26980E+01 ppm1 7.888 ppm2 2.901 ASSI { 1139} (segid " " and resid "21 " and name "HN ") (segid " " and resid "19 " and name "HA ") 5.000 5.000 0.000 peak 1139 weight 0.10000E+01 volume 0.30100E+00 ppm1 7.888 ppm2 4.013 OR { 1139} (segid " " and resid "21 " and name "HN ") (segid " " and resid "19 " and name "HD1 ") ASSI { 1142} (segid " " and resid "21 " and name "HN ") (segid " " and resid "55 " and name "HG23") 6.000 6.000 0.000 peak 1142 weight 0.10000E+01 volume 0.70000E-01 ppm1 7.888 ppm2 1.118 OR { 1142} (segid " " and resid "21 " and name "HN ") (segid " " and resid "55 " and name "HG21") OR { 1142} (segid " " and resid "21 " and name "HN ") (segid " " and resid "55 " and name "HG22") ASSI { 1138} (segid " " and resid "21 " and name "HN ") (segid " " and resid "18 " and name "HN ") 5.000 5.000 0.000 peak 1138 weight 0.10000E+01 volume 0.52500E+00 ppm1 7.889 ppm2 8.513 OR { 1138} (segid " " and resid "21 " and name "HN ") (segid " " and resid "56 " and name "HN ") OR { 1138} (segid " " and resid "28 " and name "HN ") (segid " " and resid "26 " and name "HN ") ASSI { 1133} (segid " " and resid "21 " and name "HN ") (segid " " and resid "21 " and name "HB1 ") 5.000 5.000 0.000 peak 1133 weight 0.10000E+01 volume 0.10760E+01 ppm1 7.888 ppm2 2.589 OR { 1133} (segid " " and resid "28 " and name "HN ") (segid " " and resid "27 " and name "HE2 ") ASSI { 1134} (segid " " and resid "21 " and name "HN ") (segid " " and resid "21 " and name "HA ") 5.000 5.000 0.000 peak 1134 weight 0.10000E+01 volume 0.10750E+01 ppm1 7.889 ppm2 4.689 ASSI { 1137} (segid " " and resid "21 " and name "HN ") (segid " " and resid "20 " and name "HA ") 5.000 5.000 0.000 peak 1137 weight 0.10000E+01 volume 0.54500E+00 ppm1 7.889 ppm2 4.377 OR { 1137} (segid " " and resid "28 " and name "HN ") (segid " " and resid "27 " and name "HA ") ASSI { 1141} (segid " " and resid "21 " and name "HN ") (segid " " and resid "20 " and name "HB1 ") 6.000 6.000 0.000 peak 1141 weight 0.10000E+01 volume 0.87000E-01 ppm1 7.890 ppm2 3.758 OR { 1141} (segid " " and resid "21 " and name "HN ") (segid " " and resid "57 " and name "HB1 ") OR { 1141} (segid " " and resid "21 " and name "HN ") (segid " " and resid "19 " and name "HD2 ") ASSI { 1489} (segid " " and resid "49 " and name "HE21") (segid " " and resid "49 " and name "HB2 ") 6.000 6.000 0.000 peak 1489 weight 0.10000E+01 volume 0.11800E+00 ppm1 7.610 ppm2 1.959 OR { 1489} (segid " " and resid "49 " and name "HE21") (segid " " and resid "49 " and name "HB1 ") ASSI { 1487} (segid " " and resid "49 " and name "HE21") (segid " " and resid "49 " and name "HG2 ") 5.000 5.000 0.000 peak 1487 weight 0.10000E+01 volume 0.93600E+00 ppm1 7.611 ppm2 2.256 OR { 1487} (segid " " and resid "49 " and name "HE21") (segid " " and resid "49 " and name "HG1 ") ASSI { 1492} (segid " " and resid "49 " and name "HE22") (segid " " and resid "49 " and name "HG2 ") 5.000 5.000 0.000 peak 1492 weight 0.10000E+01 volume 0.48800E+00 ppm1 6.887 ppm2 2.257 OR { 1492} (segid " " and resid "49 " and name "HE22") (segid " " and resid "49 " and name "HG1 ") ASSI { 1491} (segid " " and resid "49 " and name "HE22") (segid " " and resid "49 " and name "HE21") 2.700 2.700 0.000 peak 1491 weight 0.10000E+01 volume 0.11024E+02 ppm1 6.886 ppm2 7.609 ASSI { 1496} (segid " " and resid "49 " and name "HE22") (segid " " and resid "42 " and name "HD1 ") 6.000 6.000 0.000 peak 1496 weight 0.10000E+01 volume 0.58000E-01 ppm1 6.886 ppm2 3.090 OR { 1496} (segid " " and resid "49 " and name "HE22") (segid " " and resid "42 " and name "HD2 ") ASSI { 1495} (segid " " and resid "49 " and name "HE22") (segid " " and resid "49 " and name "HB1 ") 6.000 6.000 0.000 peak 1495 weight 0.10000E+01 volume 0.86000E-01 ppm1 6.884 ppm2 1.959 OR { 1495} (segid " " and resid "49 " and name "HE22") (segid " " and resid "49 " and name "HB2 ") ASSI { 1494} (segid " " and resid "49 " and name "HE22") (segid " " and resid "72 " and name "HE ") 6.000 6.000 0.000 peak 1494 weight 0.10000E+01 volume 0.13500E+00 ppm1 6.887 ppm2 7.139 ASSI { 1497} (segid " " and resid "49 " and name "HE22") (segid " " and resid "42 " and name "HG1 ") 6.000 6.000 0.000 peak 1497 weight 0.10000E+01 volume 0.33000E-01 ppm1 6.887 ppm2 1.483 OR { 1497} (segid " " and resid "49 " and name "HE22") (segid " " and resid "72 " and name "HG1 ") ASSI { 1490} (segid " " and resid "49 " and name "HE21") (segid " " and resid "42 " and name "HE ") 6.000 6.000 0.000 peak 1490 weight 0.10000E+01 volume 0.72000E-01 ppm1 7.613 ppm2 7.148 ASSI { 1599} (segid " " and resid "58 " and name "HN ") (segid " " and resid "58 " and name "HB1 ") 5.000 5.000 0.000 peak 1599 weight 0.10000E+01 volume 0.10530E+01 ppm1 7.814 ppm2 2.330 OR { 1599} (segid " " and resid "58 " and name "HN ") (segid " " and resid "54 " and name "HB1 ") OR { 1599} (segid " " and resid "58 " and name "HN ") (segid " " and resid "54 " and name "HB2 ") ASSI { 1602} (segid " " and resid "58 " and name "HN ") (segid " " and resid "57 " and name "HB1 ") 6.000 6.000 0.000 peak 1602 weight 0.10000E+01 volume 0.27500E+00 ppm1 7.815 ppm2 3.788 ASSI { 1605} (segid " " and resid "58 " and name "HN ") (segid " " and resid "56 " and name "HA ") 6.000 6.000 0.000 peak 1605 weight 0.10000E+01 volume 0.16800E+00 ppm1 7.813 ppm2 4.004 OR { 1605} (segid " " and resid "58 " and name "HN ") (segid " " and resid "19 " and name "HA ") ASSI { 1597} (segid " " and resid "58 " and name "HN ") (segid " " and resid "58 " and name "HA ") 5.000 5.000 0.000 peak 1597 weight 0.10000E+01 volume 0.12730E+01 ppm1 7.815 ppm2 4.321 OR { 1597} (segid " " and resid "58 " and name "HN ") (segid " " and resid "57 " and name "HA ") ASSI { 1768} (segid " " and resid "72 " and name "HN ") (segid " " and resid "72 " and name "HG2 ") 3.300 3.300 0.000 peak 1768 weight 0.10000E+01 volume 0.25570E+01 ppm1 8.522 ppm2 1.525 OR { 1768} (segid " " and resid "72 " and name "HN ") (segid " " and resid "72 " and name "HB2 ") OR { 1768} (segid " " and resid "72 " and name "HN ") (segid " " and resid "42 " and name "HB2 ") ASSI { 1770} (segid " " and resid "72 " and name "HN ") (segid " " and resid "72 " and name "HB1 ") 5.000 5.000 0.000 peak 1770 weight 0.10000E+01 volume 0.12660E+01 ppm1 8.522 ppm2 1.737 OR { 1770} (segid " " and resid "72 " and name "HN ") (segid " " and resid "42 " and name "HB1 ") ASSI { 1596} (segid " " and resid "58 " and name "HN ") (segid " " and resid "58 " and name "HB2 ") 3.300 3.300 0.000 peak 1596 weight 0.10000E+01 volume 0.21050E+01 ppm1 7.815 ppm2 3.000 ASSI { 1771} (segid " " and resid "72 " and name "HN ") (segid " " and resid "72 " and name "HA ") 5.000 5.000 0.000 peak 1771 weight 0.10000E+01 volume 0.87800E+00 ppm1 8.522 ppm2 4.210 ASSI { 1604} (segid " " and resid "58 " and name "HN ") (segid " " and resid "60 " and name "HN ") 6.000 6.000 0.000 peak 1604 weight 0.10000E+01 volume 0.17600E+00 ppm1 7.812 ppm2 8.132 ASSI { 1600} (segid " " and resid "58 " and name "HN ") (segid " " and resid "57 " and name "HN ") 5.000 5.000 0.000 peak 1600 weight 0.10000E+01 volume 0.96700E+00 ppm1 7.814 ppm2 8.617 ASSI { 1774} (segid " " and resid "72 " and name "HN ") (segid " " and resid "40 " and name "HB1 ") 6.000 6.000 0.000 peak 1774 weight 0.10000E+01 volume 0.20400E+00 ppm1 8.523 ppm2 2.433 ASSI { 1607} (segid " " and resid "58 " and name "HN ") (segid " " and resid "59 " and name "HD2 ") 6.000 6.000 0.000 peak 1607 weight 0.10000E+01 volume 0.15200E+00 ppm1 7.814 ppm2 7.268 OR { 1607} (segid " " and resid "58 " and name "HN ") (segid " " and resid "59 " and name "HD1 ") ASSI { 1772} (segid " " and resid "72 " and name "HN ") (segid " " and resid "70 " and name "HG12") 5.000 5.000 0.000 peak 1772 weight 0.10000E+01 volume 0.58600E+00 ppm1 8.522 ppm2 0.932 OR { 1772} (segid " " and resid "72 " and name "HN ") (segid " " and resid "70 " and name "HG13") OR { 1772} (segid " " and resid "72 " and name "HN ") (segid " " and resid "70 " and name "HG11") OR { 1772} (segid " " and resid "72 " and name "HN ") (segid " " and resid "71 " and name "HD22") OR { 1772} (segid " " and resid "72 " and name "HN ") (segid " " and resid "73 " and name "HD11") ASSI { 1606} (segid " " and resid "58 " and name "HN ") (segid " " and resid "55 " and name "HG23") 6.000 6.000 0.000 peak 1606 weight 0.10000E+01 volume 0.14400E+00 ppm1 7.814 ppm2 1.118 OR { 1606} (segid " " and resid "58 " and name "HN ") (segid " " and resid "55 " and name "HG21") OR { 1606} (segid " " and resid "58 " and name "HN ") (segid " " and resid "55 " and name "HG22") OR { 1606} (segid " " and resid "58 " and name "HN ") (segid " " and resid "61 " and name "HB ") ASSI { 1775} (segid " " and resid "72 " and name "HN ") (segid " " and resid "42 " and name "HD1 ") 6.000 6.000 0.000 peak 1775 weight 0.10000E+01 volume 0.11600E+00 ppm1 8.523 ppm2 3.106 OR { 1775} (segid " " and resid "72 " and name "HN ") (segid " " and resid "42 " and name "HD2 ") ASSI { 1773} (segid " " and resid "72 " and name "HN ") (segid " " and resid "40 " and name "HA ") 6.000 6.000 0.000 peak 1773 weight 0.10000E+01 volume 0.27300E+00 ppm1 8.522 ppm2 4.455 OR { 1773} (segid " " and resid "72 " and name "HN ") (segid " " and resid "42 " and name "HA ") ASSI { 993} (segid " " and resid "5 " and name "HN ") (segid " " and resid "5 " and name "HG ") 6.000 6.000 0.000 peak 993 weight 0.10000E+01 volume 0.19800E+00 ppm1 9.475 ppm2 1.313 OR { 993} (segid " " and resid "5 " and name "HN ") (segid " " and resid "6 " and name "HB2 ") ASSI { 989} (segid " " and resid "5 " and name "HN ") (segid " " and resid "13 " and name "HG21") 5.000 5.000 0.000 peak 989 weight 0.10000E+01 volume 0.32500E+00 ppm1 9.476 ppm2 0.904 OR { 989} (segid " " and resid "5 " and name "HN ") (segid " " and resid "13 " and name "HG23") OR { 989} (segid " " and resid "5 " and name "HN ") (segid " " and resid "66 " and name "HG22") ASSI { 983} (segid " " and resid "5 " and name "HN ") (segid " " and resid "5 " and name "HB1 ") 5.000 5.000 0.000 peak 983 weight 0.10000E+01 volume 0.13950E+01 ppm1 9.476 ppm2 1.898 ASSI { 982} (segid " " and resid "5 " and name "HN ") (segid " " and resid "4 " and name "HA ") 2.700 2.700 0.000 peak 982 weight 0.10000E+01 volume 0.43700E+01 ppm1 9.476 ppm2 5.441 OR { 982} (segid " " and resid "5 " and name "HN ") (segid " " and resid "5 " and name "HA ") ASSI { 986} (segid " " and resid "5 " and name "HN ") (segid " " and resid "13 " and name "HN ") 5.000 5.000 0.000 peak 986 weight 0.10000E+01 volume 0.70700E+00 ppm1 9.479 ppm2 9.272 ASSI { 988} (segid " " and resid "5 " and name "HN ") (segid " " and resid "4 " and name "HB2 ") 6.000 6.000 0.000 peak 988 weight 0.10000E+01 volume 0.22700E+00 ppm1 9.476 ppm2 3.110 ASSI { 994} (segid " " and resid "5 " and name "HN ") (segid " " and resid "13 " and name "HB ") 6.000 6.000 0.000 peak 994 weight 0.10000E+01 volume 0.13200E+00 ppm1 9.479 ppm2 2.134 ASSI { 984} (segid " " and resid "5 " and name "HN ") (segid " " and resid "5 " and name "HB2 ") 5.000 5.000 0.000 peak 984 weight 0.10000E+01 volume 0.12100E+01 ppm1 9.476 ppm2 1.111 ASSI { 985} (segid " " and resid "5 " and name "HN ") (segid " " and resid "4 " and name "HB1 ") 5.000 5.000 0.000 peak 985 weight 0.10000E+01 volume 0.50400E+00 ppm1 9.476 ppm2 2.807 ASSI { 991} (segid " " and resid "5 " and name "HN ") (segid " " and resid "5 " and name "HD22") 6.000 6.000 0.000 peak 991 weight 0.10000E+01 volume 0.24700E+00 ppm1 9.476 ppm2 0.656 OR { 991} (segid " " and resid "5 " and name "HN ") (segid " " and resid "15 " and name "HD11") OR { 991} (segid " " and resid "5 " and name "HN ") (segid " " and resid "15 " and name "HD13") OR { 991} (segid " " and resid "5 " and name "HN ") (segid " " and resid "5 " and name "HD21") OR { 991} (segid " " and resid "5 " and name "HN ") (segid " " and resid "5 " and name "HD23") OR { 991} (segid " " and resid "5 " and name "HN ") (segid " " and resid "67 " and name "HD11") OR { 991} (segid " " and resid "5 " and name "HN ") (segid " " and resid "67 " and name "HD12") OR { 991} (segid " " and resid "5 " and name "HN ") (segid " " and resid "67 " and name "HD13") ASSI { 990} (segid " " and resid "5 " and name "HN ") (segid " " and resid "4 " and name "HD1 ") 6.000 6.000 0.000 peak 990 weight 0.10000E+01 volume 0.17700E+00 ppm1 9.479 ppm2 7.042 OR { 990} (segid " " and resid "5 " and name "HN ") (segid " " and resid "4 " and name "HD2 ") ASSI { 987} (segid " " and resid "5 " and name "HN ") (segid " " and resid "14 " and name "HA ") 5.000 5.000 0.000 peak 987 weight 0.10000E+01 volume 0.32000E+00 ppm1 9.476 ppm2 5.114 ASSI { 992} (segid " " and resid "5 " and name "HN ") (segid " " and resid "15 " and name "HN ") 6.000 6.000 0.000 peak 992 weight 0.10000E+01 volume 0.22400E+00 ppm1 9.479 ppm2 8.852 OR { 992} (segid " " and resid "5 " and name "HN ") (segid " " and resid "6 " and name "HN ") ASSI { 1748} (segid " " and resid "69 " and name "HN ") (segid " " and resid "6 " and name "HN ") 5.000 5.000 0.000 peak 1748 weight 0.10000E+01 volume 0.33500E+00 ppm1 8.273 ppm2 8.876 OR { 1748} (segid " " and resid "69 " and name "HN ") (segid " " and resid "8 " and name "HN ") ASSI { 1746} (segid " " and resid "69 " and name "HN ") (segid " " and resid "5 " and name "HD12") 5.000 5.000 0.000 peak 1746 weight 0.10000E+01 volume 0.76300E+00 ppm1 8.273 ppm2 0.753 OR { 1746} (segid " " and resid "69 " and name "HN ") (segid " " and resid "5 " and name "HD13") OR { 1746} (segid " " and resid "69 " and name "HN ") (segid " " and resid "5 " and name "HD11") ASSI { 1747} (segid " " and resid "69 " and name "HN ") (segid " " and resid "7 " and name "HA ") 5.000 5.000 0.000 peak 1747 weight 0.10000E+01 volume 0.33500E+00 ppm1 8.272 ppm2 4.703 ASSI { 1744} (segid " " and resid "69 " and name "HN ") (segid " " and resid "69 " and name "HB2 ") 5.000 5.000 0.000 peak 1744 weight 0.10000E+01 volume 0.13520E+01 ppm1 8.273 ppm2 1.251 ASSI { 1742} (segid " " and resid "69 " and name "HN ") (segid " " and resid "68 " and name "HA ") 2.700 2.700 0.000 peak 1742 weight 0.10000E+01 volume 0.44080E+01 ppm1 8.273 ppm2 4.990 ASSI { 1753} (segid " " and resid "69 " and name "HN ") (segid " " and resid "7 " and name "HN ") 6.000 6.000 0.000 peak 1753 weight 0.10000E+01 volume 0.42000E-01 ppm1 8.270 ppm2 8.632 ASSI { 1743} (segid " " and resid "69 " and name "HN ") (segid " " and resid "69 " and name "HB1 ") 5.000 5.000 0.000 peak 1743 weight 0.10000E+01 volume 0.18630E+01 ppm1 8.273 ppm2 1.829 ASSI { 1745} (segid " " and resid "69 " and name "HN ") (segid " " and resid "68 " and name "HB1 ") 5.000 5.000 0.000 peak 1745 weight 0.10000E+01 volume 0.74600E+00 ppm1 8.273 ppm2 3.090 OR { 1745} (segid " " and resid "69 " and name "HN ") (segid " " and resid "68 " and name "HB2 ") ASSI { 1750} (segid " " and resid "69 " and name "HN ") (segid " " and resid "68 " and name "HN ") 6.000 6.000 0.000 peak 1750 weight 0.10000E+01 volume 0.71000E-01 ppm1 8.272 ppm2 9.378 ASSI { 1749} (segid " " and resid "69 " and name "HN ") (segid " " and resid "70 " and name "HN ") 6.000 6.000 0.000 peak 1749 weight 0.10000E+01 volume 0.12400E+00 ppm1 8.273 ppm2 9.125 OR { 1749} (segid " " and resid "69 " and name "HN ") (segid " " and resid "44 " and name "HN ") ASSI { 1783} (segid " " and resid "73 " and name "HN ") (segid " " and resid "73 " and name "HD13") 6.000 6.000 0.000 peak 1783 weight 0.10000E+01 volume 0.25800E+00 ppm1 8.342 ppm2 0.900 OR { 1783} (segid " " and resid "73 " and name "HN ") (segid " " and resid "73 " and name "HD21") OR { 1783} (segid " " and resid "73 " and name "HN ") (segid " " and resid "73 " and name "HD11") OR { 1783} (segid " " and resid "73 " and name "HN ") (segid " " and resid "73 " and name "HD22") OR { 1783} (segid " " and resid "73 " and name "HN ") (segid " " and resid "70 " and name "HG13") OR { 1783} (segid " " and resid "73 " and name "HN ") (segid " " and resid "70 " and name "HG11") ASSI { 1780} (segid " " and resid "73 " and name "HN ") (segid " " and resid "73 " and name "HG ") 3.300 3.300 0.000 peak 1780 weight 0.10000E+01 volume 0.25640E+01 ppm1 8.341 ppm2 1.610 OR { 1780} (segid " " and resid "73 " and name "HN ") (segid " " and resid "73 " and name "HB2 ") OR { 1780} (segid " " and resid "73 " and name "HN ") (segid " " and resid "73 " and name "HB1 ") ASSI { 1784} (segid " " and resid "73 " and name "HN ") (segid " " and resid "72 " and name "HD1 ") 6.000 6.000 0.000 peak 1784 weight 0.10000E+01 volume 0.12700E+00 ppm1 8.343 ppm2 3.100 OR { 1784} (segid " " and resid "73 " and name "HN ") (segid " " and resid "72 " and name "HD2 ") ASSI { 1779} (segid " " and resid "73 " and name "HN ") (segid " " and resid "72 " and name "HA ") 3.300 3.300 0.000 peak 1779 weight 0.10000E+01 volume 0.32890E+01 ppm1 8.341 ppm2 4.207 ASSI { 1781} (segid " " and resid "73 " and name "HN ") (segid " " and resid "73 " and name "HA ") 5.000 5.000 0.000 peak 1781 weight 0.10000E+01 volume 0.58300E+00 ppm1 8.342 ppm2 4.398 ASSI { 1416} (segid " " and resid "42 " and name "HN ") (segid " " and resid "72 " and name "HD2 ") 6.000 6.000 0.000 peak 1416 weight 0.10000E+01 volume 0.94000E-01 ppm1 8.409 ppm2 3.085 OR { 1416} (segid " " and resid "42 " and name "HN ") (segid " " and resid "42 " and name "HD2 ") OR { 1416} (segid " " and resid "42 " and name "HN ") (segid " " and resid "72 " and name "HD1 ") OR { 1416} (segid " " and resid "42 " and name "HN ") (segid " " and resid "42 " and name "HD1 ") ASSI { 1415} (segid " " and resid "42 " and name "HN ") (segid " " and resid "69 " and name "HA ") 6.000 6.000 0.000 peak 1415 weight 0.10000E+01 volume 0.88000E-01 ppm1 8.412 ppm2 5.066 ASSI { 1413} (segid " " and resid "42 " and name "HN ") (segid " " and resid "42 " and name "HA ") 5.000 5.000 0.000 peak 1413 weight 0.10000E+01 volume 0.71000E+00 ppm1 8.412 ppm2 4.429 ASSI { 1412} (segid " " and resid "42 " and name "HN ") (segid " " and resid "42 " and name "HB1 ") 5.000 5.000 0.000 peak 1412 weight 0.10000E+01 volume 0.10840E+01 ppm1 8.413 ppm2 1.713 ASSI { 1410} (segid " " and resid "42 " and name "HN ") (segid " " and resid "69 " and name "HD13") 5.000 5.000 0.000 peak 1410 weight 0.10000E+01 volume 0.13160E+01 ppm1 8.412 ppm2 0.824 OR { 1410} (segid " " and resid "42 " and name "HN ") (segid " " and resid "69 " and name "HD11") OR { 1410} (segid " " and resid "42 " and name "HN ") (segid " " and resid "69 " and name "HD12") ASSI { 1417} (segid " " and resid "42 " and name "HN ") (segid " " and resid "42 " and name "HG2 ") 6.000 6.000 0.000 peak 1417 weight 0.10000E+01 volume 0.14200E+00 ppm1 8.414 ppm2 1.305 OR { 1417} (segid " " and resid "42 " and name "HN ") (segid " " and resid "69 " and name "HB2 ") ASSI { 1411} (segid " " and resid "42 " and name "HN ") (segid " " and resid "42 " and name "HB2 ") 5.000 5.000 0.000 peak 1411 weight 0.10000E+01 volume 0.12420E+01 ppm1 8.412 ppm2 1.501 OR { 1411} (segid " " and resid "42 " and name "HN ") (segid " " and resid "42 " and name "HG1 ") ASSI { 1414} (segid " " and resid "42 " and name "HN ") (segid " " and resid "70 " and name "HN ") 5.000 5.000 0.000 peak 1414 weight 0.10000E+01 volume 0.45400E+00 ppm1 8.412 ppm2 9.139 ASSI { 1409} (segid " " and resid "42 " and name "HN ") (segid " " and resid "41 " and name "HA ") 3.300 3.300 0.000 peak 1409 weight 0.10000E+01 volume 0.36350E+01 ppm1 8.412 ppm2 4.088 ASSI { 1420} (segid " " and resid "42 " and name "HN ") (segid " " and resid "41 " and name "HN ") 6.000 6.000 0.000 peak 1420 weight 0.10000E+01 volume 0.61000E-01 ppm1 8.415 ppm2 7.341 ASSI { 1419} (segid " " and resid "42 " and name "HN ") (segid " " and resid "43 " and name "HN ") 6.000 6.000 0.000 peak 1419 weight 0.10000E+01 volume 0.99000E-01 ppm1 8.412 ppm2 8.889 ASSI { 1353} (segid " " and resid "39 " and name "HN ") (segid " " and resid "38 " and name "HG2 ") 6.000 6.000 0.000 peak 1353 weight 0.10000E+01 volume 0.67000E-01 ppm1 8.536 ppm2 1.622 ASSI { 1351} (segid " " and resid "39 " and name "HN ") (segid " " and resid "38 " and name "HB1 ") 5.000 5.000 0.000 peak 1351 weight 0.10000E+01 volume 0.42900E+00 ppm1 8.536 ppm2 2.265 ASSI { 1350} (segid " " and resid "39 " and name "HN ") (segid " " and resid "38 " and name "HA ") 6.000 6.000 0.000 peak 1350 weight 0.10000E+01 volume 0.24900E+00 ppm1 8.535 ppm2 4.058 ASSI { 1345} (segid " " and resid "39 " and name "HN ") (segid " " and resid "39 " and name "HB2 ") 5.000 5.000 0.000 peak 1345 weight 0.10000E+01 volume 0.16040E+01 ppm1 8.535 ppm2 2.699 ASSI { 1349} (segid " " and resid "39 " and name "HN ") (segid " " and resid "38 " and name "HD2 ") 5.000 5.000 0.000 peak 1349 weight 0.10000E+01 volume 0.58300E+00 ppm1 8.535 ppm2 3.723 ASSI { 1347} (segid " " and resid "39 " and name "HN ") (segid " " and resid "38 " and name "HB2 ") 5.000 5.000 0.000 peak 1347 weight 0.10000E+01 volume 0.14540E+01 ppm1 8.536 ppm2 2.003 ASSI { 1348} (segid " " and resid "39 " and name "HN ") (segid " " and resid "39 " and name "HA ") 5.000 5.000 0.000 peak 1348 weight 0.10000E+01 volume 0.10530E+01 ppm1 8.535 ppm2 4.391 ASSI { 1352} (segid " " and resid "39 " and name "HN ") (segid " " and resid "41 " and name "HN ") 6.000 6.000 0.000 peak 1352 weight 0.10000E+01 volume 0.12900E+00 ppm1 8.536 ppm2 7.345 ASSI { 1586} (segid " " and resid "57 " and name "HN ") (segid " " and resid "55 " and name "HB ") 5.000 5.000 0.000 peak 1586 weight 0.10000E+01 volume 0.98100E+00 ppm1 8.618 ppm2 4.488 ASSI { 1594} (segid " " and resid "57 " and name "HN ") (segid " " and resid "56 " and name "HD22") 6.000 6.000 0.000 peak 1594 weight 0.10000E+01 volume 0.17700E+00 ppm1 8.617 ppm2 0.347 OR { 1594} (segid " " and resid "57 " and name "HN ") (segid " " and resid "56 " and name "HD21") OR { 1594} (segid " " and resid "57 " and name "HN ") (segid " " and resid "56 " and name "HD23") OR { 1594} (segid " " and resid "57 " and name "HN ") (segid " " and resid "61 " and name "HD12") OR { 1594} (segid " " and resid "57 " and name "HN ") (segid " " and resid "61 " and name "HD13") OR { 1594} (segid " " and resid "57 " and name "HN ") (segid " " and resid "61 " and name "HD11") OR { 1594} (segid " " and resid "57 " and name "HN ") (segid " " and resid "61 " and name "HG22") OR { 1594} (segid " " and resid "57 " and name "HN ") (segid " " and resid "61 " and name "HG21") ASSI { 1590} (segid " " and resid "57 " and name "HN ") (segid " " and resid "56 " and name "HB1 ") 5.000 5.000 0.000 peak 1590 weight 0.10000E+01 volume 0.54300E+00 ppm1 8.619 ppm2 1.092 OR { 1590} (segid " " and resid "57 " and name "HN ") (segid " " and resid "61 " and name "HB ") ASSI { 1595} (segid " " and resid "57 " and name "HN ") (segid " " and resid "56 " and name "HG ") 6.000 6.000 0.000 peak 1595 weight 0.10000E+01 volume 0.10600E+00 ppm1 8.617 ppm2 1.638 ASSI { 1591} (segid " " and resid "57 " and name "HN ") (segid " " and resid "19 " and name "HB1 ") 6.000 6.000 0.000 peak 1591 weight 0.10000E+01 volume 0.14200E+00 ppm1 8.617 ppm2 2.332 ASSI { 1584} (segid " " and resid "57 " and name "HN ") (segid " " and resid "57 " and name "HB1 ") 5.000 5.000 0.000 peak 1584 weight 0.10000E+01 volume 0.15210E+01 ppm1 8.618 ppm2 3.757 ASSI { 1589} (segid " " and resid "57 " and name "HN ") (segid " " and resid "19 " and name "HA ") 5.000 5.000 0.000 peak 1589 weight 0.10000E+01 volume 0.95400E+00 ppm1 8.618 ppm2 3.961 ASSI { 1585} (segid " " and resid "57 " and name "HN ") (segid " " and resid "57 " and name "HA ") 5.000 5.000 0.000 peak 1585 weight 0.10000E+01 volume 0.12080E+01 ppm1 8.618 ppm2 4.297 ASSI { 1588} (segid " " and resid "57 " and name "HN ") (segid " " and resid "56 " and name "HB2 ") 5.000 5.000 0.000 peak 1588 weight 0.10000E+01 volume 0.88200E+00 ppm1 8.618 ppm2 1.868 ASSI { 1593} (segid " " and resid "57 " and name "HN ") (segid " " and resid "55 " and name "HA ") 6.000 6.000 0.000 peak 1593 weight 0.10000E+01 volume 0.14500E+00 ppm1 8.619 ppm2 5.241 ASSI { 1066} (segid " " and resid "13 " and name "HN ") (segid " " and resid "5 " and name "HB1 ") 5.000 5.000 0.000 peak 1066 weight 0.10000E+01 volume 0.30000E+00 ppm1 9.278 ppm2 1.897 ASSI { 1061} (segid " " and resid "13 " and name "HN ") (segid " " and resid "13 " and name "HG21") 5.000 5.000 0.000 peak 1061 weight 0.10000E+01 volume 0.14690E+01 ppm1 9.279 ppm2 0.892 OR { 1061} (segid " " and resid "13 " and name "HN ") (segid " " and resid "13 " and name "HG23") OR { 1061} (segid " " and resid "13 " and name "HN ") (segid " " and resid "13 " and name "HG22") ASSI { 1064} (segid " " and resid "13 " and name "HN ") (segid " " and resid "12 " and name "HG23") 5.000 5.000 0.000 peak 1064 weight 0.10000E+01 volume 0.10980E+01 ppm1 9.278 ppm2 1.070 OR { 1064} (segid " " and resid "13 " and name "HN ") (segid " " and resid "12 " and name "HG21") OR { 1064} (segid " " and resid "13 " and name "HN ") (segid " " and resid "12 " and name "HG22") ASSI { 1060} (segid " " and resid "13 " and name "HN ") (segid " " and resid "12 " and name "HA ") 2.700 2.700 0.000 peak 1060 weight 0.10000E+01 volume 0.45430E+01 ppm1 9.279 ppm2 5.290 ASSI { 1062} (segid " " and resid "13 " and name "HN ") (segid " " and resid "13 " and name "HA ") 5.000 5.000 0.000 peak 1062 weight 0.10000E+01 volume 0.76600E+00 ppm1 9.279 ppm2 4.662 ASSI { 1063} (segid " " and resid "13 " and name "HN ") (segid " " and resid "13 " and name "HB ") 5.000 5.000 0.000 peak 1063 weight 0.10000E+01 volume 0.76800E+00 ppm1 9.279 ppm2 2.148 ASSI { 1067} (segid " " and resid "13 " and name "HN ") (segid " " and resid "12 " and name "HN ") 6.000 6.000 0.000 peak 1067 weight 0.10000E+01 volume 0.24200E+00 ppm1 9.279 ppm2 8.591 OR { 1067} (segid " " and resid "13 " and name "HN ") (segid " " and resid "14 " and name "HN ") ASSI { 1068} (segid " " and resid "13 " and name "HN ") (segid " " and resid "12 " and name "HB ") 6.000 6.000 0.000 peak 1068 weight 0.10000E+01 volume 0.20000E+00 ppm1 9.281 ppm2 3.924 ASSI { 1462} (segid " " and resid "47 " and name "HN ") (segid " " and resid "47 " and name "HA2 ") 3.300 3.300 0.000 peak 1462 weight 0.10000E+01 volume 0.24890E+01 ppm1 8.072 ppm2 3.449 ASSI { 1463} (segid " " and resid "47 " and name "HN ") (segid " " and resid "46 " and name "HA ") 5.000 5.000 0.000 peak 1463 weight 0.10000E+01 volume 0.14360E+01 ppm1 8.072 ppm2 3.709 ASSI { 1465} (segid " " and resid "47 " and name "HN ") (segid " " and resid "47 " and name "HA1 ") 5.000 5.000 0.000 peak 1465 weight 0.10000E+01 volume 0.13490E+01 ppm1 8.071 ppm2 4.114 ASSI { 1464} (segid " " and resid "47 " and name "HN ") (segid " " and resid "44 " and name "HG23") 5.000 5.000 0.000 peak 1464 weight 0.10000E+01 volume 0.13390E+01 ppm1 8.072 ppm2 0.677 OR { 1464} (segid " " and resid "47 " and name "HN ") (segid " " and resid "44 " and name "HG21") OR { 1464} (segid " " and resid "47 " and name "HN ") (segid " " and resid "44 " and name "HG22") ASSI { 1467} (segid " " and resid "47 " and name "HN ") (segid " " and resid "45 " and name "HA ") 6.000 6.000 0.000 peak 1467 weight 0.10000E+01 volume 0.12000E+00 ppm1 8.073 ppm2 5.199 ASSI { 1667} (segid " " and resid "62 " and name "HN ") (segid " " and resid "3 " and name "HG12") 6.000 6.000 0.000 peak 1667 weight 0.10000E+01 volume 0.64000E-01 ppm1 7.734 ppm2 0.587 OR { 1667} (segid " " and resid "62 " and name "HN ") (segid " " and resid "3 " and name "HG13") OR { 1667} (segid " " and resid "62 " and name "HN ") (segid " " and resid "3 " and name "HG11") ASSI { 1659} (segid " " and resid "62 " and name "HN ") (segid " " and resid "65 " and name "HB1 ") 6.000 6.000 0.000 peak 1659 weight 0.10000E+01 volume 0.27400E+00 ppm1 7.736 ppm2 3.977 OR { 1659} (segid " " and resid "62 " and name "HN ") (segid " " and resid "63 " and name "HA ") ASSI { 1663} (segid " " and resid "62 " and name "HN ") (segid " " and resid "45 " and name "HZ ") 6.000 6.000 0.000 peak 1663 weight 0.10000E+01 volume 0.13400E+00 ppm1 7.735 ppm2 7.467 ASSI { 1662} (segid " " and resid "62 " and name "HN ") (segid " " and resid "61 " and name "HG11") 6.000 6.000 0.000 peak 1662 weight 0.10000E+01 volume 0.16400E+00 ppm1 7.736 ppm2 1.051 OR { 1662} (segid " " and resid "62 " and name "HN ") (segid " " and resid "56 " and name "HB1 ") ASSI { 1658} (segid " " and resid "62 " and name "HN ") (segid " " and resid "65 " and name "HB2 ") 5.000 5.000 0.000 peak 1658 weight 0.10000E+01 volume 0.46200E+00 ppm1 7.735 ppm2 3.696 ASSI { 1657} (segid " " and resid "62 " and name "HN ") (segid " " and resid "62 " and name "HG2 ") 5.000 5.000 0.000 peak 1657 weight 0.10000E+01 volume 0.83500E+00 ppm1 7.735 ppm2 2.300 OR { 1657} (segid " " and resid "62 " and name "HN ") (segid " " and resid "62 " and name "HG1 ") ASSI { 1654} (segid " " and resid "62 " and name "HN ") (segid " " and resid "61 " and name "HG23") 5.000 5.000 0.000 peak 1654 weight 0.10000E+01 volume 0.10880E+01 ppm1 7.736 ppm2 0.331 OR { 1654} (segid " " and resid "62 " and name "HN ") (segid " " and resid "61 " and name "HG22") OR { 1654} (segid " " and resid "62 " and name "HN ") (segid " " and resid "61 " and name "HG21") ASSI { 1653} (segid " " and resid "62 " and name "HN ") (segid " " and resid "61 " and name "HA ") 3.300 3.300 0.000 peak 1653 weight 0.10000E+01 volume 0.39550E+01 ppm1 7.735 ppm2 3.186 ASSI { 1656} (segid " " and resid "62 " and name "HN ") (segid " " and resid "62 " and name "HA ") 5.000 5.000 0.000 peak 1656 weight 0.10000E+01 volume 0.86500E+00 ppm1 7.734 ppm2 4.546 ASSI { 1660} (segid " " and resid "62 " and name "HN ") (segid " " and resid "61 " and name "HG12") 6.000 6.000 0.000 peak 1660 weight 0.10000E+01 volume 0.14100E+00 ppm1 7.735 ppm2 -0.409 ASSI { 1655} (segid " " and resid "62 " and name "HN ") (segid " " and resid "62 " and name "HB2 ") 5.000 5.000 0.000 peak 1655 weight 0.10000E+01 volume 0.10820E+01 ppm1 7.735 ppm2 1.830 ASSI { 1666} (segid " " and resid "62 " and name "HN ") (segid " " and resid "1 " and name "HE1 ") 6.000 6.000 0.000 peak 1666 weight 0.10000E+01 volume 0.50000E-01 ppm1 7.734 ppm2 1.490 OR { 1666} (segid " " and resid "62 " and name "HN ") (segid " " and resid "1 " and name "HE2 ") OR { 1666} (segid " " and resid "62 " and name "HN ") (segid " " and resid "1 " and name "HE3 ") OR { 1666} (segid " " and resid "62 " and name "HN ") (segid " " and resid "63 " and name "HG1 ") ASSI { 1321} (segid " " and resid "34 " and name "HN ") (segid " " and resid "31 " and name "HA ") 6.000 6.000 0.000 peak 1321 weight 0.10000E+01 volume 0.11100E+00 ppm1 8.813 ppm2 3.805 ASSI { 1318} (segid " " and resid "34 " and name "HN ") (segid " " and resid "33 " and name "HA ") 5.000 5.000 0.000 peak 1318 weight 0.10000E+01 volume 0.31600E+00 ppm1 8.813 ppm2 4.308 OR { 1318} (segid " " and resid "34 " and name "HN ") (segid " " and resid "32 " and name "HA ") ASSI { 1319} (segid " " and resid "34 " and name "HN ") (segid " " and resid "30 " and name "HA ") 6.000 6.000 0.000 peak 1319 weight 0.10000E+01 volume 0.16100E+00 ppm1 8.812 ppm2 3.317 ASSI { 1314} (segid " " and resid "34 " and name "HN ") (segid " " and resid "33 " and name "HB1 ") 3.300 3.300 0.000 peak 1314 weight 0.10000E+01 volume 0.20110E+01 ppm1 8.813 ppm2 1.947 ASSI { 1317} (segid " " and resid "34 " and name "HN ") (segid " " and resid "34 " and name "HB1 ") 5.000 5.000 0.000 peak 1317 weight 0.10000E+01 volume 0.72700E+00 ppm1 8.813 ppm2 2.283 OR { 1317} (segid " " and resid "15 " and name "HN ") (segid " " and resid "2 " and name "HG1 ") ASSI { 1320} (segid " " and resid "34 " and name "HN ") (segid " " and resid "30 " and name "HG22") 5.000 5.000 0.000 peak 1320 weight 0.10000E+01 volume 0.31300E+00 ppm1 8.814 ppm2 0.521 OR { 1320} (segid " " and resid "34 " and name "HN ") (segid " " and resid "30 " and name "HG23") OR { 1320} (segid " " and resid "34 " and name "HN ") (segid " " and resid "30 " and name "HG21") ASSI { 1508} (segid " " and resid "50 " and name "HN ") (segid " " and resid "43 " and name "HD11") 6.000 6.000 0.000 peak 1508 weight 0.10000E+01 volume 0.16400E+00 ppm1 8.537 ppm2 0.774 OR { 1508} (segid " " and resid "50 " and name "HN ") (segid " " and resid "43 " and name "HD12") OR { 1508} (segid " " and resid "50 " and name "HN ") (segid " " and resid "43 " and name "HD13") OR { 1508} (segid " " and resid "50 " and name "HN ") (segid " " and resid "43 " and name "HD23") OR { 1508} (segid " " and resid "50 " and name "HN ") (segid " " and resid "43 " and name "HD22") OR { 1508} (segid " " and resid "50 " and name "HN ") (segid " " and resid "43 " and name "HD21") OR { 1508} (segid " " and resid "50 " and name "HN ") (segid " " and resid "70 " and name "HG22") ASSI { 1316} (segid " " and resid "34 " and name "HN ") (segid " " and resid "34 " and name "HA ") 5.000 5.000 0.000 peak 1316 weight 0.10000E+01 volume 0.85400E+00 ppm1 8.813 ppm2 4.497 ASSI { 1509} (segid " " and resid "50 " and name "HN ") (segid " " and resid "43 " and name "HN ") 6.000 6.000 0.000 peak 1509 weight 0.10000E+01 volume 0.11700E+00 ppm1 8.536 ppm2 8.907 ASSI { 1315} (segid " " and resid "34 " and name "HN ") (segid " " and resid "34 " and name "HB2 ") 3.300 3.300 0.000 peak 1315 weight 0.10000E+01 volume 0.20380E+01 ppm1 8.814 ppm2 1.651 ASSI { 1506} (segid " " and resid "50 " and name "HN ") (segid " " and resid "43 " and name "HB2 ") 5.000 5.000 0.000 peak 1506 weight 0.10000E+01 volume 0.31700E+00 ppm1 8.537 ppm2 1.737 ASSI { 1505} (segid " " and resid "50 " and name "HN ") (segid " " and resid "50 " and name "HD22") 5.000 5.000 0.000 peak 1505 weight 0.10000E+01 volume 0.33100E+00 ppm1 8.537 ppm2 0.144 OR { 1505} (segid " " and resid "50 " and name "HN ") (segid " " and resid "50 " and name "HD23") ASSI { 1503} (segid " " and resid "50 " and name "HN ") (segid " " and resid "50 " and name "HD12") 5.000 5.000 0.000 peak 1503 weight 0.10000E+01 volume 0.60100E+00 ppm1 8.537 ppm2 0.578 OR { 1503} (segid " " and resid "50 " and name "HN ") (segid " " and resid "50 " and name "HD13") OR { 1503} (segid " " and resid "50 " and name "HN ") (segid " " and resid "50 " and name "HD11") ASSI { 1500} (segid " " and resid "50 " and name "HN ") (segid " " and resid "50 " and name "HG ") 5.000 5.000 0.000 peak 1500 weight 0.10000E+01 volume 0.19130E+01 ppm1 8.536 ppm2 1.174 ASSI { 1504} (segid " " and resid "50 " and name "HN ") (segid " " and resid "49 " and name "HB1 ") 5.000 5.000 0.000 peak 1504 weight 0.10000E+01 volume 0.52400E+00 ppm1 8.536 ppm2 1.972 OR { 1504} (segid " " and resid "50 " and name "HN ") (segid " " and resid "49 " and name "HB2 ") ASSI { 1501} (segid " " and resid "50 " and name "HN ") (segid " " and resid "49 " and name "HG2 ") 5.000 5.000 0.000 peak 1501 weight 0.10000E+01 volume 0.91500E+00 ppm1 8.536 ppm2 2.260 OR { 1501} (segid " " and resid "50 " and name "HN ") (segid " " and resid "49 " and name "HG1 ") ASSI { 1502} (segid " " and resid "50 " and name "HN ") (segid " " and resid "50 " and name "HA ") 5.000 5.000 0.000 peak 1502 weight 0.10000E+01 volume 0.77000E+00 ppm1 8.537 ppm2 3.828 ASSI { 1498} (segid " " and resid "50 " and name "HN ") (segid " " and resid "49 " and name "HA ") 2.700 2.700 0.000 peak 1498 weight 0.10000E+01 volume 0.46470E+01 ppm1 8.537 ppm2 4.892 OR { 1498} (segid " " and resid "50 " and name "HN ") (segid " " and resid "44 " and name "HA ") ASSI { 1499} (segid " " and resid "50 " and name "HN ") (segid " " and resid "50 " and name "HB2 ") 5.000 5.000 0.000 peak 1499 weight 0.10000E+01 volume 0.15800E+01 ppm1 8.536 ppm2 1.517 ASSI { 1089} (segid " " and resid "15 " and name "HN ") (segid " " and resid "5 " and name "HN ") 6.000 6.000 0.000 peak 1089 weight 0.10000E+01 volume 0.63000E-01 ppm1 8.851 ppm2 9.471 ASSI { 1082} (segid " " and resid "15 " and name "HN ") (segid " " and resid "14 " and name "HG21") 5.000 5.000 0.000 peak 1082 weight 0.10000E+01 volume 0.94300E+00 ppm1 8.848 ppm2 1.134 OR { 1082} (segid " " and resid "15 " and name "HN ") (segid " " and resid "14 " and name "HG23") OR { 1082} (segid " " and resid "15 " and name "HN ") (segid " " and resid "14 " and name "HG22") ASSI { 1079} (segid " " and resid "34 " and name "HN ") (segid " " and resid "34 " and name "HB2 ") 5.000 5.000 0.000 peak 1079 weight 0.10000E+01 volume 0.19130E+01 ppm1 8.848 ppm2 1.683 OR { 1079} (segid " " and resid "15 " and name "HN ") (segid " " and resid "15 " and name "HB ") ASSI { 1081} (segid " " and resid "15 " and name "HN ") (segid " " and resid "15 " and name "HA ") 5.000 5.000 0.000 peak 1081 weight 0.10000E+01 volume 0.13580E+01 ppm1 8.850 ppm2 4.416 ASSI { 1086} (segid " " and resid "15 " and name "HN ") (segid " " and resid "15 " and name "HG11") 5.000 5.000 0.000 peak 1086 weight 0.10000E+01 volume 0.45200E+00 ppm1 8.849 ppm2 1.342 ASSI { 1084} (segid " " and resid "15 " and name "HN ") (segid " " and resid "14 " and name "HB ") 5.000 5.000 0.000 peak 1084 weight 0.10000E+01 volume 0.48600E+00 ppm1 8.848 ppm2 4.029 ASSI { 1087} (segid " " and resid "15 " and name "HN ") (segid " " and resid "13 " and name "HG13") 5.000 5.000 0.000 peak 1087 weight 0.10000E+01 volume 0.40800E+00 ppm1 8.849 ppm2 0.936 OR { 1087} (segid " " and resid "15 " and name "HN ") (segid " " and resid "13 " and name "HG11") OR { 1087} (segid " " and resid "15 " and name "HN ") (segid " " and resid "13 " and name "HG22") OR { 1087} (segid " " and resid "15 " and name "HN ") (segid " " and resid "15 " and name "HG23") OR { 1087} (segid " " and resid "15 " and name "HN ") (segid " " and resid "15 " and name "HG22") OR { 1087} (segid " " and resid "15 " and name "HN ") (segid " " and resid "13 " and name "HG12") OR { 1087} (segid " " and resid "15 " and name "HN ") (segid " " and resid "15 " and name "HG21") OR { 1087} (segid " " and resid "15 " and name "HN ") (segid " " and resid "13 " and name "HG23") OR { 1087} (segid " " and resid "34 " and name "HN ") (segid " " and resid "13 " and name "HG22") OR { 1087} (segid " " and resid "34 " and name "HN ") (segid " " and resid "13 " and name "HG12") ASSI { 1078} (segid " " and resid "15 " and name "HN ") (segid " " and resid "14 " and name "HA ") 2.700 2.700 0.000 peak 1078 weight 0.10000E+01 volume 0.44950E+01 ppm1 8.849 ppm2 5.107 ASSI { 1085} (segid " " and resid "15 " and name "HN ") (segid " " and resid "4 " and name "HA ") 6.000 6.000 0.000 peak 1085 weight 0.10000E+01 volume 0.27100E+00 ppm1 8.849 ppm2 5.441 ASSI { 1083} (segid " " and resid "15 " and name "HN ") (segid " " and resid "3 " and name "HG21") 5.000 5.000 0.000 peak 1083 weight 0.10000E+01 volume 0.74100E+00 ppm1 8.849 ppm2 0.605 OR { 1083} (segid " " and resid "15 " and name "HN ") (segid " " and resid "3 " and name "HG22") OR { 1083} (segid " " and resid "15 " and name "HN ") (segid " " and resid "3 " and name "HG23") ASSI { 1759} (segid " " and resid "70 " and name "HN ") (segid " " and resid "41 " and name "HB1 ") 5.000 5.000 0.000 peak 1759 weight 0.10000E+01 volume 0.31500E+00 ppm1 9.132 ppm2 1.760 OR { 1759} (segid " " and resid "70 " and name "HN ") (segid " " and resid "72 " and name "HB1 ") OR { 1759} (segid " " and resid "70 " and name "HN ") (segid " " and resid "44 " and name "HB ") OR { 1759} (segid " " and resid "70 " and name "HN ") (segid " " and resid "43 " and name "HB2 ") ASSI { 1758} (segid " " and resid "70 " and name "HN ") (segid " " and resid "43 " and name "HA ") 6.000 6.000 0.000 peak 1758 weight 0.10000E+01 volume 0.23200E+00 ppm1 9.133 ppm2 5.347 ASSI { 1752} (segid " " and resid "70 " and name "HN ") (segid " " and resid "69 " and name "HD12") 3.300 3.300 0.000 peak 1752 weight 0.10000E+01 volume 0.23900E+01 ppm1 9.132 ppm2 0.811 OR { 1752} (segid " " and resid "70 " and name "HN ") (segid " " and resid "70 " and name "HG22") OR { 1752} (segid " " and resid "70 " and name "HN ") (segid " " and resid "69 " and name "HD11") OR { 1752} (segid " " and resid "70 " and name "HN ") (segid " " and resid "69 " and name "HD13") OR { 1752} (segid " " and resid "70 " and name "HN ") (segid " " and resid "70 " and name "HG23") ASSI { 1754} (segid " " and resid "70 " and name "HN ") (segid " " and resid "70 " and name "HA ") 5.000 5.000 0.000 peak 1754 weight 0.10000E+01 volume 0.77900E+00 ppm1 9.133 ppm2 4.391 OR { 1754} (segid " " and resid "70 " and name "HN ") (segid " " and resid "42 " and name "HA ") ASSI { 1751} (segid " " and resid "70 " and name "HN ") (segid " " and resid "69 " and name "HA ") 2.700 2.700 0.000 peak 1751 weight 0.10000E+01 volume 0.45420E+01 ppm1 9.132 ppm2 5.068 ASSI { 1757} (segid " " and resid "70 " and name "HN ") (segid " " and resid "69 " and name "HG ") 5.000 5.000 0.000 peak 1757 weight 0.10000E+01 volume 0.46300E+00 ppm1 9.132 ppm2 1.446 OR { 1757} (segid " " and resid "70 " and name "HN ") (segid " " and resid "42 " and name "HG1 ") ASSI { 1755} (segid " " and resid "70 " and name "HN ") (segid " " and resid "70 " and name "HB ") 5.000 5.000 0.000 peak 1755 weight 0.10000E+01 volume 0.82100E+00 ppm1 9.132 ppm2 2.082 ASSI { 1432} (segid " " and resid "43 " and name "HN ") (segid " " and resid "42 " and name "HD1 ") 6.000 6.000 0.000 peak 1432 weight 0.10000E+01 volume 0.92000E-01 ppm1 8.904 ppm2 3.087 OR { 1432} (segid " " and resid "43 " and name "HN ") (segid " " and resid "42 " and name "HD2 ") ASSI { 1431} (segid " " and resid "43 " and name "HN ") (segid " " and resid "42 " and name "HG2 ") 6.000 6.000 0.000 peak 1431 weight 0.10000E+01 volume 0.27200E+00 ppm1 8.905 ppm2 1.280 ASSI { 1430} (segid " " and resid "43 " and name "HN ") (segid " " and resid "49 " and name "HG2 ") 6.000 6.000 0.000 peak 1430 weight 0.10000E+01 volume 0.21300E+00 ppm1 8.903 ppm2 2.257 OR { 1430} (segid " " and resid "43 " and name "HN ") (segid " " and resid "49 " and name "HG1 ") ASSI { 1428} (segid " " and resid "43 " and name "HN ") (segid " " and resid "43 " and name "HB1 ") 5.000 5.000 0.000 peak 1428 weight 0.10000E+01 volume 0.73100E+00 ppm1 8.904 ppm2 1.025 OR { 1428} (segid " " and resid "43 " and name "HN ") (segid " " and resid "67 " and name "HG22") OR { 1428} (segid " " and resid "43 " and name "HN ") (segid " " and resid "67 " and name "HG21") OR { 1428} (segid " " and resid "43 " and name "HN ") (segid " " and resid "67 " and name "HG23") ASSI { 1425} (segid " " and resid "43 " and name "HN ") (segid " " and resid "43 " and name "HB2 ") 5.000 5.000 0.000 peak 1425 weight 0.10000E+01 volume 0.18470E+01 ppm1 8.903 ppm2 1.733 OR { 1425} (segid " " and resid "43 " and name "HN ") (segid " " and resid "42 " and name "HB1 ") ASSI { 1424} (segid " " and resid "43 " and name "HN ") (segid " " and resid "42 " and name "HA ") 2.700 2.700 0.000 peak 1424 weight 0.10000E+01 volume 0.43450E+01 ppm1 8.903 ppm2 4.426 ASSI { 1427} (segid " " and resid "43 " and name "HN ") (segid " " and resid "43 " and name "HA ") 5.000 5.000 0.000 peak 1427 weight 0.10000E+01 volume 0.59000E+00 ppm1 8.903 ppm2 5.343 ASSI { 1429} (segid " " and resid "43 " and name "HN ") (segid " " and resid "43 " and name "HD23") 5.000 5.000 0.000 peak 1429 weight 0.10000E+01 volume 0.68700E+00 ppm1 8.903 ppm2 0.775 OR { 1429} (segid " " and resid "43 " and name "HN ") (segid " " and resid "43 " and name "HD21") OR { 1429} (segid " " and resid "43 " and name "HN ") (segid " " and resid "43 " and name "HD22") OR { 1429} (segid " " and resid "43 " and name "HN ") (segid " " and resid "43 " and name "HD12") OR { 1429} (segid " " and resid "43 " and name "HN ") (segid " " and resid "43 " and name "HD13") ASSI { 1426} (segid " " and resid "43 " and name "HN ") (segid " " and resid "43 " and name "HG ") 5.000 5.000 0.000 peak 1426 weight 0.10000E+01 volume 0.18010E+01 ppm1 8.903 ppm2 1.483 OR { 1426} (segid " " and resid "43 " and name "HN ") (segid " " and resid "42 " and name "HG1 ") ASSI { 1740} (segid " " and resid "68 " and name "HN ") (segid " " and resid "6 " and name "HG2 ") 6.000 6.000 0.000 peak 1740 weight 0.10000E+01 volume 0.88000E-01 ppm1 9.355 ppm2 1.233 OR { 1740} (segid " " and resid "68 " and name "HN ") (segid " " and resid "69 " and name "HB2 ") OR { 1740} (segid " " and resid "68 " and name "HN ") (segid " " and resid "42 " and name "HG2 ") ASSI { 1732} (segid " " and resid "68 " and name "HN ") (segid " " and resid "67 " and name "HG23") 5.000 5.000 0.000 peak 1732 weight 0.10000E+01 volume 0.16180E+01 ppm1 9.356 ppm2 0.969 OR { 1732} (segid " " and resid "68 " and name "HN ") (segid " " and resid "67 " and name "HG21") OR { 1732} (segid " " and resid "68 " and name "HN ") (segid " " and resid "67 " and name "HG22") ASSI { 1730} (segid " " and resid "68 " and name "HN ") (segid " " and resid "67 " and name "HA ") 3.300 3.300 0.000 peak 1730 weight 0.10000E+01 volume 0.32560E+01 ppm1 9.355 ppm2 4.710 ASSI { 1736} (segid " " and resid "68 " and name "HN ") (segid " " and resid "68 " and name "HD2 ") 5.000 5.000 0.000 peak 1736 weight 0.10000E+01 volume 0.30900E+00 ppm1 9.355 ppm2 7.079 ASSI { 1734} (segid " " and resid "68 " and name "HN ") (segid " " and resid "68 " and name "HA ") 5.000 5.000 0.000 peak 1734 weight 0.10000E+01 volume 0.59600E+00 ppm1 9.355 ppm2 4.983 ASSI { 1731} (segid " " and resid "68 " and name "HN ") (segid " " and resid "68 " and name "HB2 ") 3.300 3.300 0.000 peak 1731 weight 0.10000E+01 volume 0.22600E+01 ppm1 9.355 ppm2 3.101 OR { 1731} (segid " " and resid "68 " and name "HN ") (segid " " and resid "68 " and name "HB1 ") ASSI { 1735} (segid " " and resid "68 " and name "HN ") (segid " " and resid "44 " and name "HB ") 5.000 5.000 0.000 peak 1735 weight 0.10000E+01 volume 0.47200E+00 ppm1 9.355 ppm2 1.799 ASSI { 1737} (segid " " and resid "68 " and name "HN ") (segid " " and resid "44 " and name "HD11") 5.000 5.000 0.000 peak 1737 weight 0.10000E+01 volume 0.32900E+00 ppm1 9.355 ppm2 0.698 OR { 1737} (segid " " and resid "68 " and name "HN ") (segid " " and resid "44 " and name "HG23") OR { 1737} (segid " " and resid "68 " and name "HN ") (segid " " and resid "44 " and name "HG21") OR { 1737} (segid " " and resid "68 " and name "HN ") (segid " " and resid "44 " and name "HG22") OR { 1737} (segid " " and resid "68 " and name "HN ") (segid " " and resid "44 " and name "HD12") OR { 1737} (segid " " and resid "68 " and name "HN ") (segid " " and resid "67 " and name "HD11") OR { 1737} (segid " " and resid "68 " and name "HN ") (segid " " and resid "67 " and name "HD13") ASSI { 1738} (segid " " and resid "68 " and name "HN ") (segid " " and resid "45 " and name "HA ") 6.000 6.000 0.000 peak 1738 weight 0.10000E+01 volume 0.16200E+00 ppm1 9.355 ppm2 5.246 ASSI { 1739} (segid " " and resid "68 " and name "HN ") (segid " " and resid "67 " and name "HG11") 6.000 6.000 0.000 peak 1739 weight 0.10000E+01 volume 0.11200E+00 ppm1 9.356 ppm2 1.457 ASSI { 1629} (segid " " and resid "60 " and name "HN ") (segid " " and resid "59 " and name "HB1 ") 6.000 6.000 0.000 peak 1629 weight 0.10000E+01 volume 0.88000E-01 ppm1 8.136 ppm2 3.505 ASSI { 1631} (segid " " and resid "60 " and name "HN ") (segid " " and resid "61 " and name "HD13") 6.000 6.000 0.000 peak 1631 weight 0.10000E+01 volume 0.35000E-01 ppm1 8.130 ppm2 0.360 OR { 1631} (segid " " and resid "60 " and name "HN ") (segid " " and resid "61 " and name "HD12") OR { 1631} (segid " " and resid "60 " and name "HN ") (segid " " and resid "61 " and name "HD11") OR { 1631} (segid " " and resid "60 " and name "HN ") (segid " " and resid "61 " and name "HG21") ASSI { 1625} (segid " " and resid "60 " and name "HN ") (segid " " and resid "60 " and name "HB2 ") 5.000 5.000 0.000 peak 1625 weight 0.10000E+01 volume 0.47200E+00 ppm1 8.132 ppm2 2.856 ASSI { 1628} (segid " " and resid "60 " and name "HN ") (segid " " and resid "61 " and name "HB ") 6.000 6.000 0.000 peak 1628 weight 0.10000E+01 volume 0.13700E+00 ppm1 8.132 ppm2 1.085 OR { 1628} (segid " " and resid "60 " and name "HN ") (segid " " and resid "56 " and name "HB1 ") ASSI { 1626} (segid " " and resid "60 " and name "HN ") (segid " " and resid "60 " and name "HB1 ") 6.000 6.000 0.000 peak 1626 weight 0.10000E+01 volume 0.26100E+00 ppm1 8.132 ppm2 3.293 ASSI { 1632} (segid " " and resid "60 " and name "HN ") (segid " " and resid "58 " and name "HB1 ") 6.000 6.000 0.000 peak 1632 weight 0.10000E+01 volume 0.44000E-01 ppm1 8.131 ppm2 2.326 OR { 1632} (segid " " and resid "60 " and name "HN ") (segid " " and resid "62 " and name "HG2 ") OR { 1632} (segid " " and resid "60 " and name "HN ") (segid " " and resid "62 " and name "HG1 ") OR { 1632} (segid " " and resid "60 " and name "HN ") (segid " " and resid "19 " and name "HB1 ") ASSI { 1627} (segid " " and resid "60 " and name "HN ") (segid " " and resid "59 " and name "HB2 ") 6.000 6.000 0.000 peak 1627 weight 0.10000E+01 volume 0.19500E+00 ppm1 8.132 ppm2 2.617 ASSI { 1621} (segid " " and resid "60 " and name "HN ") (segid " " and resid "60 " and name "HA ") 2.700 2.700 0.000 peak 1621 weight 0.10000E+01 volume 0.41340E+01 ppm1 8.132 ppm2 4.370 ASSI { 1398} (segid " " and resid "41 " and name "HE21") (segid " " and resid "30 " and name "HD13") 6.000 6.000 0.000 peak 1398 weight 0.10000E+01 volume 0.50000E-01 ppm1 6.564 ppm2 0.023 OR { 1398} (segid " " and resid "41 " and name "HE21") (segid " " and resid "30 " and name "HD12") OR { 1398} (segid " " and resid "41 " and name "HE21") (segid " " and resid "30 " and name "HD11") ASSI { 1388} (segid " " and resid "41 " and name "HE21") (segid " " and resid "38 " and name "HA ") 6.000 6.000 0.000 peak 1388 weight 0.10000E+01 volume 0.27100E+00 ppm1 6.569 ppm2 4.069 ASSI { 1393} (segid " " and resid "41 " and name "HE21") (segid " " and resid "36 " and name "HB ") 6.000 6.000 0.000 peak 1393 weight 0.10000E+01 volume 0.25100E+00 ppm1 6.568 ppm2 1.433 OR { 1393} (segid " " and resid "41 " and name "HE21") (segid " " and resid "27 " and name "HB1 ") ASSI { 1403} (segid " " and resid "41 " and name "HE22") (segid " " and resid "69 " and name "HD13") 6.000 6.000 0.000 peak 1403 weight 0.10000E+01 volume 0.28300E+00 ppm1 6.416 ppm2 0.877 OR { 1403} (segid " " and resid "41 " and name "HE22") (segid " " and resid "69 " and name "HD12") OR { 1403} (segid " " and resid "41 " and name "HE22") (segid " " and resid "69 " and name "HD11") OR { 1403} (segid " " and resid "41 " and name "HE22") (segid " " and resid "36 " and name "HG23") OR { 1403} (segid " " and resid "41 " and name "HE22") (segid " " and resid "36 " and name "HG21") OR { 1403} (segid " " and resid "41 " and name "HE22") (segid " " and resid "36 " and name "HG22") ASSI { 1389} (segid " " and resid "41 " and name "HE21") (segid " " and resid "41 " and name "HG2 ") 5.000 5.000 0.000 peak 1389 weight 0.10000E+01 volume 0.39200E+00 ppm1 6.568 ppm2 1.599 ASSI { 1405} (segid " " and resid "41 " and name "HE22") (segid " " and resid "27 " and name "HB1 ") 5.000 5.000 0.000 peak 1405 weight 0.10000E+01 volume 0.32900E+00 ppm1 6.417 ppm2 1.461 OR { 1405} (segid " " and resid "41 " and name "HE22") (segid " " and resid "36 " and name "HB ") ASSI { 1408} (segid " " and resid "41 " and name "HE22") (segid " " and resid "27 " and name "HA ") 6.000 6.000 0.000 peak 1408 weight 0.10000E+01 volume 0.74000E-01 ppm1 6.416 ppm2 4.368 ASSI { 1404} (segid " " and resid "41 " and name "HE22") (segid " " and resid "30 " and name "HG23") 6.000 6.000 0.000 peak 1404 weight 0.10000E+01 volume 0.20100E+00 ppm1 6.417 ppm2 0.515 OR { 1404} (segid " " and resid "41 " and name "HE22") (segid " " and resid "30 " and name "HG22") ASSI { 1402} (segid " " and resid "41 " and name "HE22") (segid " " and resid "38 " and name "HG2 ") 5.000 5.000 0.000 peak 1402 weight 0.10000E+01 volume 0.55900E+00 ppm1 6.417 ppm2 1.597 OR { 1402} (segid " " and resid "41 " and name "HE22") (segid " " and resid "41 " and name "HG2 ") OR { 1402} (segid " " and resid "41 " and name "HE22") (segid " " and resid "27 " and name "HD2 ") OR { 1402} (segid " " and resid "41 " and name "HE22") (segid " " and resid "27 " and name "HD1 ") ASSI { 1401} (segid " " and resid "41 " and name "HE22") (segid " " and resid "30 " and name "HB ") 5.000 5.000 0.000 peak 1401 weight 0.10000E+01 volume 0.53900E+00 ppm1 6.417 ppm2 1.954 ASSI { 1400} (segid " " and resid "41 " and name "HE22") (segid " " and resid "38 " and name "HA ") 5.000 5.000 0.000 peak 1400 weight 0.10000E+01 volume 0.43200E+00 ppm1 6.417 ppm2 4.065 ASSI { 1386} (segid " " and resid "41 " and name "HE21") (segid " " and resid "41 " and name "HB2 ") 5.000 5.000 0.000 peak 1386 weight 0.10000E+01 volume 0.90700E+00 ppm1 6.568 ppm2 1.975 OR { 1386} (segid " " and resid "41 " and name "HE21") (segid " " and resid "30 " and name "HB ") OR { 1386} (segid " " and resid "41 " and name "HE21") (segid " " and resid "27 " and name "HB2 ") ASSI { 1395} (segid " " and resid "41 " and name "HE21") (segid " " and resid "31 " and name "HA ") 6.000 6.000 0.000 peak 1395 weight 0.10000E+01 volume 0.11000E+00 ppm1 6.568 ppm2 3.752 OR { 1395} (segid " " and resid "41 " and name "HE21") (segid " " and resid "38 " and name "HD1 ") ASSI { 1392} (segid " " and resid "41 " and name "HE21") (segid " " and resid "27 " and name "HA ") 6.000 6.000 0.000 peak 1392 weight 0.10000E+01 volume 0.26800E+00 ppm1 6.568 ppm2 4.361 ASSI { 1382} (segid " " and resid "41 " and name "HE21") (segid " " and resid "41 " and name "HE22") 3.300 3.300 0.000 peak 1382 weight 0.10000E+01 volume 0.33620E+01 ppm1 6.568 ppm2 6.407 ASSI { 1387} (segid " " and resid "41 " and name "HE21") (segid " " and resid "41 " and name "HG1 ") 5.000 5.000 0.000 peak 1387 weight 0.10000E+01 volume 0.38500E+00 ppm1 6.568 ppm2 2.486 ASSI { 1399} (segid " " and resid "41 " and name "HE22") (segid " " and resid "41 " and name "HG1 ") 5.000 5.000 0.000 peak 1399 weight 0.10000E+01 volume 0.76600E+00 ppm1 6.417 ppm2 2.489 ASSI { 1407} (segid " " and resid "41 " and name "HE22") (segid " " and resid "31 " and name "HA ") 6.000 6.000 0.000 peak 1407 weight 0.10000E+01 volume 0.11300E+00 ppm1 6.417 ppm2 3.746 ASSI { 1391} (segid " " and resid "41 " and name "HE21") (segid " " and resid "30 " and name "HG23") 6.000 6.000 0.000 peak 1391 weight 0.10000E+01 volume 0.29100E+00 ppm1 6.568 ppm2 0.518 OR { 1391} (segid " " and resid "41 " and name "HE21") (segid " " and resid "30 " and name "HG22") ASSI { 1394} (segid " " and resid "41 " and name "HE21") (segid " " and resid "36 " and name "HG23") 6.000 6.000 0.000 peak 1394 weight 0.10000E+01 volume 0.16400E+00 ppm1 6.570 ppm2 0.868 OR { 1394} (segid " " and resid "41 " and name "HE21") (segid " " and resid "36 " and name "HG21") OR { 1394} (segid " " and resid "41 " and name "HE21") (segid " " and resid "36 " and name "HG22") ASSI { 1796} (segid " " and resid "76 " and name "HN ") (segid " " and resid "76 " and name "HA2 ") 6.000 6.000 0.000 peak 1796 weight 0.10000E+01 volume 0.17700E+00 ppm1 7.945 ppm2 3.719 ASSI { 1797} (segid " " and resid "76 " and name "HN ") (segid " " and resid "75 " and name "HA2 ") 6.000 6.000 0.000 peak 1797 weight 0.10000E+01 volume 0.12400E+00 ppm1 7.944 ppm2 3.973 OR { 1797} (segid " " and resid "76 " and name "HN ") (segid " " and resid "75 " and name "HA1 ") ASSI { 1798} (segid " " and resid "76 " and name "HN ") (segid " " and resid "75 " and name "HN ") 6.000 6.000 0.000 peak 1798 weight 0.10000E+01 volume 0.15300E+00 ppm1 7.944 ppm2 8.475 ASSI { 1122} (segid " " and resid "20 " and name "HN ") (segid " " and resid "18 " and name "HB1 ") 5.000 5.000 0.000 peak 1122 weight 0.10000E+01 volume 0.12980E+01 ppm1 7.069 ppm2 2.080 ASSI { 1124} (segid " " and resid "20 " and name "HN ") (segid " " and resid "18 " and name "HB2 ") 5.000 5.000 0.000 peak 1124 weight 0.10000E+01 volume 0.54800E+00 ppm1 7.069 ppm2 1.656 OR { 1124} (segid " " and resid "20 " and name "HN ") (segid " " and resid "56 " and name "HG ") ASSI { 1125} (segid " " and resid "20 " and name "HN ") (segid " " and resid "19 " and name "HA ") 5.000 5.000 0.000 peak 1125 weight 0.10000E+01 volume 0.78100E+00 ppm1 7.070 ppm2 4.029 OR { 1125} (segid " " and resid "20 " and name "HN ") (segid " " and resid "19 " and name "HD1 ") ASSI { 1126} (segid " " and resid "20 " and name "HN ") (segid " " and resid "19 " and name "HB1 ") 6.000 6.000 0.000 peak 1126 weight 0.10000E+01 volume 0.26900E+00 ppm1 7.071 ppm2 2.329 ASSI { 1121} (segid " " and resid "20 " and name "HN ") (segid " " and resid "20 " and name "HB1 ") 5.000 5.000 0.000 peak 1121 weight 0.10000E+01 volume 0.10810E+01 ppm1 7.069 ppm2 3.764 OR { 1121} (segid " " and resid "20 " and name "HN ") (segid " " and resid "19 " and name "HD2 ") ASSI { 1131} (segid " " and resid "20 " and name "HN ") (segid " " and resid "56 " and name "HN ") 6.000 6.000 0.000 peak 1131 weight 0.10000E+01 volume 0.48000E-01 ppm1 7.071 ppm2 8.520 OR { 1131} (segid " " and resid "20 " and name "HN ") (segid " " and resid "18 " and name "HN ") ASSI { 1123} (segid " " and resid "20 " and name "HN ") (segid " " and resid "20 " and name "HA ") 5.000 5.000 0.000 peak 1123 weight 0.10000E+01 volume 0.65100E+00 ppm1 7.069 ppm2 4.378 ASSI { 1132} (segid " " and resid "20 " and name "HN ") (segid " " and resid "21 " and name "HB2 ") 6.000 6.000 0.000 peak 1132 weight 0.10000E+01 volume 0.47000E-01 ppm1 7.068 ppm2 2.903 ASSI { 1128} (segid " " and resid "20 " and name "HN ") (segid " " and resid "18 " and name "HA ") 6.000 6.000 0.000 peak 1128 weight 0.10000E+01 volume 0.97000E-01 ppm1 7.070 ppm2 5.018 ASSI { 1129} (segid " " and resid "20 " and name "HN ") (segid " " and resid "21 " and name "HA ") 6.000 6.000 0.000 peak 1129 weight 0.10000E+01 volume 0.88000E-01 ppm1 7.070 ppm2 4.712 ASSI { 1003} (segid " " and resid "6 " and name "HN ") (segid " " and resid "69 " and name "HN ") 6.000 6.000 0.000 peak 1003 weight 0.10000E+01 volume 0.19900E+00 ppm1 8.876 ppm2 8.276 ASSI { 997} (segid " " and resid "6 " and name "HN ") (segid " " and resid "68 " and name "HA ") 5.000 5.000 0.000 peak 997 weight 0.10000E+01 volume 0.61700E+00 ppm1 8.875 ppm2 4.981 ASSI { 1000} (segid " " and resid "6 " and name "HN ") (segid " " and resid "6 " and name "HA ") 5.000 5.000 0.000 peak 1000 weight 0.10000E+01 volume 0.44100E+00 ppm1 8.874 ppm2 5.207 ASSI { 999} (segid " " and resid "6 " and name "HN ") (segid " " and resid "5 " and name "HD12") 5.000 5.000 0.000 peak 999 weight 0.10000E+01 volume 0.47000E+00 ppm1 8.875 ppm2 0.725 OR { 999} (segid " " and resid "6 " and name "HN ") (segid " " and resid "5 " and name "HD11") OR { 999} (segid " " and resid "6 " and name "HN ") (segid " " and resid "5 " and name "HD13") ASSI { 1004} (segid " " and resid "6 " and name "HN ") (segid " " and resid "67 " and name "HN ") 6.000 6.000 0.000 peak 1004 weight 0.10000E+01 volume 0.21300E+00 ppm1 8.875 ppm2 9.447 OR { 1004} (segid " " and resid "6 " and name "HN ") (segid " " and resid "5 " and name "HN ") ASSI { 998} (segid " " and resid "6 " and name "HN ") (segid " " and resid "6 " and name "HB1 ") 5.000 5.000 0.000 peak 998 weight 0.10000E+01 volume 0.60400E+00 ppm1 8.875 ppm2 1.638 ASSI { 1005} (segid " " and resid "6 " and name "HN ") (segid " " and resid "68 " and name "HB1 ") 6.000 6.000 0.000 peak 1005 weight 0.10000E+01 volume 0.53000E-01 ppm1 8.876 ppm2 3.099 OR { 1005} (segid " " and resid "6 " and name "HN ") (segid " " and resid "68 " and name "HB2 ") OR { 1005} (segid " " and resid "6 " and name "HN ") (segid " " and resid "4 " and name "HB2 ") ASSI { 1001} (segid " " and resid "6 " and name "HN ") (segid " " and resid "66 " and name "HG23") 6.000 6.000 0.000 peak 1001 weight 0.10000E+01 volume 0.29800E+00 ppm1 8.874 ppm2 0.943 OR { 1001} (segid " " and resid "6 " and name "HN ") (segid " " and resid "66 " and name "HG22") OR { 1001} (segid " " and resid "6 " and name "HN ") (segid " " and resid "66 " and name "HG21") OR { 1001} (segid " " and resid "6 " and name "HN ") (segid " " and resid "13 " and name "HG13") OR { 1001} (segid " " and resid "6 " and name "HN ") (segid " " and resid "67 " and name "HG22") OR { 1001} (segid " " and resid "6 " and name "HN ") (segid " " and resid "67 " and name "HG21") OR { 1001} (segid " " and resid "6 " and name "HN ") (segid " " and resid "67 " and name "HG23") ASSI { 996} (segid " " and resid "6 " and name "HN ") (segid " " and resid "6 " and name "HB2 ") 5.000 5.000 0.000 peak 996 weight 0.10000E+01 volume 0.10440E+01 ppm1 8.875 ppm2 1.325 OR { 996} (segid " " and resid "6 " and name "HN ") (segid " " and resid "5 " and name "HG ") ASSI { 995} (segid " " and resid "6 " and name "HN ") (segid " " and resid "5 " and name "HA ") 3.300 3.300 0.000 peak 995 weight 0.10000E+01 volume 0.25200E+01 ppm1 8.875 ppm2 5.440 ASSI { 1002} (segid " " and resid "6 " and name "HN ") (segid " " and resid "5 " and name "HB1 ") 6.000 6.000 0.000 peak 1002 weight 0.10000E+01 volume 0.20500E+00 ppm1 8.874 ppm2 1.875 OR { 1002} (segid " " and resid "6 " and name "HN ") (segid " " and resid "69 " and name "HB1 ") OR { 1002} (segid " " and resid "6 " and name "HN ") (segid " " and resid "67 " and name "HB ") ASSI { 3345} (segid " " and resid "46 " and name "HB1 ") (segid " " and resid "48 " and name "HG1 ") 6.000 6.000 0.000 peak 3345 weight 0.10000E+01 volume -0.43000E-01 ppm1 0.809 ppm2 1.599 OR { 3345} (segid " " and resid "46 " and name "HB3 ") (segid " " and resid "48 " and name "HG1 ") OR { 3345} (segid " " and resid "46 " and name "HB2 ") (segid " " and resid "48 " and name "HG1 ") ASSI { 1385} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "61 " and name "HG22") 2.700 2.700 0.000 peak 1385 weight 0.10000E+01 volume -0.53910E+01 ppm1 1.521 ppm2 0.366 OR { 1385} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "61 " and name "HG21") OR { 1385} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "61 " and name "HG22") OR { 1385} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "61 " and name "HG21") OR { 1385} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "56 " and name "HD11") OR { 1385} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "61 " and name "HG23") OR { 1385} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "17 " and name "HG23") OR { 1385} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "61 " and name "HG23") OR { 1385} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "61 " and name "HG23") OR { 1385} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "56 " and name "HD13") OR { 1385} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "56 " and name "HD13") OR { 1385} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "17 " and name "HG23") OR { 1385} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "17 " and name "HG21") OR { 1385} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "56 " and name "HD13") ASSI { 1981} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "1 " and name "HA ") 6.000 6.000 0.000 peak 1981 weight 0.10000E+01 volume -0.14900E+00 ppm1 1.520 ppm2 4.182 OR { 1981} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "1 " and name "HA ") OR { 1981} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "3 " and name "HA ") OR { 1981} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "3 " and name "HA ") OR { 1981} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "3 " and name "HA ") ASSI { 2247} (segid " " and resid "13 " and name "HG23") (segid " " and resid "33 " and name "HE2 ") 6.000 6.000 0.000 peak 2247 weight 0.10000E+01 volume -0.27000E+00 ppm1 0.888 ppm2 3.101 OR { 2247} (segid " " and resid "13 " and name "HG22") (segid " " and resid "33 " and name "HE1 ") OR { 2247} (segid " " and resid "13 " and name "HG23") (segid " " and resid "33 " and name "HE1 ") ASSI { 2216} (segid " " and resid "13 " and name "HG11") (segid " " and resid "13 " and name "HB ") 3.300 3.300 0.000 peak 2216 weight 0.10000E+01 volume -0.20790E+01 ppm1 0.967 ppm2 2.153 OR { 2216} (segid " " and resid "13 " and name "HG13") (segid " " and resid "13 " and name "HB ") OR { 2216} (segid " " and resid "13 " and name "HG12") (segid " " and resid "13 " and name "HB ") ASSI { 4033} (segid " " and resid "66 " and name "HG23") (segid " " and resid "6 " and name "HD2 ") 5.000 5.000 0.000 peak 4033 weight 0.10000E+01 volume -0.98800E+00 ppm1 0.927 ppm2 1.520 OR { 4033} (segid " " and resid "66 " and name "HG21") (segid " " and resid "6 " and name "HD1 ") OR { 4033} (segid " " and resid "66 " and name "HG21") (segid " " and resid "6 " and name "HD2 ") OR { 4033} (segid " " and resid "66 " and name "HG22") (segid " " and resid "6 " and name "HD2 ") OR { 4033} (segid " " and resid "66 " and name "HG23") (segid " " and resid "6 " and name "HD1 ") OR { 4033} (segid " " and resid "66 " and name "HG22") (segid " " and resid "6 " and name "HD1 ") ASSI { 4043} (segid " " and resid "66 " and name "HG22") (segid " " and resid "6 " and name "HE2 ") 5.000 5.000 0.000 peak 4043 weight 0.10000E+01 volume -0.50500E+00 ppm1 0.941 ppm2 2.890 OR { 4043} (segid " " and resid "13 " and name "HG13") (segid " " and resid "11 " and name "HE1 ") OR { 4043} (segid " " and resid "66 " and name "HG21") (segid " " and resid "6 " and name "HE2 ") OR { 4043} (segid " " and resid "66 " and name "HG23") (segid " " and resid "6 " and name "HE2 ") OR { 4043} (segid " " and resid "13 " and name "HG11") (segid " " and resid "11 " and name "HE1 ") OR { 4043} (segid " " and resid "66 " and name "HG22") (segid " " and resid "6 " and name "HE1 ") ASSI { 2214} (segid " " and resid "70 " and name "HG13") (segid " " and resid "70 " and name "HG21") 2.700 2.700 0.000 peak 2214 weight 0.10000E+01 volume -0.60730E+01 ppm1 0.927 ppm2 0.809 OR { 2214} (segid " " and resid "70 " and name "HG11") (segid " " and resid "70 " and name "HG22") OR { 2214} (segid " " and resid "70 " and name "HG11") (segid " " and resid "70 " and name "HG23") OR { 2214} (segid " " and resid "70 " and name "HG11") (segid " " and resid "70 " and name "HG21") OR { 2214} (segid " " and resid "70 " and name "HG13") (segid " " and resid "70 " and name "HG23") OR { 2214} (segid " " and resid "70 " and name "HG12") (segid " " and resid "70 " and name "HG22") OR { 2214} (segid " " and resid "70 " and name "HG13") (segid " " and resid "70 " and name "HG22") OR { 2214} (segid " " and resid "70 " and name "HG12") (segid " " and resid "70 " and name "HG21") ASSI { 2231} (segid " " and resid "70 " and name "HG13") (segid " " and resid "70 " and name "HB ") 3.300 3.300 0.000 peak 2231 weight 0.10000E+01 volume -0.21050E+01 ppm1 0.927 ppm2 2.074 OR { 2231} (segid " " and resid "70 " and name "HG12") (segid " " and resid "70 " and name "HB ") OR { 2231} (segid " " and resid "70 " and name "HG11") (segid " " and resid "70 " and name "HB ") ASSI { 4695} (segid " " and resid "7 " and name "HG21") (segid " " and resid "11 " and name "HB2 ") 5.000 5.000 0.000 peak 4695 weight 0.10000E+01 volume -0.79300E+00 ppm1 1.165 ppm2 1.635 OR { 4695} (segid " " and resid "7 " and name "HG23") (segid " " and resid "11 " and name "HB2 ") OR { 4695} (segid " " and resid "7 " and name "HG22") (segid " " and resid "11 " and name "HB2 ") OR { 4695} (segid " " and resid "7 " and name "HG22") (segid " " and resid "11 " and name "HD2 ") ASSI { 4070} (segid " " and resid "71 " and name "HD21") (segid " " and resid "8 " and name "HD13") 5.000 5.000 0.000 peak 4070 weight 0.10000E+01 volume -0.44100E+00 ppm1 0.861 ppm2 1.046 OR { 4070} (segid " " and resid "71 " and name "HD23") (segid " " and resid "8 " and name "HD12") OR { 4070} (segid " " and resid "71 " and name "HD21") (segid " " and resid "8 " and name "HD12") OR { 4070} (segid " " and resid "71 " and name "HD22") (segid " " and resid "8 " and name "HD11") OR { 4070} (segid " " and resid "71 " and name "HD22") (segid " " and resid "8 " and name "HD12") ASSI { 2908} (segid " " and resid "33 " and name "HG1 ") (segid " " and resid "33 " and name "HD2 ") 2.700 2.700 0.000 peak 2908 weight 0.10000E+01 volume -0.47680E+01 ppm1 1.599 ppm2 1.705 OR { 2908} (segid " " and resid "33 " and name "HG2 ") (segid " " and resid "33 " and name "HD1 ") OR { 2908} (segid " " and resid "33 " and name "HG2 ") (segid " " and resid "33 " and name "HD2 ") OR { 2908} (segid " " and resid "33 " and name "HG1 ") (segid " " and resid "33 " and name "HD1 ") ASSI { 2700} (segid " " and resid "27 " and name "HG2 ") (segid " " and resid "43 " and name "HD12") 5.000 5.000 0.000 peak 2700 weight 0.10000E+01 volume -0.78200E+00 ppm1 1.547 ppm2 0.809 OR { 2700} (segid " " and resid "27 " and name "HG2 ") (segid " " and resid "43 " and name "HD13") OR { 2700} (segid " " and resid "27 " and name "HG2 ") (segid " " and resid "43 " and name "HD11") OR { 2700} (segid " " and resid "27 " and name "HG2 ") (segid " " and resid "23 " and name "HG13") ASSI { 2701} (segid " " and resid "27 " and name "HG2 ") (segid " " and resid "27 " and name "HB2 ") 5.000 5.000 0.000 peak 2701 weight 0.10000E+01 volume -0.63000E+00 ppm1 1.547 ppm2 2.021 ASSI { 2702} (segid " " and resid "29 " and name "HG2 ") (segid " " and resid "29 " and name "HB2 ") 5.000 5.000 0.000 peak 2702 weight 0.10000E+01 volume -0.55200E+00 ppm1 1.573 ppm2 2.205 ASSI { 3510} (segid " " and resid "56 " and name "HG ") (segid " " and resid "21 " and name "HB2 ") 6.000 6.000 0.000 peak 3510 weight 0.10000E+01 volume -0.20400E+00 ppm1 1.665 ppm2 2.917 ASSI { 3503} (segid " " and resid "71 " and name "HG ") (segid " " and resid "71 " and name "HD22") 5.000 5.000 0.000 peak 3503 weight 0.10000E+01 volume -0.15870E+01 ppm1 1.639 ppm2 0.888 OR { 3503} (segid " " and resid "73 " and name "HG ") (segid " " and resid "73 " and name "HD23") OR { 3503} (segid " " and resid "73 " and name "HG ") (segid " " and resid "73 " and name "HD11") OR { 3503} (segid " " and resid "73 " and name "HG ") (segid " " and resid "73 " and name "HD13") OR { 3503} (segid " " and resid "71 " and name "HG ") (segid " " and resid "71 " and name "HD23") OR { 3503} (segid " " and resid "73 " and name "HG ") (segid " " and resid "73 " and name "HD22") OR { 3503} (segid " " and resid "73 " and name "HG ") (segid " " and resid "73 " and name "HD21") OR { 3503} (segid " " and resid "71 " and name "HG ") (segid " " and resid "71 " and name "HD21") OR { 3503} (segid " " and resid "73 " and name "HG ") (segid " " and resid "73 " and name "HD12") OR { 3503} (segid " " and resid "71 " and name "HG ") (segid " " and resid "36 " and name "HG22") OR { 3503} (segid " " and resid "71 " and name "HG ") (segid " " and resid "36 " and name "HG23") ASSI { 3506} (segid " " and resid "54 " and name "HG2 ") (segid " " and resid "54 " and name "HD2 ") 5.000 5.000 0.000 peak 3506 weight 0.10000E+01 volume -0.77200E+00 ppm1 1.665 ppm2 3.180 OR { 3506} (segid " " and resid "74 " and name "HG2 ") (segid " " and resid "74 " and name "HD1 ") OR { 3506} (segid " " and resid "54 " and name "HG2 ") (segid " " and resid "54 " and name "HD1 ") OR { 3506} (segid " " and resid "74 " and name "HG1 ") (segid " " and resid "74 " and name "HD2 ") OR { 3506} (segid " " and resid "74 " and name "HG2 ") (segid " " and resid "74 " and name "HD2 ") OR { 3506} (segid " " and resid "74 " and name "HG1 ") (segid " " and resid "74 " and name "HD1 ") ASSI { 4106} (segid " " and resid "73 " and name "HG ") (segid " " and resid "73 " and name "HA ") 6.000 6.000 0.000 peak 4106 weight 0.10000E+01 volume -0.29500E+00 ppm1 1.612 ppm2 4.392 ASSI { 2300} (segid " " and resid "44 " and name "HG11") (segid " " and resid "44 " and name "HG21") 3.300 3.300 0.000 peak 2300 weight 0.10000E+01 volume -0.25250E+01 ppm1 1.375 ppm2 0.677 OR { 2300} (segid " " and resid "15 " and name "HG11") (segid " " and resid "15 " and name "HD11") OR { 2300} (segid " " and resid "44 " and name "HG11") (segid " " and resid "44 " and name "HD11") OR { 2300} (segid " " and resid "44 " and name "HG11") (segid " " and resid "44 " and name "HD12") OR { 2300} (segid " " and resid "15 " and name "HG11") (segid " " and resid "15 " and name "HD13") OR { 2300} (segid " " and resid "15 " and name "HG11") (segid " " and resid "15 " and name "HD12") OR { 2300} (segid " " and resid "44 " and name "HG11") (segid " " and resid "44 " and name "HD13") OR { 2300} (segid " " and resid "44 " and name "HG11") (segid " " and resid "44 " and name "HG22") OR { 2300} (segid " " and resid "44 " and name "HG11") (segid " " and resid "44 " and name "HG23") ASSI { 4086} (segid " " and resid "42 " and name "HG1 ") (segid " " and resid "42 " and name "HG2 ") 3.300 3.300 0.000 peak 4086 weight 0.10000E+01 volume -0.32720E+01 ppm1 1.481 ppm2 1.283 OR { 4086} (segid " " and resid "72 " and name "HG1 ") (segid " " and resid "42 " and name "HG2 ") ASSI { 4085} (segid " " and resid "72 " and name "HG2 ") (segid " " and resid "72 " and name "HB1 ") 2.700 2.700 0.000 peak 4085 weight 0.10000E+01 volume -0.41020E+01 ppm1 1.507 ppm2 1.731 OR { 4085} (segid " " and resid "42 " and name "HG1 ") (segid " " and resid "42 " and name "HB1 ") OR { 4085} (segid " " and resid "72 " and name "HG1 ") (segid " " and resid "72 " and name "HB1 ") OR { 4085} (segid " " and resid "72 " and name "HG1 ") (segid " " and resid "42 " and name "HB1 ") ASSI { 3500} (segid " " and resid "54 " and name "HG2 ") (segid " " and resid "54 " and name "HG1 ") 3.300 3.300 0.000 peak 3500 weight 0.10000E+01 volume -0.37430E+01 ppm1 1.665 ppm2 1.916 OR { 3500} (segid " " and resid "74 " and name "HG1 ") (segid " " and resid "74 " and name "HB1 ") OR { 3500} (segid " " and resid "74 " and name "HG2 ") (segid " " and resid "74 " and name "HB1 ") OR { 3500} (segid " " and resid "56 " and name "HG ") (segid " " and resid "56 " and name "HB2 ") ASSI { 2298} (segid " " and resid "15 " and name "HG11") (segid " " and resid "15 " and name "HG12") 2.700 2.700 0.000 peak 2298 weight 0.10000E+01 volume -0.49470E+01 ppm1 1.389 ppm2 1.257 OR { 2298} (segid " " and resid "44 " and name "HG11") (segid " " and resid "42 " and name "HG2 ") ASSI { 4094} (segid " " and resid "42 " and name "HG1 ") (segid " " and resid "42 " and name "HA ") 5.000 5.000 0.000 peak 4094 weight 0.10000E+01 volume -0.70300E+00 ppm1 1.481 ppm2 4.419 ASSI { 2470} (segid " " and resid "38 " and name "HG1 ") (segid " " and resid "38 " and name "HG2 ") 3.300 3.300 0.000 peak 2470 weight 0.10000E+01 volume -0.35740E+01 ppm1 2.192 ppm2 1.626 ASSI { 2468} (segid " " and resid "19 " and name "HG1 ") (segid " " and resid "19 " and name "HG2 ") 2.700 2.700 0.000 peak 2468 weight 0.10000E+01 volume -0.62980E+01 ppm1 2.192 ppm2 2.021 OR { 2468} (segid " " and resid "19 " and name "HG1 ") (segid " " and resid "19 " and name "HB2 ") OR { 2468} (segid " " and resid "38 " and name "HG1 ") (segid " " and resid "38 " and name "HB2 ") ASSI { 2471} (segid " " and resid "19 " and name "HG1 ") (segid " " and resid "19 " and name "HB1 ") 5.000 5.000 0.000 peak 2471 weight 0.10000E+01 volume -0.13660E+01 ppm1 2.205 ppm2 2.337 ASSI { 1838} (segid " " and resid "16 " and name "HB2 ") (segid " " and resid "16 " and name "HA ") 5.000 5.000 0.000 peak 1838 weight 0.10000E+01 volume -0.11070E+01 ppm1 1.889 ppm2 4.919 ASSI { 1835} (segid " " and resid "2 " and name "HB1 ") (segid " " and resid "2 " and name "HB2 ") 2.700 2.700 0.000 peak 1835 weight 0.10000E+01 volume -0.62800E+01 ppm1 1.889 ppm2 1.678 OR { 1835} (segid " " and resid "29 " and name "HD1 ") (segid " " and resid "29 " and name "HD2 ") ASSI { 2364} (segid " " and resid "16 " and name "HB1 ") (segid " " and resid "16 " and name "HG1 ") 3.300 3.300 0.000 peak 2364 weight 0.10000E+01 volume -0.21990E+01 ppm1 1.955 ppm2 2.205 ASSI { 1839} (segid " " and resid "29 " and name "HD1 ") (segid " " and resid "29 " and name "HG2 ") 5.000 5.000 0.000 peak 1839 weight 0.10000E+01 volume -0.12520E+01 ppm1 1.889 ppm2 1.573 OR { 1839} (segid " " and resid "2 " and name "HB1 ") (segid " " and resid "63 " and name "HG1 ") ASSI { 1849} (segid " " and resid "2 " and name "HB2 ") (segid " " and resid "2 " and name "HB1 ") 2.700 2.700 0.000 peak 1849 weight 0.10000E+01 volume -0.62840E+01 ppm1 1.665 ppm2 1.889 OR { 1849} (segid " " and resid "29 " and name "HD2 ") (segid " " and resid "29 " and name "HD1 ") OR { 1849} (segid " " and resid "29 " and name "HD2 ") (segid " " and resid "29 " and name "HB1 ") ASSI { 1842} (segid " " and resid "2 " and name "HB1 ") (segid " " and resid "2 " and name "HG1 ") 5.000 5.000 0.000 peak 1842 weight 0.10000E+01 volume -0.67100E+00 ppm1 1.889 ppm2 2.311 OR { 1842} (segid " " and resid "16 " and name "HB2 ") (segid " " and resid "2 " and name "HG1 ") ASSI { 1843} (segid " " and resid "29 " and name "HD1 ") (segid " " and resid "29 " and name "HE2 ") 5.000 5.000 0.000 peak 1843 weight 0.10000E+01 volume -0.37200E+00 ppm1 1.889 ppm2 3.075 ASSI { 3790} (segid " " and resid "29 " and name "HD2 ") (segid " " and resid "29 " and name "HE2 ") 5.000 5.000 0.000 peak 3790 weight 0.10000E+01 volume -0.37900E+00 ppm1 1.692 ppm2 3.101 OR { 3790} (segid " " and resid "29 " and name "HD2 ") (segid " " and resid "25 " and name "HB1 ") ASSI { 1847} (segid " " and resid "29 " and name "HD1 ") (segid " " and resid "29 " and name "HE1 ") 5.000 5.000 0.000 peak 1847 weight 0.10000E+01 volume -0.39600E+00 ppm1 1.876 ppm2 3.154 ASSI { 1852} (segid " " and resid "29 " and name "HD2 ") (segid " " and resid "29 " and name "HE1 ") 5.000 5.000 0.000 peak 1852 weight 0.10000E+01 volume -0.37600E+00 ppm1 1.678 ppm2 3.180 ASSI { 1848} (segid " " and resid "29 " and name "HD1 ") (segid " " and resid "26 " and name "HA ") 6.000 6.000 0.000 peak 1848 weight 0.10000E+01 volume -0.18100E+00 ppm1 1.876 ppm2 4.577 ASSI { 1850} (segid " " and resid "2 " and name "HB2 ") (segid " " and resid "2 " and name "HA ") 5.000 5.000 0.000 peak 1850 weight 0.10000E+01 volume -0.74100E+00 ppm1 1.665 ppm2 4.788 ASSI { 1840} (segid " " and resid "2 " and name "HB1 ") (segid " " and resid "2 " and name "HA ") 5.000 5.000 0.000 peak 1840 weight 0.10000E+01 volume -0.67500E+00 ppm1 1.902 ppm2 4.788 ASSI { 3157} (segid " " and resid "74 " and name "HB2 ") (segid " " and resid "74 " and name "HA ") 5.000 5.000 0.000 peak 3157 weight 0.10000E+01 volume -0.34800E+00 ppm1 1.797 ppm2 4.287 ASSI { 3775} (segid " " and resid "63 " and name "HB2 ") (segid " " and resid "63 " and name "HG2 ") 5.000 5.000 0.000 peak 3775 weight 0.10000E+01 volume -0.49600E+00 ppm1 1.810 ppm2 1.415 ASSI { 3774} (segid " " and resid "63 " and name "HB2 ") (segid " " and resid "63 " and name "HA ") 5.000 5.000 0.000 peak 3774 weight 0.10000E+01 volume -0.81000E+00 ppm1 1.797 ppm2 3.944 ASSI { 3753} (segid " " and resid "63 " and name "HB2 ") (segid " " and resid "63 " and name "HG1 ") 5.000 5.000 0.000 peak 3753 weight 0.10000E+01 volume -0.11820E+01 ppm1 1.797 ppm2 1.547 OR { 3753} (segid " " and resid "63 " and name "HB2 ") (segid " " and resid "1 " and name "HE1 ") ASSI { 3778} (segid " " and resid "63 " and name "HB2 ") (segid " " and resid "63 " and name "HE1 ") 6.000 6.000 0.000 peak 3778 weight 0.10000E+01 volume -0.11400E+00 ppm1 1.797 ppm2 2.996 OR { 3778} (segid " " and resid "63 " and name "HB2 ") (segid " " and resid "63 " and name "HE2 ") ASSI { 3464} (segid " " and resid "62 " and name "HB1 ") (segid " " and resid "62 " and name "HB2 ") 2.700 2.700 0.000 peak 3464 weight 0.10000E+01 volume -0.46500E+01 ppm1 2.192 ppm2 1.836 OR { 3464} (segid " " and resid "29 " and name "HB2 ") (segid " " and resid "29 " and name "HB1 ") OR { 3464} (segid " " and resid "29 " and name "HB2 ") (segid " " and resid "29 " and name "HD1 ") ASSI { 3463} (segid " " and resid "29 " and name "HB2 ") (segid " " and resid "29 " and name "HB1 ") 2.700 2.700 0.000 peak 3463 weight 0.10000E+01 volume -0.52910E+01 ppm1 2.205 ppm2 1.916 OR { 3463} (segid " " and resid "51 " and name "HB1 ") (segid " " and resid "51 " and name "HB2 ") OR { 3463} (segid " " and resid "29 " and name "HB2 ") (segid " " and resid "29 " and name "HD1 ") ASSI { 3772} (segid " " and resid "62 " and name "HB2 ") (segid " " and resid "62 " and name "HG1 ") 5.000 5.000 0.000 peak 3772 weight 0.10000E+01 volume -0.14330E+01 ppm1 1.823 ppm2 2.284 OR { 3772} (segid " " and resid "62 " and name "HB2 ") (segid " " and resid "62 " and name "HG2 ") ASSI { 3468} (segid " " and resid "29 " and name "HB1 ") (segid " " and resid "29 " and name "HB2 ") 2.700 2.700 0.000 peak 3468 weight 0.10000E+01 volume -0.48290E+01 ppm1 1.902 ppm2 2.205 OR { 3468} (segid " " and resid "51 " and name "HB2 ") (segid " " and resid "51 " and name "HB1 ") ASSI { 2560} (segid " " and resid "38 " and name "HB1 ") (segid " " and resid "27 " and name "HE2 ") 6.000 6.000 0.000 peak 2560 weight 0.10000E+01 volume -0.17100E+00 ppm1 2.271 ppm2 2.627 ASSI { 2542} (segid " " and resid "34 " and name "HB1 ") (segid " " and resid "34 " and name "HB2 ") 3.300 3.300 0.000 peak 2542 weight 0.10000E+01 volume -0.38180E+01 ppm1 2.271 ppm2 1.652 OR { 2542} (segid " " and resid "38 " and name "HB1 ") (segid " " and resid "27 " and name "HD1 ") OR { 2542} (segid " " and resid "38 " and name "HB1 ") (segid " " and resid "27 " and name "HD2 ") ASSI { 2549} (segid " " and resid "34 " and name "HB1 ") (segid " " and resid "34 " and name "HA ") 5.000 5.000 0.000 peak 2549 weight 0.10000E+01 volume -0.94600E+00 ppm1 2.284 ppm2 4.498 ASSI { 2677} (segid " " and resid "27 " and name "HB2 ") (segid " " and resid "27 " and name "HD1 ") 5.000 5.000 0.000 peak 2677 weight 0.10000E+01 volume -0.19460E+01 ppm1 2.008 ppm2 1.626 OR { 2677} (segid " " and resid "27 " and name "HB2 ") (segid " " and resid "27 " and name "HG1 ") OR { 2677} (segid " " and resid "2 " and name "HG2 ") (segid " " and resid "2 " and name "HB2 ") OR { 2677} (segid " " and resid "27 " and name "HB2 ") (segid " " and resid "27 " and name "HD2 ") ASSI { 2685} (segid " " and resid "2 " and name "HG2 ") (segid " " and resid "14 " and name "HB ") 6.000 6.000 0.000 peak 2685 weight 0.10000E+01 volume -0.20000E+00 ppm1 2.008 ppm2 4.050 OR { 2685} (segid " " and resid "27 " and name "HB2 ") (segid " " and resid "38 " and name "HA ") ASSI { 1863} (segid " " and resid "3 " and name "HB ") (segid " " and resid "3 " and name "HG12") 3.300 3.300 0.000 peak 1863 weight 0.10000E+01 volume -0.31870E+01 ppm1 2.047 ppm2 0.572 OR { 1863} (segid " " and resid "3 " and name "HB ") (segid " " and resid "3 " and name "HG11") OR { 1863} (segid " " and resid "3 " and name "HB ") (segid " " and resid "3 " and name "HG22") OR { 1863} (segid " " and resid "3 " and name "HB ") (segid " " and resid "3 " and name "HG21") OR { 1863} (segid " " and resid "3 " and name "HB ") (segid " " and resid "3 " and name "HG23") OR { 1863} (segid " " and resid "3 " and name "HB ") (segid " " and resid "3 " and name "HG13") ASSI { 3360} (segid " " and resid "48 " and name "HB2 ") (segid " " and resid "48 " and name "HG2 ") 5.000 5.000 0.000 peak 3360 weight 0.10000E+01 volume -0.14870E+01 ppm1 1.981 ppm2 1.599 OR { 3360} (segid " " and resid "48 " and name "HB2 ") (segid " " and resid "48 " and name "HG1 ") ASSI { 4026} (segid " " and resid "3 " and name "HB ") (segid " " and resid "61 " and name "HG23") 6.000 6.000 0.000 peak 4026 weight 0.10000E+01 volume -0.17800E+00 ppm1 2.047 ppm2 0.361 OR { 4026} (segid " " and resid "3 " and name "HB ") (segid " " and resid "61 " and name "HG21") OR { 4026} (segid " " and resid "3 " and name "HB ") (segid " " and resid "17 " and name "HG21") OR { 4026} (segid " " and resid "3 " and name "HB ") (segid " " and resid "17 " and name "HG23") OR { 4026} (segid " " and resid "3 " and name "HB ") (segid " " and resid "17 " and name "HG22") OR { 4026} (segid " " and resid "3 " and name "HB ") (segid " " and resid "61 " and name "HG22") OR { 4026} (segid " " and resid "48 " and name "HB1 ") (segid " " and resid "61 " and name "HD12") ASSI { 2067} (segid " " and resid "11 " and name "HE2 ") (segid " " and resid "13 " and name "HG21") 5.000 5.000 0.000 peak 2067 weight 0.10000E+01 volume -0.74600E+00 ppm1 2.901 ppm2 0.925 OR { 2067} (segid " " and resid "6 " and name "HE2 ") (segid " " and resid "66 " and name "HG22") OR { 2067} (segid " " and resid "11 " and name "HE1 ") (segid " " and resid "13 " and name "HG22") OR { 2067} (segid " " and resid "11 " and name "HE2 ") (segid " " and resid "13 " and name "HG12") OR { 2067} (segid " " and resid "6 " and name "HE2 ") (segid " " and resid "66 " and name "HG21") OR { 2067} (segid " " and resid "11 " and name "HE1 ") (segid " " and resid "13 " and name "HG21") OR { 2067} (segid " " and resid "11 " and name "HE1 ") (segid " " and resid "13 " and name "HG23") OR { 2067} (segid " " and resid "11 " and name "HE1 ") (segid " " and resid "13 " and name "HG11") OR { 2067} (segid " " and resid "6 " and name "HE1 ") (segid " " and resid "66 " and name "HG22") ASSI { 2070} (segid " " and resid "6 " and name "HE1 ") (segid " " and resid "12 " and name "HG23") 6.000 6.000 0.000 peak 2070 weight 0.10000E+01 volume -0.20500E+00 ppm1 2.877 ppm2 1.046 OR { 2070} (segid " " and resid "6 " and name "HE2 ") (segid " " and resid "12 " and name "HG21") OR { 2070} (segid " " and resid "6 " and name "HE2 ") (segid " " and resid "12 " and name "HG23") OR { 2070} (segid " " and resid "6 " and name "HE1 ") (segid " " and resid "12 " and name "HG21") OR { 2070} (segid " " and resid "6 " and name "HE2 ") (segid " " and resid "12 " and name "HG22") ASSI { 2065} (segid " " and resid "11 " and name "HE1 ") (segid " " and resid "11 " and name "HG1 ") 5.000 5.000 0.000 peak 2065 weight 0.10000E+01 volume -0.72900E+00 ppm1 2.890 ppm2 1.389 OR { 2065} (segid " " and resid "6 " and name "HE1 ") (segid " " and resid "6 " and name "HG1 ") OR { 2065} (segid " " and resid "11 " and name "HE2 ") (segid " " and resid "11 " and name "HG1 ") OR { 2065} (segid " " and resid "6 " and name "HE2 ") (segid " " and resid "6 " and name "HG1 ") ASSI { 2073} (segid " " and resid "11 " and name "HE1 ") (segid " " and resid "11 " and name "HB1 ") 6.000 6.000 0.000 peak 2073 weight 0.10000E+01 volume -0.12500E+00 ppm1 2.917 ppm2 1.784 OR { 2073} (segid " " and resid "11 " and name "HE2 ") (segid " " and resid "11 " and name "HB1 ") ASSI { 2071} (segid " " and resid "11 " and name "HE1 ") (segid " " and resid "11 " and name "HA ") 6.000 6.000 0.000 peak 2071 weight 0.10000E+01 volume -0.20400E+00 ppm1 2.890 ppm2 4.340 ASSI { 2066} (segid " " and resid "11 " and name "HE1 ") (segid " " and resid "11 " and name "HG2 ") 5.000 5.000 0.000 peak 2066 weight 0.10000E+01 volume -0.71600E+00 ppm1 2.901 ppm2 1.296 OR { 2066} (segid " " and resid "6 " and name "HE2 ") (segid " " and resid "6 " and name "HB2 ") OR { 2066} (segid " " and resid "11 " and name "HE2 ") (segid " " and resid "11 " and name "HG2 ") ASSI { 4686} (segid " " and resid "11 " and name "HE1 ") (segid " " and resid "11 " and name "HG2 ") 5.000 5.000 0.000 peak 4686 weight 0.10000E+01 volume -0.73500E+00 ppm1 2.901 ppm2 1.222 OR { 4686} (segid " " and resid "6 " and name "HE1 ") (segid " " and resid "6 " and name "HG2 ") OR { 4686} (segid " " and resid "6 " and name "HE2 ") (segid " " and resid "6 " and name "HG2 ") OR { 4686} (segid " " and resid "11 " and name "HE2 ") (segid " " and resid "11 " and name "HG2 ") ASSI { 3369} (segid " " and resid "48 " and name "HE1 ") (segid " " and resid "48 " and name "HG2 ") 5.000 5.000 0.000 peak 3369 weight 0.10000E+01 volume -0.10820E+01 ppm1 3.180 ppm2 1.573 OR { 3369} (segid " " and resid "48 " and name "HE1 ") (segid " " and resid "48 " and name "HG1 ") OR { 3369} (segid " " and resid "48 " and name "HE2 ") (segid " " and resid "48 " and name "HG2 ") OR { 3369} (segid " " and resid "48 " and name "HE2 ") (segid " " and resid "48 " and name "HG1 ") OR { 3369} (segid " " and resid "29 " and name "HE1 ") (segid " " and resid "29 " and name "HG2 ") ASSI { 3368} (segid " " and resid "48 " and name "HE1 ") (segid " " and resid "48 " and name "HD2 ") 5.000 5.000 0.000 peak 3368 weight 0.10000E+01 volume -0.15960E+01 ppm1 3.180 ppm2 1.889 OR { 3368} (segid " " and resid "48 " and name "HE2 ") (segid " " and resid "48 " and name "HD1 ") OR { 3368} (segid " " and resid "29 " and name "HE1 ") (segid " " and resid "29 " and name "HD1 ") OR { 3368} (segid " " and resid "48 " and name "HE1 ") (segid " " and resid "48 " and name "HD1 ") OR { 3368} (segid " " and resid "48 " and name "HE2 ") (segid " " and resid "48 " and name "HD2 ") OR { 3368} (segid " " and resid "29 " and name "HE1 ") (segid " " and resid "29 " and name "HB1 ") ASSI { 3374} (segid " " and resid "29 " and name "HE1 ") (segid " " and resid "17 " and name "HG12") 6.000 6.000 0.000 peak 3374 weight 0.10000E+01 volume -0.18600E+00 ppm1 3.167 ppm2 0.651 OR { 3374} (segid " " and resid "29 " and name "HE1 ") (segid " " and resid "17 " and name "HG13") ASSI { 2777} (segid " " and resid "29 " and name "HE2 ") (segid " " and resid "29 " and name "HD2 ") 5.000 5.000 0.000 peak 2777 weight 0.10000E+01 volume -0.72800E+00 ppm1 3.075 ppm2 1.678 ASSI { 2776} (segid " " and resid "29 " and name "HE2 ") (segid " " and resid "29 " and name "HG1 ") 5.000 5.000 0.000 peak 2776 weight 0.10000E+01 volume -0.12110E+01 ppm1 3.088 ppm2 1.863 OR { 2776} (segid " " and resid "29 " and name "HE2 ") (segid " " and resid "29 " and name "HD1 ") OR { 2776} (segid " " and resid "29 " and name "HE2 ") (segid " " and resid "29 " and name "HB1 ") ASSI { 3358} (segid " " and resid "29 " and name "HE1 ") (segid " " and resid "29 " and name "HE2 ") 2.700 2.700 0.000 peak 3358 weight 0.10000E+01 volume -0.83950E+01 ppm1 3.180 ppm2 3.075 ASSI { 2780} (segid " " and resid "29 " and name "HE2 ") (segid " " and resid "29 " and name "HA ") 6.000 6.000 0.000 peak 2780 weight 0.10000E+01 volume -0.67000E-01 ppm1 3.088 ppm2 4.182 ASSI { 4120} (segid " " and resid "74 " and name "HD1 ") (segid " " and resid "74 " and name "HG2 ") 5.000 5.000 0.000 peak 4120 weight 0.10000E+01 volume -0.78400E+00 ppm1 3.207 ppm2 1.652 OR { 4120} (segid " " and resid "74 " and name "HD2 ") (segid " " and resid "74 " and name "HG1 ") OR { 4120} (segid " " and resid "74 " and name "HD2 ") (segid " " and resid "74 " and name "HG2 ") OR { 4120} (segid " " and resid "74 " and name "HD1 ") (segid " " and resid "74 " and name "HG1 ") ASSI { 4093} (segid " " and resid "42 " and name "HD1 ") (segid " " and resid "72 " and name "HA ") 5.000 5.000 0.000 peak 4093 weight 0.10000E+01 volume -0.42900E+00 ppm1 3.128 ppm2 4.234 OR { 4093} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "72 " and name "HA ") ASSI { 3485} (segid " " and resid "53 " and name "HA2 ") (segid " " and resid "53 " and name "HA1 ") 2.700 2.700 0.000 peak 3485 weight 0.10000E+01 volume -0.45080E+01 ppm1 3.931 ppm2 4.287 ASSI { 3486} (segid " " and resid "10 " and name "HA1 ") (segid " " and resid "10 " and name "HA2 ") 2.700 2.700 0.000 peak 3486 weight 0.10000E+01 volume -0.50810E+01 ppm1 4.300 ppm2 3.602 ASSI { 2920} (segid " " and resid "48 " and name "HG2 ") (segid " " and resid "59 " and name "HE1 ") 6.000 6.000 0.000 peak 2920 weight 0.10000E+01 volume -0.12500E+00 ppm1 1.586 ppm2 6.869 OR { 2920} (segid " " and resid "48 " and name "HG2 ") (segid " " and resid "59 " and name "HE2 ") OR { 2920} (segid " " and resid "48 " and name "HG1 ") (segid " " and resid "59 " and name "HE2 ") ASSI { 2679} (segid " " and resid "29 " and name "HG2 ") (segid " " and resid "29 " and name "HG1 ") 3.300 3.300 0.000 peak 2679 weight 0.10000E+01 volume -0.28640E+01 ppm1 1.573 ppm2 1.836 OR { 2679} (segid " " and resid "29 " and name "HG2 ") (segid " " and resid "29 " and name "HD1 ") OR { 2679} (segid " " and resid "29 " and name "HG2 ") (segid " " and resid "29 " and name "HB1 ") OR { 2679} (segid " " and resid "27 " and name "HG2 ") (segid " " and resid "41 " and name "HB1 ") ASSI { 2705} (segid " " and resid "29 " and name "HG2 ") (segid " " and resid "29 " and name "HE2 ") 5.000 5.000 0.000 peak 2705 weight 0.10000E+01 volume -0.31800E+00 ppm1 1.573 ppm2 3.075 ASSI { 2942} (segid " " and resid "40 " and name "HA ") (segid " " and resid "71 " and name "HD23") 6.000 6.000 0.000 peak 2942 weight 0.10000E+01 volume -0.28700E+00 ppm1 4.471 ppm2 0.914 OR { 2942} (segid " " and resid "40 " and name "HA ") (segid " " and resid "71 " and name "HD22") OR { 2942} (segid " " and resid "40 " and name "HA ") (segid " " and resid "71 " and name "HD21") OR { 2942} (segid " " and resid "40 " and name "HA ") (segid " " and resid "73 " and name "HD11") OR { 2942} (segid " " and resid "40 " and name "HA ") (segid " " and resid "36 " and name "HG21") OR { 2942} (segid " " and resid "40 " and name "HA ") (segid " " and resid "36 " and name "HG23") OR { 2942} (segid " " and resid "40 " and name "HA ") (segid " " and resid "73 " and name "HD12") OR { 2942} (segid " " and resid "40 " and name "HA ") (segid " " and resid "36 " and name "HG22") OR { 2942} (segid " " and resid "40 " and name "HA ") (segid " " and resid "73 " and name "HD21") OR { 2942} (segid " " and resid "40 " and name "HA ") (segid " " and resid "73 " and name "HD13") ASSI { 2940} (segid " " and resid "34 " and name "HA ") (segid " " and resid "34 " and name "HB2 ") 5.000 5.000 0.000 peak 2940 weight 0.10000E+01 volume -0.14180E+01 ppm1 4.485 ppm2 1.678 OR { 2940} (segid " " and resid "40 " and name "HA ") (segid " " and resid "71 " and name "HG ") OR { 2940} (segid " " and resid "40 " and name "HA ") (segid " " and resid "42 " and name "HB1 ") ASSI { 2944} (segid " " and resid "40 " and name "HA ") (segid " " and resid "71 " and name "HD23") 6.000 6.000 0.000 peak 2944 weight 0.10000E+01 volume -0.29600E+00 ppm1 4.471 ppm2 0.888 OR { 2944} (segid " " and resid "40 " and name "HA ") (segid " " and resid "73 " and name "HD22") OR { 2944} (segid " " and resid "40 " and name "HA ") (segid " " and resid "71 " and name "HD22") OR { 2944} (segid " " and resid "40 " and name "HA ") (segid " " and resid "71 " and name "HD21") OR { 2944} (segid " " and resid "40 " and name "HA ") (segid " " and resid "73 " and name "HD11") OR { 2944} (segid " " and resid "40 " and name "HA ") (segid " " and resid "36 " and name "HG21") OR { 2944} (segid " " and resid "40 " and name "HA ") (segid " " and resid "36 " and name "HG23") OR { 2944} (segid " " and resid "40 " and name "HA ") (segid " " and resid "73 " and name "HD12") OR { 2944} (segid " " and resid "40 " and name "HA ") (segid " " and resid "36 " and name "HG22") OR { 2944} (segid " " and resid "40 " and name "HA ") (segid " " and resid "73 " and name "HD21") OR { 2944} (segid " " and resid "40 " and name "HA ") (segid " " and resid "73 " and name "HD13") ASSI { 2938} (segid " " and resid "40 " and name "HA ") (segid " " and resid "72 " and name "HB1 ") 5.000 5.000 0.000 peak 2938 weight 0.10000E+01 volume -0.17260E+01 ppm1 4.471 ppm2 1.757 OR { 2938} (segid " " and resid "40 " and name "HA ") (segid " " and resid "40 " and name "HB2 ") ASSI { 2941} (segid " " and resid "40 " and name "HA ") (segid " " and resid "72 " and name "HD2 ") 5.000 5.000 0.000 peak 2941 weight 0.10000E+01 volume -0.44500E+00 ppm1 4.471 ppm2 3.128 OR { 2941} (segid " " and resid "40 " and name "HA ") (segid " " and resid "72 " and name "HD1 ") ASSI { 3114} (segid " " and resid "42 " and name "HA ") (segid " " and resid "42 " and name "HG2 ") 5.000 5.000 0.000 peak 3114 weight 0.10000E+01 volume -0.78800E+00 ppm1 4.432 ppm2 1.283 ASSI { 3113} (segid " " and resid "40 " and name "HA ") (segid " " and resid "72 " and name "HB1 ") 5.000 5.000 0.000 peak 3113 weight 0.10000E+01 volume -0.18120E+01 ppm1 4.432 ppm2 1.705 OR { 3113} (segid " " and resid "42 " and name "HA ") (segid " " and resid "42 " and name "HB1 ") ASSI { 3115} (segid " " and resid "40 " and name "HA ") (segid " " and resid "72 " and name "HD2 ") 5.000 5.000 0.000 peak 3115 weight 0.10000E+01 volume -0.82800E+00 ppm1 4.432 ppm2 3.101 OR { 3115} (segid " " and resid "40 " and name "HA ") (segid " " and resid "72 " and name "HD1 ") OR { 3115} (segid " " and resid "42 " and name "HA ") (segid " " and resid "42 " and name "HD1 ") ASSI { 3122} (segid " " and resid "42 " and name "HA ") (segid " " and resid "43 " and name "HA ") 6.000 6.000 0.000 peak 3122 weight 0.10000E+01 volume -0.72000E-01 ppm1 4.432 ppm2 5.367 ASSI { 5597} (segid " " and resid "40 " and name "HA ") (segid " " and resid "72 " and name "HG2 ") 3.300 3.300 0.000 peak 5597 weight 0.10000E+01 volume -0.35340E+01 ppm1 4.428 ppm2 1.507 OR { 5597} (segid " " and resid "42 " and name "HA ") (segid " " and resid "42 " and name "HG1 ") OR { 5597} (segid " " and resid "42 " and name "HA ") (segid " " and resid "42 " and name "HB2 ") OR { 5597} (segid " " and resid "40 " and name "HA ") (segid " " and resid "72 " and name "HB2 ") ASSI { 1964} (segid " " and resid "52 " and name "HA ") (segid " " and resid "23 " and name "HB ") 3.300 3.300 0.000 peak 1964 weight 0.10000E+01 volume -0.26010E+01 ppm1 4.379 ppm2 2.284 ASSI { 2156} (segid " " and resid "11 " and name "HA ") (segid " " and resid "12 " and name "HA ") 6.000 6.000 0.000 peak 2156 weight 0.10000E+01 volume -0.74000E-01 ppm1 4.366 ppm2 5.315 ASSI { 2500} (segid " " and resid "20 " and name "HA ") (segid " " and resid "55 " and name "HA ") 6.000 6.000 0.000 peak 2500 weight 0.10000E+01 volume -0.13300E+00 ppm1 4.366 ppm2 5.262 OR { 2500} (segid " " and resid "58 " and name "HA ") (segid " " and resid "55 " and name "HA ") ASSI { 2498} (segid " " and resid "20 " and name "HA ") (segid " " and resid "55 " and name "HG23") 5.000 5.000 0.000 peak 2498 weight 0.10000E+01 volume -0.10700E+01 ppm1 4.366 ppm2 1.151 OR { 2498} (segid " " and resid "20 " and name "HA ") (segid " " and resid "55 " and name "HG21") OR { 2498} (segid " " and resid "20 " and name "HA ") (segid " " and resid "55 " and name "HG22") ASSI { 2502} (segid " " and resid "20 " and name "HA ") (segid " " and resid "19 " and name "HB2 ") 6.000 6.000 0.000 peak 2502 weight 0.10000E+01 volume -0.13200E+00 ppm1 4.366 ppm2 2.021 OR { 2502} (segid " " and resid "20 " and name "HA ") (segid " " and resid "19 " and name "HG2 ") ASSI { 3469} (segid " " and resid "63 " and name "HB1 ") (segid " " and resid "63 " and name "HB2 ") 2.700 2.700 0.000 peak 3469 weight 0.10000E+01 volume -0.43980E+01 ppm1 1.955 ppm2 1.810 ASSI { 2294} (segid " " and resid "27 " and name "HA ") (segid " " and resid "27 " and name "HE1 ") 6.000 6.000 0.000 peak 2294 weight 0.10000E+01 volume -0.75000E-01 ppm1 4.379 ppm2 2.759 ASSI { 2746} (segid " " and resid "29 " and name "HA ") (segid " " and resid "29 " and name "HG2 ") 5.000 5.000 0.000 peak 2746 weight 0.10000E+01 volume -0.99600E+00 ppm1 4.182 ppm2 1.573 ASSI { 2747} (segid " " and resid "29 " and name "HA ") (segid " " and resid "29 " and name "HB2 ") 5.000 5.000 0.000 peak 2747 weight 0.10000E+01 volume -0.69300E+00 ppm1 4.182 ppm2 2.205 ASSI { 2749} (segid " " and resid "29 " and name "HA ") (segid " " and resid "32 " and name "HB2 ") 5.000 5.000 0.000 peak 2749 weight 0.10000E+01 volume -0.32900E+00 ppm1 4.182 ppm2 2.732 ASSI { 3172} (segid " " and resid "41 " and name "HG2 ") (segid " " and resid "30 " and name "HG21") 6.000 6.000 0.000 peak 3172 weight 0.10000E+01 volume 0.27000E-01 ppm1 1.586 ppm2 0.519 OR { 3172} (segid " " and resid "41 " and name "HG2 ") (segid " " and resid "30 " and name "HG22") OR { 3172} (segid " " and resid "41 " and name "HG2 ") (segid " " and resid "30 " and name "HG23") ASSI { 3169} (segid " " and resid "41 " and name "HG2 ") (segid " " and resid "36 " and name "HG23") 6.000 6.000 0.000 peak 3169 weight 0.10000E+01 volume 0.99000E-01 ppm1 1.612 ppm2 0.888 OR { 3169} (segid " " and resid "41 " and name "HG2 ") (segid " " and resid "69 " and name "HD11") OR { 3169} (segid " " and resid "41 " and name "HG2 ") (segid " " and resid "36 " and name "HG21") OR { 3169} (segid " " and resid "41 " and name "HG2 ") (segid " " and resid "36 " and name "HG22") ASSI { 3162} (segid " " and resid "41 " and name "HG1 ") (segid " " and resid "36 " and name "HG21") 6.000 6.000 0.000 peak 3162 weight 0.10000E+01 volume 0.11000E+00 ppm1 2.495 ppm2 0.888 OR { 3162} (segid " " and resid "41 " and name "HG1 ") (segid " " and resid "36 " and name "HG23") OR { 3162} (segid " " and resid "41 " and name "HG1 ") (segid " " and resid "36 " and name "HG22") OR { 3162} (segid " " and resid "41 " and name "HG1 ") (segid " " and resid "69 " and name "HD13") ASSI { 3163} (segid " " and resid "41 " and name "HG1 ") (segid " " and resid "38 " and name "HA ") 6.000 6.000 0.000 peak 3163 weight 0.10000E+01 volume 0.10300E+00 ppm1 2.495 ppm2 4.076 OR { 3163} (segid " " and resid "41 " and name "HG1 ") (segid " " and resid "41 " and name "HA ") ASSI { 3170} (segid " " and resid "41 " and name "HG2 ") (segid " " and resid "38 " and name "HA ") 6.000 6.000 0.000 peak 3170 weight 0.10000E+01 volume 0.12000E+00 ppm1 1.612 ppm2 4.103 OR { 3170} (segid " " and resid "41 " and name "HG2 ") (segid " " and resid "41 " and name "HA ") ASSI { 2229} (segid " " and resid "14 " and name "HA ") (segid " " and resid "4 " and name "HB1 ") 6.000 6.000 0.000 peak 2229 weight 0.10000E+01 volume -0.10800E+00 ppm1 5.117 ppm2 2.811 ASSI { 4044} (segid " " and resid "66 " and name "HG22") (segid " " and resid "4 " and name "HB1 ") 5.000 5.000 0.000 peak 4044 weight 0.10000E+01 volume -0.38300E+00 ppm1 0.941 ppm2 2.811 OR { 4044} (segid " " and resid "66 " and name "HG23") (segid " " and resid "4 " and name "HB1 ") OR { 4044} (segid " " and resid "66 " and name "HG21") (segid " " and resid "4 " and name "HB1 ") ASSI { 4027} (segid " " and resid "66 " and name "HG21") (segid " " and resid "4 " and name "HB2 ") 5.000 5.000 0.000 peak 4027 weight 0.10000E+01 volume -0.15290E+01 ppm1 0.941 ppm2 3.101 OR { 4027} (segid " " and resid "66 " and name "HG23") (segid " " and resid "4 " and name "HB2 ") OR { 4027} (segid " " and resid "66 " and name "HG22") (segid " " and resid "4 " and name "HB2 ") ASSI { 4804} (segid " " and resid "66 " and name "HG21") (segid " " and resid "4 " and name "HD2 ") 5.000 5.000 0.000 peak 4804 weight 0.10000E+01 volume -0.32300E+00 ppm1 0.956 ppm2 7.058 OR { 4804} (segid " " and resid "66 " and name "HG22") (segid " " and resid "4 " and name "HD2 ") OR { 4804} (segid " " and resid "66 " and name "HG21") (segid " " and resid "4 " and name "HD1 ") OR { 4804} (segid " " and resid "66 " and name "HG23") (segid " " and resid "4 " and name "HD1 ") OR { 4804} (segid " " and resid "66 " and name "HG22") (segid " " and resid "4 " and name "HD1 ") ASSI { 2957} (segid " " and resid "34 " and name "HG1 ") (segid " " and resid "5 " and name "HD23") 5.000 5.000 0.000 peak 2957 weight 0.10000E+01 volume -0.52300E+00 ppm1 2.008 ppm2 0.677 OR { 2957} (segid " " and resid "34 " and name "HG1 ") (segid " " and resid "5 " and name "HD22") OR { 2957} (segid " " and resid "34 " and name "HG2 ") (segid " " and resid "5 " and name "HD23") OR { 2957} (segid " " and resid "34 " and name "HG2 ") (segid " " and resid "5 " and name "HD21") OR { 2957} (segid " " and resid "34 " and name "HG1 ") (segid " " and resid "5 " and name "HD21") OR { 2957} (segid " " and resid "30 " and name "HB ") (segid " " and resid "5 " and name "HD22") OR { 2957} (segid " " and resid "30 " and name "HB ") (segid " " and resid "5 " and name "HD21") ASSI { 4676} (segid " " and resid "6 " and name "HE2 ") (segid " " and resid "6 " and name "HA ") 6.000 6.000 0.000 peak 4676 weight 0.10000E+01 volume -0.11400E+00 ppm1 2.901 ppm2 5.194 OR { 4676} (segid " " and resid "6 " and name "HE1 ") (segid " " and resid "6 " and name "HA ") ASSI { 4035} (segid " " and resid "66 " and name "HG22") (segid " " and resid "6 " and name "HB1 ") 5.000 5.000 0.000 peak 4035 weight 0.10000E+01 volume -0.10110E+01 ppm1 0.941 ppm2 1.652 OR { 4035} (segid " " and resid "66 " and name "HG21") (segid " " and resid "6 " and name "HB1 ") OR { 4035} (segid " " and resid "66 " and name "HG23") (segid " " and resid "6 " and name "HB1 ") ASSI { 2060} (segid " " and resid "6 " and name "HE1 ") (segid " " and resid "6 " and name "HB1 ") 5.000 5.000 0.000 peak 2060 weight 0.10000E+01 volume -0.12000E+01 ppm1 2.930 ppm2 1.652 OR { 2060} (segid " " and resid "6 " and name "HE2 ") (segid " " and resid "6 " and name "HB1 ") ASSI { 4028} (segid " " and resid "66 " and name "HG23") (segid " " and resid "6 " and name "HB2 ") 5.000 5.000 0.000 peak 4028 weight 0.10000E+01 volume -0.13720E+01 ppm1 0.941 ppm2 1.336 OR { 4028} (segid " " and resid "66 " and name "HG22") (segid " " and resid "6 " and name "HB2 ") OR { 4028} (segid " " and resid "66 " and name "HG21") (segid " " and resid "6 " and name "HB2 ") ASSI { 2062} (segid " " and resid "6 " and name "HE1 ") (segid " " and resid "6 " and name "HD2 ") 5.000 5.000 0.000 peak 2062 weight 0.10000E+01 volume -0.11210E+01 ppm1 2.890 ppm2 1.547 OR { 2062} (segid " " and resid "6 " and name "HE2 ") (segid " " and resid "6 " and name "HD1 ") OR { 2062} (segid " " and resid "6 " and name "HE1 ") (segid " " and resid "6 " and name "HD1 ") OR { 2062} (segid " " and resid "6 " and name "HE2 ") (segid " " and resid "6 " and name "HD2 ") ASSI { 2958} (segid " " and resid "34 " and name "HG1 ") (segid " " and resid "7 " and name "HG22") 5.000 5.000 0.000 peak 2958 weight 0.10000E+01 volume -0.34500E+00 ppm1 2.008 ppm2 1.151 OR { 2958} (segid " " and resid "34 " and name "HG1 ") (segid " " and resid "7 " and name "HG23") OR { 2958} (segid " " and resid "34 " and name "HG2 ") (segid " " and resid "7 " and name "HG23") ASSI { 4678} (segid " " and resid "6 " and name "HE2 ") (segid " " and resid "10 " and name "HA2 ") 6.000 6.000 0.000 peak 4678 weight 0.10000E+01 volume -0.25500E+00 ppm1 2.901 ppm2 3.597 OR { 4678} (segid " " and resid "6 " and name "HE1 ") (segid " " and resid "10 " and name "HA2 ") ASSI { 2137} (segid " " and resid "11 " and name "HA ") (segid " " and resid "11 " and name "HB1 ") 5.000 5.000 0.000 peak 2137 weight 0.10000E+01 volume -0.13630E+01 ppm1 4.353 ppm2 1.784 ASSI { 2135} (segid " " and resid "11 " and name "HA ") (segid " " and resid "11 " and name "HB2 ") 5.000 5.000 0.000 peak 2135 weight 0.10000E+01 volume -0.17790E+01 ppm1 4.353 ppm2 1.678 ASSI { 2146} (segid " " and resid "11 " and name "HA ") (segid " " and resid "11 " and name "HG1 ") 5.000 5.000 0.000 peak 2146 weight 0.10000E+01 volume -0.70900E+00 ppm1 4.353 ppm2 1.415 ASSI { 2147} (segid " " and resid "11 " and name "HA ") (segid " " and resid "11 " and name "HG2 ") 5.000 5.000 0.000 peak 2147 weight 0.10000E+01 volume -0.57200E+00 ppm1 4.366 ppm2 1.283 ASSI { 2959} (segid " " and resid "34 " and name "HG1 ") (segid " " and resid "13 " and name "HG23") 5.000 5.000 0.000 peak 2959 weight 0.10000E+01 volume -0.46600E+00 ppm1 2.008 ppm2 0.888 OR { 2959} (segid " " and resid "34 " and name "HG2 ") (segid " " and resid "13 " and name "HG23") OR { 2959} (segid " " and resid "34 " and name "HG1 ") (segid " " and resid "13 " and name "HG22") OR { 2959} (segid " " and resid "34 " and name "HG2 ") (segid " " and resid "13 " and name "HG22") ASSI { 1851} (segid " " and resid "2 " and name "HB2 ") (segid " " and resid "14 " and name "HG22") 5.000 5.000 0.000 peak 1851 weight 0.10000E+01 volume -0.52400E+00 ppm1 1.665 ppm2 1.099 OR { 1851} (segid " " and resid "2 " and name "HB2 ") (segid " " and resid "14 " and name "HG21") OR { 1851} (segid " " and resid "2 " and name "HB2 ") (segid " " and resid "14 " and name "HG23") ASSI { 4129} (segid " " and resid "2 " and name "HG1 ") (segid " " and resid "14 " and name "HG23") 6.000 6.000 0.000 peak 4129 weight 0.10000E+01 volume -0.23400E+00 ppm1 2.298 ppm2 1.099 OR { 4129} (segid " " and resid "2 " and name "HG1 ") (segid " " and resid "14 " and name "HG22") OR { 4129} (segid " " and resid "2 " and name "HG1 ") (segid " " and resid "14 " and name "HG21") ASSI { 2312} (segid " " and resid "15 " and name "HG12") (segid " " and resid "15 " and name "HA ") 5.000 5.000 0.000 peak 2312 weight 0.10000E+01 volume -0.65600E+00 ppm1 1.270 ppm2 4.419 ASSI { 2307} (segid " " and resid "15 " and name "HG11") (segid " " and resid "15 " and name "HA ") 5.000 5.000 0.000 peak 2307 weight 0.10000E+01 volume -0.40000E+00 ppm1 1.389 ppm2 4.419 ASSI { 2916} (segid " " and resid "33 " and name "HG1 ") (segid " " and resid "15 " and name "HD13") 5.000 5.000 0.000 peak 2916 weight 0.10000E+01 volume -0.49000E+00 ppm1 1.599 ppm2 0.651 OR { 2916} (segid " " and resid "33 " and name "HG1 ") (segid " " and resid "15 " and name "HD11") OR { 2916} (segid " " and resid "33 " and name "HG1 ") (segid " " and resid "15 " and name "HD12") ASSI { 2302} (segid " " and resid "15 " and name "HG11") (segid " " and resid "15 " and name "HG21") 5.000 5.000 0.000 peak 2302 weight 0.10000E+01 volume -0.11350E+01 ppm1 1.375 ppm2 0.941 OR { 2302} (segid " " and resid "15 " and name "HG11") (segid " " and resid "15 " and name "HG22") OR { 2302} (segid " " and resid "15 " and name "HG11") (segid " " and resid "15 " and name "HG23") ASSI { 2311} (segid " " and resid "15 " and name "HG12") (segid " " and resid "15 " and name "HG23") 5.000 5.000 0.000 peak 2311 weight 0.10000E+01 volume -0.68200E+00 ppm1 1.244 ppm2 0.941 OR { 2311} (segid " " and resid "15 " and name "HG12") (segid " " and resid "15 " and name "HG21") OR { 2311} (segid " " and resid "15 " and name "HG12") (segid " " and resid "15 " and name "HG22") ASSI { 1841} (segid " " and resid "29 " and name "HD1 ") (segid " " and resid "15 " and name "HG21") 5.000 5.000 0.000 peak 1841 weight 0.10000E+01 volume -0.41400E+00 ppm1 1.889 ppm2 0.941 OR { 1841} (segid " " and resid "29 " and name "HD1 ") (segid " " and resid "15 " and name "HG23") OR { 1841} (segid " " and resid "29 " and name "HD1 ") (segid " " and resid "15 " and name "HG22") ASSI { 1836} (segid " " and resid "16 " and name "HB2 ") (segid " " and resid "16 " and name "HG2 ") 3.300 3.300 0.000 peak 1836 weight 0.10000E+01 volume -0.23300E+01 ppm1 1.889 ppm2 2.126 ASSI { 2778} (segid " " and resid "29 " and name "HE2 ") (segid " " and resid "17 " and name "HA ") 6.000 6.000 0.000 peak 2778 weight 0.10000E+01 volume -0.17100E+00 ppm1 3.075 ppm2 4.603 ASSI { 3373} (segid " " and resid "29 " and name "HE1 ") (segid " " and resid "17 " and name "HA ") 5.000 5.000 0.000 peak 3373 weight 0.10000E+01 volume -0.32600E+00 ppm1 3.167 ppm2 4.603 ASSI { 2475} (segid " " and resid "19 " and name "HG1 ") (segid " " and resid "18 " and name "HA ") 6.000 6.000 0.000 peak 2475 weight 0.10000E+01 volume -0.13900E+00 ppm1 2.192 ppm2 5.025 ASSI { 5027} (segid " " and resid "19 " and name "HG1 ") (segid " " and resid "19 " and name "HA ") 5.000 5.000 0.000 peak 5027 weight 0.10000E+01 volume -0.11650E+01 ppm1 2.195 ppm2 3.986 ASSI { 2484} (segid " " and resid "19 " and name "HD1 ") (segid " " and resid "19 " and name "HB2 ") 5.000 5.000 0.000 peak 2484 weight 0.10000E+01 volume -0.11290E+01 ppm1 4.017 ppm2 2.013 ASSI { 2472} (segid " " and resid "19 " and name "HG1 ") (segid " " and resid "19 " and name "HD1 ") 5.000 5.000 0.000 peak 2472 weight 0.10000E+01 volume -0.12660E+01 ppm1 2.192 ppm2 4.024 ASSI { 2495} (segid " " and resid "20 " and name "HA ") (segid " " and resid "20 " and name "HB1 ") 3.300 3.300 0.000 peak 2495 weight 0.10000E+01 volume -0.33050E+01 ppm1 4.366 ppm2 3.786 ASSI { 2496} (segid " " and resid "20 " and name "HA ") (segid " " and resid "20 " and name "HB2 ") 3.300 3.300 0.000 peak 2496 weight 0.10000E+01 volume -0.29530E+01 ppm1 4.366 ppm2 4.155 ASSI { 3518} (segid " " and resid "56 " and name "HG ") (segid " " and resid "21 " and name "HB1 ") 6.000 6.000 0.000 peak 3518 weight 0.10000E+01 volume -0.13200E+00 ppm1 1.678 ppm2 2.601 ASSI { 2550} (segid " " and resid "23 " and name "HB ") (segid " " and resid "23 " and name "HA ") 5.000 5.000 0.000 peak 2550 weight 0.10000E+01 volume -0.41700E+00 ppm1 2.271 ppm2 3.576 ASSI { 2157} (segid " " and resid "52 " and name "HA ") (segid " " and resid "23 " and name "HA ") 6.000 6.000 0.000 peak 2157 weight 0.10000E+01 volume -0.10900E+00 ppm1 4.366 ppm2 3.576 ASSI { 2143} (segid " " and resid "52 " and name "HA ") (segid " " and resid "23 " and name "HG11") 5.000 5.000 0.000 peak 2143 weight 0.10000E+01 volume -0.12730E+01 ppm1 4.379 ppm2 0.835 OR { 2143} (segid " " and resid "52 " and name "HA ") (segid " " and resid "23 " and name "HG13") OR { 2143} (segid " " and resid "52 " and name "HA ") (segid " " and resid "23 " and name "HG12") ASSI { 2148} (segid " " and resid "52 " and name "HA ") (segid " " and resid "23 " and name "HG21") 5.000 5.000 0.000 peak 2148 weight 0.10000E+01 volume -0.55300E+00 ppm1 4.379 ppm2 1.072 OR { 2148} (segid " " and resid "52 " and name "HA ") (segid " " and resid "23 " and name "HG22") OR { 2148} (segid " " and resid "52 " and name "HA ") (segid " " and resid "23 " and name "HG23") ASSI { 2680} (segid " " and resid "27 " and name "HB2 ") (segid " " and resid "24 " and name "HA ") 5.000 5.000 0.000 peak 2680 weight 0.10000E+01 volume -0.33800E+00 ppm1 2.008 ppm2 3.944 ASSI { 2154} (segid " " and resid "52 " and name "HA ") (segid " " and resid "24 " and name "HA ") 6.000 6.000 0.000 peak 2154 weight 0.10000E+01 volume -0.15400E+00 ppm1 4.366 ppm2 3.944 ASSI { 1857} (segid " " and resid "29 " and name "HD2 ") (segid " " and resid "26 " and name "HA ") 5.000 5.000 0.000 peak 1857 weight 0.10000E+01 volume -0.30800E+00 ppm1 1.678 ppm2 4.551 ASSI { 2703} (segid " " and resid "27 " and name "HG2 ") (segid " " and resid "27 " and name "HA ") 5.000 5.000 0.000 peak 2703 weight 0.10000E+01 volume -0.45600E+00 ppm1 1.547 ppm2 4.366 ASSI { 2699} (segid " " and resid "27 " and name "HG2 ") (segid " " and resid "27 " and name "HB1 ") 5.000 5.000 0.000 peak 2699 weight 0.10000E+01 volume -0.69100E+00 ppm1 1.547 ppm2 1.415 ASSI { 2707} (segid " " and resid "27 " and name "HG2 ") (segid " " and resid "27 " and name "HE1 ") 5.000 5.000 0.000 peak 2707 weight 0.10000E+01 volume -0.33400E+00 ppm1 1.547 ppm2 2.759 ASSI { 1856} (segid " " and resid "29 " and name "HD2 ") (segid " " and resid "29 " and name "HA ") 6.000 6.000 0.000 peak 1856 weight 0.10000E+01 volume -0.22400E+00 ppm1 1.678 ppm2 4.182 ASSI { 5294} (segid " " and resid "29 " and name "HE1 ") (segid " " and resid "29 " and name "HG1 ") 5.000 5.000 0.000 peak 5294 weight 0.10000E+01 volume -0.94000E+00 ppm1 3.173 ppm2 1.815 ASSI { 2927} (segid " " and resid "29 " and name "HE2 ") (segid " " and resid "29 " and name "HG1 ") 5.000 5.000 0.000 peak 2927 weight 0.10000E+01 volume -0.12650E+01 ppm1 3.089 ppm2 1.818 ASSI { 2921} (segid " " and resid "33 " and name "HG1 ") (segid " " and resid "30 " and name "HA ") 6.000 6.000 0.000 peak 2921 weight 0.10000E+01 volume -0.11800E+00 ppm1 1.599 ppm2 3.312 ASSI { 2881} (segid " " and resid "32 " and name "HA ") (segid " " and resid "32 " and name "HB1 ") 3.300 3.300 0.000 peak 2881 weight 0.10000E+01 volume -0.21400E+01 ppm1 4.313 ppm2 2.811 ASSI { 2880} (segid " " and resid "32 " and name "HA ") (segid " " and resid "32 " and name "HB2 ") 3.300 3.300 0.000 peak 2880 weight 0.10000E+01 volume -0.20600E+01 ppm1 4.313 ppm2 2.732 ASSI { 2914} (segid " " and resid "33 " and name "HG2 ") (segid " " and resid "33 " and name "HA ") 5.000 5.000 0.000 peak 2914 weight 0.10000E+01 volume -0.73100E+00 ppm1 1.599 ppm2 4.313 OR { 2914} (segid " " and resid "33 " and name "HG1 ") (segid " " and resid "33 " and name "HA ") ASSI { 2913} (segid " " and resid "33 " and name "HG2 ") (segid " " and resid "33 " and name "HE2 ") 5.000 5.000 0.000 peak 2913 weight 0.10000E+01 volume -0.82100E+00 ppm1 1.599 ppm2 3.101 OR { 2913} (segid " " and resid "33 " and name "HG2 ") (segid " " and resid "33 " and name "HE1 ") OR { 2913} (segid " " and resid "33 " and name "HG1 ") (segid " " and resid "33 " and name "HE2 ") OR { 2913} (segid " " and resid "33 " and name "HG1 ") (segid " " and resid "33 " and name "HE1 ") ASSI { 2955} (segid " " and resid "34 " and name "HG1 ") (segid " " and resid "34 " and name "HA ") 5.000 5.000 0.000 peak 2955 weight 0.10000E+01 volume -0.63000E+00 ppm1 2.008 ppm2 4.498 OR { 2955} (segid " " and resid "34 " and name "HG2 ") (segid " " and resid "34 " and name "HA ") ASSI { 2954} (segid " " and resid "34 " and name "HG1 ") (segid " " and resid "34 " and name "HB2 ") 3.300 3.300 0.000 peak 2954 weight 0.10000E+01 volume -0.20410E+01 ppm1 2.008 ppm2 1.678 OR { 2954} (segid " " and resid "34 " and name "HG2 ") (segid " " and resid "34 " and name "HB2 ") ASSI { 5101} (segid " " and resid "34 " and name "HB1 ") (segid " " and resid "36 " and name "HD12") 5.000 5.000 0.000 peak 5101 weight 0.10000E+01 volume -0.17590E+01 ppm1 2.269 ppm2 0.790 OR { 5101} (segid " " and resid "34 " and name "HB1 ") (segid " " and resid "36 " and name "HD13") ASSI { 5423} (segid " " and resid "34 " and name "HG2 ") (segid " " and resid "36 " and name "HD13") 5.000 5.000 0.000 peak 5423 weight 0.10000E+01 volume -0.71300E+00 ppm1 2.001 ppm2 0.790 OR { 5423} (segid " " and resid "34 " and name "HG1 ") (segid " " and resid "36 " and name "HD11") OR { 5423} (segid " " and resid "34 " and name "HG1 ") (segid " " and resid "36 " and name "HD13") OR { 5423} (segid " " and resid "34 " and name "HG1 ") (segid " " and resid "36 " and name "HD12") ASSI { 3093} (segid " " and resid "38 " and name "HG1 ") (segid " " and resid "37 " and name "HA ") 6.000 6.000 0.000 peak 3093 weight 0.10000E+01 volume -0.19000E+00 ppm1 2.192 ppm2 4.603 ASSI { 5028} (segid " " and resid "38 " and name "HG1 ") (segid " " and resid "38 " and name "HA ") 5.000 5.000 0.000 peak 5028 weight 0.10000E+01 volume -0.94800E+00 ppm1 2.195 ppm2 4.057 ASSI { 3156} (segid " " and resid "41 " and name "HB1 ") (segid " " and resid "38 " and name "HA ") 5.000 5.000 0.000 peak 3156 weight 0.10000E+01 volume -0.74300E+00 ppm1 1.797 ppm2 4.076 ASSI { 2474} (segid " " and resid "38 " and name "HG1 ") (segid " " and resid "38 " and name "HD1 ") 3.300 3.300 0.000 peak 2474 weight 0.10000E+01 volume -0.22370E+01 ppm1 2.192 ppm2 3.734 OR { 2474} (segid " " and resid "38 " and name "HG1 ") (segid " " and resid "38 " and name "HD2 ") ASSI { 2936} (segid " " and resid "40 " and name "HA ") (segid " " and resid "40 " and name "HB1 ") 5.000 5.000 0.000 peak 2936 weight 0.10000E+01 volume -0.16510E+01 ppm1 4.471 ppm2 2.469 ASSI { 2928} (segid " " and resid "40 " and name "HA ") (segid " " and resid "40 " and name "HG1 ") 3.300 3.300 0.000 peak 2928 weight 0.10000E+01 volume -0.24260E+01 ppm1 4.471 ppm2 2.363 OR { 2928} (segid " " and resid "40 " and name "HA ") (segid " " and resid "40 " and name "HG2 ") ASSI { 3155} (segid " " and resid "41 " and name "HB1 ") (segid " " and resid "41 " and name "HA ") 5.000 5.000 0.000 peak 3155 weight 0.10000E+01 volume -0.76200E+00 ppm1 1.810 ppm2 4.103 ASSI { 2306} (segid " " and resid "42 " and name "HG2 ") (segid " " and resid "42 " and name "HB1 ") 5.000 5.000 0.000 peak 2306 weight 0.10000E+01 volume -0.12600E+01 ppm1 1.270 ppm2 1.705 ASSI { 4813} (segid " " and resid "70 " and name "HG13") (segid " " and resid "42 " and name "HD2 ") 5.000 5.000 0.000 peak 4813 weight 0.10000E+01 volume -0.11310E+01 ppm1 0.956 ppm2 3.075 OR { 4813} (segid " " and resid "70 " and name "HG11") (segid " " and resid "42 " and name "HD1 ") OR { 4813} (segid " " and resid "70 " and name "HG11") (segid " " and resid "42 " and name "HD2 ") OR { 4813} (segid " " and resid "70 " and name "HG12") (segid " " and resid "42 " and name "HD2 ") OR { 4813} (segid " " and resid "70 " and name "HG12") (segid " " and resid "42 " and name "HD1 ") ASSI { 2310} (segid " " and resid "42 " and name "HG2 ") (segid " " and resid "42 " and name "HD1 ") 5.000 5.000 0.000 peak 2310 weight 0.10000E+01 volume -0.10200E+01 ppm1 1.296 ppm2 3.075 OR { 2310} (segid " " and resid "42 " and name "HG2 ") (segid " " and resid "42 " and name "HD2 ") ASSI { 3159} (segid " " and resid "41 " and name "HB1 ") (segid " " and resid "43 " and name "HD22") 5.000 5.000 0.000 peak 3159 weight 0.10000E+01 volume -0.34300E+00 ppm1 1.797 ppm2 0.756 OR { 3159} (segid " " and resid "41 " and name "HB1 ") (segid " " and resid "43 " and name "HD21") ASSI { 2305} (segid " " and resid "44 " and name "HG11") (segid " " and resid "44 " and name "HA ") 5.000 5.000 0.000 peak 2305 weight 0.10000E+01 volume -0.45000E+00 ppm1 1.375 ppm2 4.919 ASSI { 5760} (segid " " and resid "49 " and name "HA ") (segid " " and resid "44 " and name "HD11") 5.000 5.000 0.000 peak 5760 weight 0.10000E+01 volume -0.85700E+00 ppm1 4.894 ppm2 0.657 OR { 5760} (segid " " and resid "49 " and name "HA ") (segid " " and resid "44 " and name "HD12") ASSI { 2912} (segid " " and resid "48 " and name "HG1 ") (segid " " and resid "48 " and name "HA ") 5.000 5.000 0.000 peak 2912 weight 0.10000E+01 volume -0.90700E+00 ppm1 1.586 ppm2 4.656 OR { 2912} (segid " " and resid "48 " and name "HG2 ") (segid " " and resid "48 " and name "HA ") ASSI { 3359} (segid " " and resid "48 " and name "HB2 ") (segid " " and resid "48 " and name "HA ") 5.000 5.000 0.000 peak 3359 weight 0.10000E+01 volume -0.10600E+01 ppm1 1.981 ppm2 4.656 ASSI { 4021} (segid " " and resid "48 " and name "HB1 ") (segid " " and resid "48 " and name "HA ") 5.000 5.000 0.000 peak 4021 weight 0.10000E+01 volume -0.80500E+00 ppm1 2.074 ppm2 4.656 ASSI { 2909} (segid " " and resid "48 " and name "HG1 ") (segid " " and resid "48 " and name "HD2 ") 2.700 2.700 0.000 peak 2909 weight 0.10000E+01 volume -0.43190E+01 ppm1 1.586 ppm2 1.942 OR { 2909} (segid " " and resid "48 " and name "HG2 ") (segid " " and resid "48 " and name "HD1 ") OR { 2909} (segid " " and resid "48 " and name "HG2 ") (segid " " and resid "48 " and name "HD2 ") OR { 2909} (segid " " and resid "48 " and name "HG1 ") (segid " " and resid "48 " and name "HD1 ") ASSI { 3467} (segid " " and resid "51 " and name "HB1 ") (segid " " and resid "51 " and name "HA ") 5.000 5.000 0.000 peak 3467 weight 0.10000E+01 volume -0.15550E+01 ppm1 2.192 ppm2 4.577 ASSI { 3773} (segid " " and resid "51 " and name "HB2 ") (segid " " and resid "51 " and name "HA ") 5.000 5.000 0.000 peak 3773 weight 0.10000E+01 volume -0.55800E+00 ppm1 1.916 ppm2 4.603 ASSI { 3466} (segid " " and resid "51 " and name "HB1 ") (segid " " and resid "51 " and name "HG1 ") 5.000 5.000 0.000 peak 3466 weight 0.10000E+01 volume -0.16250E+01 ppm1 2.192 ppm2 2.443 ASSI { 3770} (segid " " and resid "51 " and name "HB2 ") (segid " " and resid "51 " and name "HG1 ") 5.000 5.000 0.000 peak 3770 weight 0.10000E+01 volume -0.99500E+00 ppm1 1.929 ppm2 2.443 ASSI { 3768} (segid " " and resid "51 " and name "HB2 ") (segid " " and resid "51 " and name "HG2 ") 5.000 5.000 0.000 peak 3768 weight 0.10000E+01 volume -0.11080E+01 ppm1 1.929 ppm2 2.311 ASSI { 2145} (segid " " and resid "52 " and name "HA ") (segid " " and resid "52 " and name "HB2 ") 5.000 5.000 0.000 peak 2145 weight 0.10000E+01 volume -0.11320E+01 ppm1 4.379 ppm2 2.495 ASSI { 3507} (segid " " and resid "54 " and name "HG2 ") (segid " " and resid "54 " and name "HA ") 5.000 5.000 0.000 peak 3507 weight 0.10000E+01 volume -0.62600E+00 ppm1 1.665 ppm2 4.814 ASSI { 3504} (segid " " and resid "54 " and name "HG2 ") (segid " " and resid "54 " and name "HB1 ") 5.000 5.000 0.000 peak 3504 weight 0.10000E+01 volume -0.97500E+00 ppm1 1.665 ppm2 2.363 OR { 3504} (segid " " and resid "54 " and name "HG2 ") (segid " " and resid "54 " and name "HB2 ") ASSI { 2497} (segid " " and resid "20 " and name "HA ") (segid " " and resid "55 " and name "HB ") 5.000 5.000 0.000 peak 2497 weight 0.10000E+01 volume -0.17090E+01 ppm1 4.366 ppm2 4.471 ASSI { 5881} (segid " " and resid "56 " and name "HG ") (segid " " and resid "56 " and name "HB2 ") 2.700 2.700 0.000 peak 5881 weight 0.10000E+01 volume -0.48950E+01 ppm1 1.668 ppm2 1.869 ASSI { 3501} (segid " " and resid "56 " and name "HG ") (segid " " and resid "56 " and name "HD13") 5.000 5.000 0.000 peak 3501 weight 0.10000E+01 volume -0.12300E+01 ppm1 1.665 ppm2 0.414 OR { 3501} (segid " " and resid "56 " and name "HG ") (segid " " and resid "56 " and name "HD12") OR { 3501} (segid " " and resid "56 " and name "HG ") (segid " " and resid "56 " and name "HD11") ASSI { 3502} (segid " " and resid "56 " and name "HG ") (segid " " and resid "56 " and name "HD21") 5.000 5.000 0.000 peak 3502 weight 0.10000E+01 volume -0.11340E+01 ppm1 1.665 ppm2 0.308 OR { 3502} (segid " " and resid "56 " and name "HG ") (segid " " and resid "56 " and name "HD22") OR { 3502} (segid " " and resid "56 " and name "HG ") (segid " " and resid "56 " and name "HD23") ASSI { 2879} (segid " " and resid "58 " and name "HA ") (segid " " and resid "58 " and name "HB1 ") 3.300 3.300 0.000 peak 2879 weight 0.10000E+01 volume -0.23370E+01 ppm1 4.340 ppm2 2.311 ASSI { 2882} (segid " " and resid "58 " and name "HA ") (segid " " and resid "58 " and name "HB2 ") 5.000 5.000 0.000 peak 2882 weight 0.10000E+01 volume -0.13150E+01 ppm1 4.340 ppm2 3.022 ASSI { 3363} (segid " " and resid "48 " and name "HB2 ") (segid " " and resid "59 " and name "HD2 ") 6.000 6.000 0.000 peak 3363 weight 0.10000E+01 volume -0.14700E+00 ppm1 1.981 ppm2 7.265 OR { 3363} (segid " " and resid "48 " and name "HB2 ") (segid " " and resid "59 " and name "HD1 ") ASSI { 3512} (segid " " and resid "54 " and name "HG2 ") (segid " " and resid "59 " and name "HE2 ") 6.000 6.000 0.000 peak 3512 weight 0.10000E+01 volume -0.95000E-01 ppm1 1.665 ppm2 6.869 ASSI { 3364} (segid " " and resid "48 " and name "HB2 ") (segid " " and resid "59 " and name "HE2 ") 6.000 6.000 0.000 peak 3364 weight 0.10000E+01 volume -0.15600E+00 ppm1 1.981 ppm2 6.869 OR { 3364} (segid " " and resid "48 " and name "HB2 ") (segid " " and resid "59 " and name "HE1 ") ASSI { 5884} (segid " " and resid "56 " and name "HG ") (segid " " and resid "61 " and name "HD13") 5.000 5.000 0.000 peak 5884 weight 0.10000E+01 volume -0.13180E+01 ppm1 1.668 ppm2 0.383 OR { 5884} (segid " " and resid "56 " and name "HG ") (segid " " and resid "61 " and name "HD12") OR { 5884} (segid " " and resid "56 " and name "HG ") (segid " " and resid "61 " and name "HD11") ASSI { 6092} (segid " " and resid "61 " and name "HG11") (segid " " and resid "61 " and name "HG22") 5.000 5.000 0.000 peak 6092 weight 0.10000E+01 volume -0.70400E+00 ppm1 1.020 ppm2 0.334 OR { 6092} (segid " " and resid "61 " and name "HG11") (segid " " and resid "61 " and name "HG21") OR { 6092} (segid " " and resid "61 " and name "HG11") (segid " " and resid "61 " and name "HG23") ASSI { 3777} (segid " " and resid "62 " and name "HB2 ") (segid " " and resid "62 " and name "HA ") 5.000 5.000 0.000 peak 3777 weight 0.10000E+01 volume -0.50000E+00 ppm1 1.823 ppm2 4.551 ASSI { 6147} (segid " " and resid "62 " and name "HB1 ") (segid " " and resid "62 " and name "HA ") 5.000 5.000 0.000 peak 6147 weight 0.10000E+01 volume -0.16290E+01 ppm1 2.194 ppm2 4.545 ASSI { 3771} (segid " " and resid "63 " and name "HB1 ") (segid " " and resid "63 " and name "HG1 ") 5.000 5.000 0.000 peak 3771 weight 0.10000E+01 volume -0.80200E+00 ppm1 1.955 ppm2 1.547 ASSI { 2217} (segid " " and resid "66 " and name "HG23") (segid " " and resid "66 " and name "HB ") 3.300 3.300 0.000 peak 2217 weight 0.10000E+01 volume -0.32070E+01 ppm1 0.941 ppm2 4.129 OR { 2217} (segid " " and resid "66 " and name "HG21") (segid " " and resid "66 " and name "HB ") OR { 2217} (segid " " and resid "66 " and name "HG22") (segid " " and resid "66 " and name "HB ") ASSI { 1872} (segid " " and resid "3 " and name "HB ") (segid " " and resid "67 " and name "HD13") 5.000 5.000 0.000 peak 1872 weight 0.10000E+01 volume -0.82400E+00 ppm1 2.047 ppm2 0.703 OR { 1872} (segid " " and resid "3 " and name "HB ") (segid " " and resid "67 " and name "HD11") OR { 1872} (segid " " and resid "3 " and name "HB ") (segid " " and resid "67 " and name "HD12") ASSI { 4048} (segid " " and resid "66 " and name "HG23") (segid " " and resid "68 " and name "HA ") 6.000 6.000 0.000 peak 4048 weight 0.10000E+01 volume -0.13000E+00 ppm1 0.927 ppm2 4.972 OR { 4048} (segid " " and resid "66 " and name "HG22") (segid " " and resid "68 " and name "HA ") OR { 4048} (segid " " and resid "66 " and name "HG21") (segid " " and resid "68 " and name "HA ") OR { 4048} (segid " " and resid "70 " and name "HG12") (segid " " and resid "68 " and name "HA ") OR { 4048} (segid " " and resid "70 " and name "HG13") (segid " " and resid "68 " and name "HA ") ASSI { 4816} (segid " " and resid "70 " and name "HG12") (segid " " and resid "68 " and name "HB2 ") 5.000 5.000 0.000 peak 4816 weight 0.10000E+01 volume -0.15930E+01 ppm1 0.956 ppm2 3.092 OR { 4816} (segid " " and resid "70 " and name "HG11") (segid " " and resid "68 " and name "HB1 ") OR { 4816} (segid " " and resid "70 " and name "HG11") (segid " " and resid "68 " and name "HB2 ") OR { 4816} (segid " " and resid "70 " and name "HG13") (segid " " and resid "68 " and name "HB1 ") OR { 4816} (segid " " and resid "70 " and name "HG13") (segid " " and resid "68 " and name "HB2 ") ASSI { 4042} (segid " " and resid "66 " and name "HG22") (segid " " and resid "68 " and name "HD2 ") 5.000 5.000 0.000 peak 4042 weight 0.10000E+01 volume -0.34900E+00 ppm1 0.941 ppm2 7.054 OR { 4042} (segid " " and resid "66 " and name "HG23") (segid " " and resid "68 " and name "HD2 ") OR { 4042} (segid " " and resid "66 " and name "HG21") (segid " " and resid "68 " and name "HD2 ") ASSI { 3158} (segid " " and resid "41 " and name "HB1 ") (segid " " and resid "69 " and name "HD11") 5.000 5.000 0.000 peak 3158 weight 0.10000E+01 volume -0.53300E+00 ppm1 1.797 ppm2 0.861 OR { 3158} (segid " " and resid "41 " and name "HB1 ") (segid " " and resid "69 " and name "HD13") OR { 3158} (segid " " and resid "41 " and name "HB1 ") (segid " " and resid "69 " and name "HD12") ASSI { 2956} (segid " " and resid "34 " and name "HG1 ") (segid " " and resid "69 " and name "HD21") 5.000 5.000 0.000 peak 2956 weight 0.10000E+01 volume -0.70900E+00 ppm1 2.008 ppm2 0.782 OR { 2956} (segid " " and resid "34 " and name "HG1 ") (segid " " and resid "69 " and name "HD23") OR { 2956} (segid " " and resid "34 " and name "HG1 ") (segid " " and resid "69 " and name "HD22") OR { 2956} (segid " " and resid "34 " and name "HG2 ") (segid " " and resid "69 " and name "HD22") OR { 2956} (segid " " and resid "30 " and name "HB ") (segid " " and resid "69 " and name "HD22") OR { 2956} (segid " " and resid "30 " and name "HB ") (segid " " and resid "69 " and name "HD23") OR { 2956} (segid " " and resid "30 " and name "HB ") (segid " " and resid "69 " and name "HD21") ASSI { 2233} (segid " " and resid "70 " and name "HG12") (segid " " and resid "70 " and name "HA ") 5.000 5.000 0.000 peak 2233 weight 0.10000E+01 volume -0.13160E+01 ppm1 0.927 ppm2 4.392 OR { 2233} (segid " " and resid "70 " and name "HG11") (segid " " and resid "70 " and name "HA ") OR { 2233} (segid " " and resid "70 " and name "HG13") (segid " " and resid "70 " and name "HA ") ASSI { 1804} (segid " " and resid "1 " and name "HA ") (segid " " and resid "63 " and name "HG1 ") 6.000 6.000 0.000 peak 1804 weight 0.10000E+01 volume -0.11900E+00 ppm1 4.182 ppm2 1.520 OR { 1804} (segid " " and resid "1 " and name "HA ") (segid " " and resid "1 " and name "HE1 ") ASSI { 1806} (segid " " and resid "1 " and name "HA ") (segid " " and resid "2 " and name "HB2 ") 6.000 6.000 0.000 peak 1806 weight 0.10000E+01 volume -0.12200E+00 ppm1 4.182 ppm2 1.652 ASSI { 1802} (segid " " and resid "1 " and name "HA ") (segid " " and resid "1 " and name "HG1 ") 5.000 5.000 0.000 peak 1802 weight 0.10000E+01 volume -0.31100E+00 ppm1 4.182 ppm2 2.495 ASSI { 1808} (segid " " and resid "1 " and name "HA ") (segid " " and resid "63 " and name "HA ") 6.000 6.000 0.000 peak 1808 weight 0.10000E+01 volume -0.77000E-01 ppm1 4.182 ppm2 3.918 ASSI { 1803} (segid " " and resid "1 " and name "HA ") (segid " " and resid "2 " and name "HA ") 6.000 6.000 0.000 peak 1803 weight 0.10000E+01 volume -0.16600E+00 ppm1 4.182 ppm2 4.788 ASSI { 2373} (segid " " and resid "1 " and name "HA ") (segid " " and resid "1 " and name "HB2 ") 3.300 3.300 0.000 peak 2373 weight 0.10000E+01 volume -0.30800E+01 ppm1 4.180 ppm2 2.014 OR { 2373} (segid " " and resid "1 " and name "HA ") (segid " " and resid "1 " and name "HG2 ") ASSI { 1811} (segid " " and resid "1 " and name "HB1 ") (segid " " and resid "1 " and name "HG1 ") 5.000 5.000 0.000 peak 1811 weight 0.10000E+01 volume -0.54200E+00 ppm1 2.126 ppm2 2.495 ASSI { 1815} (segid " " and resid "1 " and name "HB2 ") (segid " " and resid "1 " and name "HB1 ") 3.300 3.300 0.000 peak 1815 weight 0.10000E+01 volume -0.32460E+01 ppm1 2.021 ppm2 2.126 ASSI { 1974} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "17 " and name "HG12") 5.000 5.000 0.000 peak 1974 weight 0.10000E+01 volume -0.66900E+00 ppm1 1.520 ppm2 0.677 OR { 1974} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "17 " and name "HG11") OR { 1974} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "67 " and name "HD13") OR { 1974} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "17 " and name "HG13") OR { 1974} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "17 " and name "HG12") OR { 1974} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "67 " and name "HD12") OR { 1974} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "17 " and name "HG13") OR { 1974} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "17 " and name "HG11") OR { 1974} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "17 " and name "HG11") OR { 1974} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "67 " and name "HD12") OR { 1974} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "67 " and name "HD12") OR { 1974} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "67 " and name "HD13") OR { 1974} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "17 " and name "HG12") OR { 1974} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "67 " and name "HD13") OR { 1974} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "67 " and name "HD11") OR { 1974} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "67 " and name "HD11") ASSI { 1980} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "63 " and name "HB2 ") 6.000 6.000 0.000 peak 1980 weight 0.10000E+01 volume -0.29600E+00 ppm1 1.520 ppm2 1.784 OR { 1980} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "63 " and name "HB2 ") OR { 1980} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "63 " and name "HB2 ") ASSI { 1977} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "56 " and name "HB2 ") 5.000 5.000 0.000 peak 1977 weight 0.10000E+01 volume -0.39700E+00 ppm1 1.520 ppm2 1.889 OR { 1977} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "56 " and name "HB2 ") OR { 1977} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "56 " and name "HB2 ") OR { 1977} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "63 " and name "HB1 ") ASSI { 1966} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "19 " and name "HG2 ") 3.300 3.300 0.000 peak 1966 weight 0.10000E+01 volume -0.27460E+01 ppm1 1.520 ppm2 2.021 OR { 1966} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "1 " and name "HG2 ") OR { 1966} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "1 " and name "HG2 ") OR { 1966} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "1 " and name "HG2 ") OR { 1966} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "19 " and name "HG2 ") OR { 1966} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "19 " and name "HG2 ") ASSI { 1968} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "1 " and name "HG1 ") 5.000 5.000 0.000 peak 1968 weight 0.10000E+01 volume -0.14350E+01 ppm1 1.520 ppm2 2.495 OR { 1968} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "1 " and name "HG1 ") OR { 1968} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "1 " and name "HG1 ") ASSI { 4474} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "63 " and name "HA ") 5.000 5.000 0.000 peak 4474 weight 0.10000E+01 volume -0.10250E+01 ppm1 1.519 ppm2 3.935 OR { 4474} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "63 " and name "HA ") OR { 4474} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "63 " and name "HA ") ASSI { 4480} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "19 " and name "HG1 ") 5.000 5.000 0.000 peak 4480 weight 0.10000E+01 volume -0.66000E+00 ppm1 1.519 ppm2 2.193 ASSI { 1833} (segid " " and resid "1 " and name "HG2 ") (segid " " and resid "63 " and name "HA ") 5.000 5.000 0.000 peak 1833 weight 0.10000E+01 volume -0.38400E+00 ppm1 2.032 ppm2 3.940 ASSI { 4128} (segid " " and resid "2 " and name "HG1 ") (segid " " and resid "2 " and name "HA ") 5.000 5.000 0.000 peak 4128 weight 0.10000E+01 volume -0.32300E+00 ppm1 2.311 ppm2 4.788 ASSI { 1859} (segid " " and resid "3 " and name "HA ") (segid " " and resid "3 " and name "HB ") 3.300 3.300 0.000 peak 1859 weight 0.10000E+01 volume -0.29050E+01 ppm1 4.182 ppm2 2.047 ASSI { 1862} (segid " " and resid "3 " and name "HA ") (segid " " and resid "63 " and name "HA ") 6.000 6.000 0.000 peak 1862 weight 0.10000E+01 volume -0.17500E+00 ppm1 4.182 ppm2 3.944 OR { 1862} (segid " " and resid "3 " and name "HA ") (segid " " and resid "65 " and name "HB1 ") ASSI { 1865} (segid " " and resid "3 " and name "HA ") (segid " " and resid "2 " and name "HA ") 6.000 6.000 0.000 peak 1865 weight 0.10000E+01 volume -0.60000E-01 ppm1 4.182 ppm2 4.788 ASSI { 1897} (segid " " and resid "3 " and name "HG13") (segid " " and resid "2 " and name "HB1 ") 6.000 6.000 0.000 peak 1897 weight 0.10000E+01 volume -0.12600E+00 ppm1 0.572 ppm2 1.863 OR { 1897} (segid " " and resid "3 " and name "HG11") (segid " " and resid "2 " and name "HB1 ") OR { 1897} (segid " " and resid "3 " and name "HG12") (segid " " and resid "2 " and name "HB1 ") OR { 1897} (segid " " and resid "3 " and name "HG11") (segid " " and resid "62 " and name "HB2 ") OR { 1897} (segid " " and resid "3 " and name "HG13") (segid " " and resid "62 " and name "HB2 ") OR { 1897} (segid " " and resid "3 " and name "HG11") (segid " " and resid "56 " and name "HB2 ") OR { 1897} (segid " " and resid "3 " and name "HG12") (segid " " and resid "67 " and name "HB ") OR { 1897} (segid " " and resid "3 " and name "HG11") (segid " " and resid "67 " and name "HB ") OR { 1897} (segid " " and resid "3 " and name "HG13") (segid " " and resid "67 " and name "HB ") OR { 1897} (segid " " and resid "3 " and name "HG12") (segid " " and resid "62 " and name "HB2 ") OR { 1897} (segid " " and resid "3 " and name "HG12") (segid " " and resid "56 " and name "HB2 ") OR { 1897} (segid " " and resid "3 " and name "HG13") (segid " " and resid "56 " and name "HB2 ") OR { 1897} (segid " " and resid "3 " and name "HG11") (segid " " and resid "16 " and name "HB2 ") OR { 1897} (segid " " and resid "3 " and name "HG13") (segid " " and resid "16 " and name "HB2 ") OR { 1897} (segid " " and resid "3 " and name "HG12") (segid " " and resid "16 " and name "HB2 ") ASSI { 1895} (segid " " and resid "3 " and name "HG12") (segid " " and resid "15 " and name "HG23") 6.000 6.000 0.000 peak 1895 weight 0.10000E+01 volume -0.13300E+00 ppm1 0.572 ppm2 0.941 OR { 1895} (segid " " and resid "3 " and name "HG13") (segid " " and resid "15 " and name "HG22") OR { 1895} (segid " " and resid "3 " and name "HG13") (segid " " and resid "15 " and name "HG23") OR { 1895} (segid " " and resid "3 " and name "HG11") (segid " " and resid "15 " and name "HG22") OR { 1895} (segid " " and resid "3 " and name "HG12") (segid " " and resid "15 " and name "HG22") OR { 1895} (segid " " and resid "3 " and name "HG13") (segid " " and resid "15 " and name "HG21") OR { 1895} (segid " " and resid "3 " and name "HG11") (segid " " and resid "15 " and name "HG21") OR { 1895} (segid " " and resid "3 " and name "HG12") (segid " " and resid "15 " and name "HG21") OR { 1895} (segid " " and resid "3 " and name "HG11") (segid " " and resid "15 " and name "HG23") OR { 1895} (segid " " and resid "3 " and name "HG12") (segid " " and resid "66 " and name "HG23") OR { 1895} (segid " " and resid "3 " and name "HG11") (segid " " and resid "67 " and name "HG23") OR { 1895} (segid " " and resid "3 " and name "HG12") (segid " " and resid "67 " and name "HG22") OR { 1895} (segid " " and resid "3 " and name "HG12") (segid " " and resid "67 " and name "HG21") ASSI { 1888} (segid " " and resid "3 " and name "HG12") (segid " " and resid "3 " and name "HB ") 3.300 3.300 0.000 peak 1888 weight 0.10000E+01 volume -0.28690E+01 ppm1 0.572 ppm2 2.047 OR { 1888} (segid " " and resid "3 " and name "HG11") (segid " " and resid "3 " and name "HB ") OR { 1888} (segid " " and resid "3 " and name "HG13") (segid " " and resid "3 " and name "HB ") OR { 1888} (segid " " and resid "3 " and name "HG11") (segid " " and resid "1 " and name "HG2 ") OR { 1888} (segid " " and resid "3 " and name "HG12") (segid " " and resid "1 " and name "HG2 ") ASSI { 1894} (segid " " and resid "3 " and name "HG13") (segid " " and resid "1 " and name "HG1 ") 6.000 6.000 0.000 peak 1894 weight 0.10000E+01 volume -0.23000E+00 ppm1 0.572 ppm2 2.495 OR { 1894} (segid " " and resid "3 " and name "HG11") (segid " " and resid "1 " and name "HG1 ") OR { 1894} (segid " " and resid "3 " and name "HG12") (segid " " and resid "1 " and name "HG1 ") ASSI { 1892} (segid " " and resid "3 " and name "HG11") (segid " " and resid "63 " and name "HA ") 5.000 5.000 0.000 peak 1892 weight 0.10000E+01 volume -0.59000E+00 ppm1 0.572 ppm2 3.944 OR { 1892} (segid " " and resid "3 " and name "HG12") (segid " " and resid "63 " and name "HA ") OR { 1892} (segid " " and resid "3 " and name "HG13") (segid " " and resid "63 " and name "HA ") OR { 1892} (segid " " and resid "3 " and name "HG13") (segid " " and resid "65 " and name "HB1 ") ASSI { 1898} (segid " " and resid "3 " and name "HG13") (segid " " and resid "2 " and name "HA ") 6.000 6.000 0.000 peak 1898 weight 0.10000E+01 volume -0.60000E-01 ppm1 0.572 ppm2 4.788 OR { 1898} (segid " " and resid "3 " and name "HG12") (segid " " and resid "2 " and name "HA ") OR { 1898} (segid " " and resid "3 " and name "HG11") (segid " " and resid "2 " and name "HA ") ASSI { 1868} (segid " " and resid "3 " and name "HG23") (segid " " and resid "17 " and name "HG21") 5.000 5.000 0.000 peak 1868 weight 0.10000E+01 volume -0.15100E+01 ppm1 0.585 ppm2 0.387 OR { 1868} (segid " " and resid "3 " and name "HG22") (segid " " and resid "17 " and name "HG23") OR { 1868} (segid " " and resid "3 " and name "HG21") (segid " " and resid "17 " and name "HG23") OR { 1868} (segid " " and resid "3 " and name "HG21") (segid " " and resid "17 " and name "HG22") OR { 1868} (segid " " and resid "3 " and name "HG21") (segid " " and resid "17 " and name "HG21") OR { 1868} (segid " " and resid "3 " and name "HG22") (segid " " and resid "17 " and name "HG22") ASSI { 1875} (segid " " and resid "3 " and name "HG21") (segid " " and resid "15 " and name "HG22") 5.000 5.000 0.000 peak 1875 weight 0.10000E+01 volume -0.69200E+00 ppm1 0.585 ppm2 0.941 OR { 1875} (segid " " and resid "3 " and name "HG22") (segid " " and resid "15 " and name "HG23") OR { 1875} (segid " " and resid "3 " and name "HG22") (segid " " and resid "15 " and name "HG22") OR { 1875} (segid " " and resid "3 " and name "HG23") (segid " " and resid "15 " and name "HG22") OR { 1875} (segid " " and resid "3 " and name "HG21") (segid " " and resid "15 " and name "HG23") OR { 1875} (segid " " and resid "3 " and name "HG23") (segid " " and resid "15 " and name "HG21") OR { 1875} (segid " " and resid "3 " and name "HG21") (segid " " and resid "15 " and name "HG21") OR { 1875} (segid " " and resid "3 " and name "HG22") (segid " " and resid "15 " and name "HG21") ASSI { 1882} (segid " " and resid "3 " and name "HG21") (segid " " and resid "5 " and name "HB2 ") 6.000 6.000 0.000 peak 1882 weight 0.10000E+01 volume -0.16500E+00 ppm1 0.585 ppm2 1.125 OR { 1882} (segid " " and resid "3 " and name "HG22") (segid " " and resid "5 " and name "HB2 ") OR { 1882} (segid " " and resid "3 " and name "HG23") (segid " " and resid "5 " and name "HB2 ") OR { 1882} (segid " " and resid "3 " and name "HG21") (segid " " and resid "14 " and name "HG21") OR { 1882} (segid " " and resid "3 " and name "HG21") (segid " " and resid "14 " and name "HG23") OR { 1882} (segid " " and resid "3 " and name "HG23") (segid " " and resid "14 " and name "HG21") ASSI { 1885} (segid " " and resid "3 " and name "HG21") (segid " " and resid "15 " and name "HG12") 6.000 6.000 0.000 peak 1885 weight 0.10000E+01 volume -0.14500E+00 ppm1 0.585 ppm2 1.230 OR { 1885} (segid " " and resid "3 " and name "HG22") (segid " " and resid "15 " and name "HG12") OR { 1885} (segid " " and resid "3 " and name "HG23") (segid " " and resid "15 " and name "HG12") OR { 1885} (segid " " and resid "3 " and name "HG22") (segid " " and resid "67 " and name "HG12") OR { 1885} (segid " " and resid "3 " and name "HG23") (segid " " and resid "67 " and name "HG12") ASSI { 1877} (segid " " and resid "3 " and name "HG21") (segid " " and resid "1 " and name "HE1 ") 6.000 6.000 0.000 peak 1877 weight 0.10000E+01 volume -0.23700E+00 ppm1 0.585 ppm2 1.520 OR { 1877} (segid " " and resid "3 " and name "HG21") (segid " " and resid "1 " and name "HE3 ") OR { 1877} (segid " " and resid "3 " and name "HG22") (segid " " and resid "67 " and name "HG11") OR { 1877} (segid " " and resid "3 " and name "HG23") (segid " " and resid "67 " and name "HG11") OR { 1877} (segid " " and resid "3 " and name "HG21") (segid " " and resid "67 " and name "HG11") OR { 1877} (segid " " and resid "3 " and name "HG22") (segid " " and resid "1 " and name "HE1 ") OR { 1877} (segid " " and resid "3 " and name "HG23") (segid " " and resid "1 " and name "HE3 ") OR { 1877} (segid " " and resid "3 " and name "HG21") (segid " " and resid "1 " and name "HE2 ") OR { 1877} (segid " " and resid "3 " and name "HG22") (segid " " and resid "1 " and name "HE2 ") OR { 1877} (segid " " and resid "3 " and name "HG22") (segid " " and resid "1 " and name "HE3 ") ASSI { 1879} (segid " " and resid "3 " and name "HG23") (segid " " and resid "67 " and name "HB ") 6.000 6.000 0.000 peak 1879 weight 0.10000E+01 volume -0.16400E+00 ppm1 0.585 ppm2 1.863 OR { 1879} (segid " " and resid "3 " and name "HG21") (segid " " and resid "67 " and name "HB ") OR { 1879} (segid " " and resid "3 " and name "HG22") (segid " " and resid "67 " and name "HB ") OR { 1879} (segid " " and resid "3 " and name "HG21") (segid " " and resid "5 " and name "HB1 ") OR { 1879} (segid " " and resid "3 " and name "HG21") (segid " " and resid "2 " and name "HB1 ") OR { 1879} (segid " " and resid "3 " and name "HG23") (segid " " and resid "2 " and name "HB1 ") OR { 1879} (segid " " and resid "3 " and name "HG22") (segid " " and resid "2 " and name "HB1 ") OR { 1879} (segid " " and resid "3 " and name "HG23") (segid " " and resid "5 " and name "HB1 ") OR { 1879} (segid " " and resid "3 " and name "HG22") (segid " " and resid "5 " and name "HB1 ") OR { 1879} (segid " " and resid "3 " and name "HG23") (segid " " and resid "29 " and name "HD1 ") OR { 1879} (segid " " and resid "3 " and name "HG21") (segid " " and resid "29 " and name "HD1 ") ASSI { 1867} (segid " " and resid "3 " and name "HG22") (segid " " and resid "3 " and name "HB ") 3.300 3.300 0.000 peak 1867 weight 0.10000E+01 volume -0.21870E+01 ppm1 0.585 ppm2 2.047 OR { 1867} (segid " " and resid "3 " and name "HG21") (segid " " and resid "3 " and name "HB ") OR { 1867} (segid " " and resid "3 " and name "HG23") (segid " " and resid "3 " and name "HB ") ASSI { 1884} (segid " " and resid "3 " and name "HG23") (segid " " and resid "2 " and name "HA ") 6.000 6.000 0.000 peak 1884 weight 0.10000E+01 volume -0.92000E-01 ppm1 0.585 ppm2 4.788 OR { 1884} (segid " " and resid "3 " and name "HG21") (segid " " and resid "2 " and name "HA ") OR { 1884} (segid " " and resid "3 " and name "HG22") (segid " " and resid "2 " and name "HA ") ASSI { 1886} (segid " " and resid "3 " and name "HG21") (segid " " and resid "26 " and name "HD1 ") 6.000 6.000 0.000 peak 1886 weight 0.10000E+01 volume -0.11700E+00 ppm1 0.585 ppm2 7.054 OR { 1886} (segid " " and resid "3 " and name "HG21") (segid " " and resid "4 " and name "HD1 ") OR { 1886} (segid " " and resid "3 " and name "HG22") (segid " " and resid "26 " and name "HD1 ") OR { 1886} (segid " " and resid "3 " and name "HG23") (segid " " and resid "4 " and name "HD1 ") OR { 1886} (segid " " and resid "3 " and name "HG21") (segid " " and resid "26 " and name "HD2 ") OR { 1886} (segid " " and resid "3 " and name "HG21") (segid " " and resid "4 " and name "HD2 ") OR { 1886} (segid " " and resid "3 " and name "HG23") (segid " " and resid "26 " and name "HD1 ") OR { 1886} (segid " " and resid "3 " and name "HG22") (segid " " and resid "26 " and name "HD2 ") OR { 1886} (segid " " and resid "3 " and name "HG23") (segid " " and resid "26 " and name "HD2 ") OR { 1886} (segid " " and resid "3 " and name "HG22") (segid " " and resid "4 " and name "HD2 ") ASSI { 1887} (segid " " and resid "3 " and name "HG23") (segid " " and resid "15 " and name "HG11") 6.000 6.000 0.000 peak 1887 weight 0.10000E+01 volume -0.12300E+00 ppm1 0.585 ppm2 1.362 OR { 1887} (segid " " and resid "3 " and name "HG21") (segid " " and resid "15 " and name "HG11") OR { 1887} (segid " " and resid "3 " and name "HG22") (segid " " and resid "15 " and name "HG11") ASSI { 1910} (segid " " and resid "4 " and name "HA ") (segid " " and resid "13 " and name "HG13") 6.000 6.000 0.000 peak 1910 weight 0.10000E+01 volume -0.11500E+00 ppm1 5.460 ppm2 0.914 OR { 1910} (segid " " and resid "4 " and name "HA ") (segid " " and resid "13 " and name "HG12") OR { 1910} (segid " " and resid "4 " and name "HA ") (segid " " and resid "13 " and name "HG11") OR { 1910} (segid " " and resid "4 " and name "HA ") (segid " " and resid "66 " and name "HG22") OR { 1910} (segid " " and resid "4 " and name "HA ") (segid " " and resid "66 " and name "HG23") OR { 1910} (segid " " and resid "4 " and name "HA ") (segid " " and resid "66 " and name "HG21") OR { 1910} (segid " " and resid "4 " and name "HA ") (segid " " and resid "13 " and name "HG23") ASSI { 1913} (segid " " and resid "4 " and name "HA ") (segid " " and resid "3 " and name "HA ") 6.000 6.000 0.000 peak 1913 weight 0.10000E+01 volume -0.78000E-01 ppm1 5.433 ppm2 4.182 ASSI { 1992} (segid " " and resid "4 " and name "HD2 ") (segid " " and resid "12 " and name "HG22") 5.000 5.000 0.000 peak 1992 weight 0.10000E+01 volume -0.48900E+00 ppm1 7.041 ppm2 1.046 OR { 1992} (segid " " and resid "4 " and name "HD1 ") (segid " " and resid "12 " and name "HG23") OR { 1992} (segid " " and resid "4 " and name "HD2 ") (segid " " and resid "12 " and name "HG21") OR { 1992} (segid " " and resid "4 " and name "HD1 ") (segid " " and resid "12 " and name "HG22") ASSI { 1982} (segid " " and resid "4 " and name "HD2 ") (segid " " and resid "4 " and name "HE2 ") 5.000 5.000 0.000 peak 1982 weight 0.10000E+01 volume -0.19660E+01 ppm1 7.041 ppm2 7.265 OR { 1982} (segid " " and resid "4 " and name "HD1 ") (segid " " and resid "4 " and name "HE1 ") ASSI { 1990} (segid " " and resid "4 " and name "HZ ") (segid " " and resid "14 " and name "HG23") 6.000 6.000 0.000 peak 1990 weight 0.10000E+01 volume -0.11800E+00 ppm1 7.251 ppm2 1.099 OR { 1990} (segid " " and resid "4 " and name "HZ ") (segid " " and resid "14 " and name "HG22") OR { 1990} (segid " " and resid "4 " and name "HZ ") (segid " " and resid "14 " and name "HG21") ASSI { 1927} (segid " " and resid "5 " and name "HA ") (segid " " and resid "5 " and name "HD11") 3.300 3.300 0.000 peak 1927 weight 0.10000E+01 volume -0.20610E+01 ppm1 5.446 ppm2 0.756 OR { 1927} (segid " " and resid "5 " and name "HA ") (segid " " and resid "5 " and name "HD12") OR { 1927} (segid " " and resid "5 " and name "HA ") (segid " " and resid "5 " and name "HD13") ASSI { 1931} (segid " " and resid "5 " and name "HA ") (segid " " and resid "66 " and name "HG23") 5.000 5.000 0.000 peak 1931 weight 0.10000E+01 volume -0.38700E+00 ppm1 5.446 ppm2 0.967 OR { 1931} (segid " " and resid "5 " and name "HA ") (segid " " and resid "66 " and name "HG22") OR { 1931} (segid " " and resid "5 " and name "HA ") (segid " " and resid "66 " and name "HG21") OR { 1931} (segid " " and resid "5 " and name "HA ") (segid " " and resid "13 " and name "HG13") OR { 1931} (segid " " and resid "5 " and name "HA ") (segid " " and resid "67 " and name "HG21") OR { 1931} (segid " " and resid "5 " and name "HA ") (segid " " and resid "67 " and name "HG23") ASSI { 1939} (segid " " and resid "5 " and name "HB1 ") (segid " " and resid "30 " and name "HG22") 6.000 6.000 0.000 peak 1939 weight 0.10000E+01 volume -0.18500E+00 ppm1 1.902 ppm2 0.572 OR { 1939} (segid " " and resid "5 " and name "HB1 ") (segid " " and resid "30 " and name "HG23") OR { 1939} (segid " " and resid "5 " and name "HB1 ") (segid " " and resid "3 " and name "HG21") OR { 1939} (segid " " and resid "5 " and name "HB1 ") (segid " " and resid "3 " and name "HG23") OR { 1939} (segid " " and resid "5 " and name "HB1 ") (segid " " and resid "3 " and name "HG22") ASSI { 1936} (segid " " and resid "5 " and name "HB1 ") (segid " " and resid "13 " and name "HG21") 5.000 5.000 0.000 peak 1936 weight 0.10000E+01 volume -0.66100E+00 ppm1 1.902 ppm2 0.888 OR { 1936} (segid " " and resid "5 " and name "HB1 ") (segid " " and resid "13 " and name "HG23") OR { 1936} (segid " " and resid "5 " and name "HB1 ") (segid " " and resid "13 " and name "HG22") ASSI { 4603} (segid " " and resid "5 " and name "HB1 ") (segid " " and resid "5 " and name "HD23") 5.000 5.000 0.000 peak 4603 weight 0.10000E+01 volume -0.92400E+00 ppm1 1.899 ppm2 0.657 OR { 4603} (segid " " and resid "5 " and name "HB1 ") (segid " " and resid "5 " and name "HD22") OR { 4603} (segid " " and resid "5 " and name "HB1 ") (segid " " and resid "5 " and name "HD21") ASSI { 1945} (segid " " and resid "5 " and name "HB2 ") (segid " " and resid "13 " and name "HG22") 5.000 5.000 0.000 peak 1945 weight 0.10000E+01 volume -0.31800E+00 ppm1 1.125 ppm2 0.888 OR { 1945} (segid " " and resid "5 " and name "HB2 ") (segid " " and resid "13 " and name "HG21") OR { 1945} (segid " " and resid "5 " and name "HB2 ") (segid " " and resid "13 " and name "HG23") ASSI { 2011} (segid " " and resid "5 " and name "HD11") (segid " " and resid "30 " and name "HG12") 6.000 6.000 0.000 peak 2011 weight 0.10000E+01 volume -0.27400E+00 ppm1 0.756 ppm2 0.334 OR { 2011} (segid " " and resid "5 " and name "HD13") (segid " " and resid "30 " and name "HG12") OR { 2011} (segid " " and resid "5 " and name "HD12") (segid " " and resid "30 " and name "HG12") ASSI { 2003} (segid " " and resid "5 " and name "HD12") (segid " " and resid "5 " and name "HG ") 3.300 3.300 0.000 peak 2003 weight 0.10000E+01 volume -0.26770E+01 ppm1 0.756 ppm2 1.283 OR { 2003} (segid " " and resid "5 " and name "HD13") (segid " " and resid "5 " and name "HG ") OR { 2003} (segid " " and resid "5 " and name "HD12") (segid " " and resid "69 " and name "HB2 ") OR { 2003} (segid " " and resid "5 " and name "HD11") (segid " " and resid "5 " and name "HG ") OR { 2003} (segid " " and resid "5 " and name "HD11") (segid " " and resid "69 " and name "HB2 ") ASSI { 2013} (segid " " and resid "5 " and name "HD13") (segid " " and resid "13 " and name "HB ") 6.000 6.000 0.000 peak 2013 weight 0.10000E+01 volume -0.82000E-01 ppm1 0.756 ppm2 2.153 OR { 2013} (segid " " and resid "5 " and name "HD11") (segid " " and resid "13 " and name "HB ") OR { 2013} (segid " " and resid "5 " and name "HD12") (segid " " and resid "13 " and name "HB ") ASSI { 2010} (segid " " and resid "5 " and name "HD12") (segid " " and resid "67 " and name "HA ") 6.000 6.000 0.000 peak 2010 weight 0.10000E+01 volume -0.22000E+00 ppm1 0.756 ppm2 4.709 OR { 2010} (segid " " and resid "5 " and name "HD11") (segid " " and resid "67 " and name "HA ") OR { 2010} (segid " " and resid "5 " and name "HD13") (segid " " and resid "67 " and name "HA ") OR { 2010} (segid " " and resid "5 " and name "HD12") (segid " " and resid "7 " and name "HA ") OR { 2010} (segid " " and resid "5 " and name "HD11") (segid " " and resid "7 " and name "HA ") ASSI { 2005} (segid " " and resid "5 " and name "HD11") (segid " " and resid "5 " and name "HB2 ") 5.000 5.000 0.000 peak 2005 weight 0.10000E+01 volume -0.15010E+01 ppm1 0.756 ppm2 1.125 OR { 2005} (segid " " and resid "5 " and name "HD13") (segid " " and resid "5 " and name "HB2 ") OR { 2005} (segid " " and resid "5 " and name "HD12") (segid " " and resid "5 " and name "HB2 ") ASSI { 2016} (segid " " and resid "5 " and name "HD21") (segid " " and resid "13 " and name "HG12") 5.000 5.000 0.000 peak 2016 weight 0.10000E+01 volume -0.38500E+00 ppm1 0.690 ppm2 0.993 OR { 2016} (segid " " and resid "5 " and name "HD22") (segid " " and resid "13 " and name "HG13") OR { 2016} (segid " " and resid "5 " and name "HD23") (segid " " and resid "13 " and name "HG13") OR { 2016} (segid " " and resid "5 " and name "HD21") (segid " " and resid "13 " and name "HG13") OR { 2016} (segid " " and resid "5 " and name "HD22") (segid " " and resid "13 " and name "HG11") OR { 2016} (segid " " and resid "5 " and name "HD21") (segid " " and resid "13 " and name "HG11") OR { 2016} (segid " " and resid "5 " and name "HD23") (segid " " and resid "13 " and name "HG12") ASSI { 2017} (segid " " and resid "5 " and name "HD23") (segid " " and resid "34 " and name "HG1 ") 5.000 5.000 0.000 peak 2017 weight 0.10000E+01 volume -0.42500E+00 ppm1 0.690 ppm2 2.021 OR { 2017} (segid " " and resid "5 " and name "HD22") (segid " " and resid "34 " and name "HG1 ") OR { 2017} (segid " " and resid "5 " and name "HD23") (segid " " and resid "34 " and name "HG2 ") OR { 2017} (segid " " and resid "5 " and name "HD21") (segid " " and resid "34 " and name "HG2 ") OR { 2017} (segid " " and resid "5 " and name "HD22") (segid " " and resid "34 " and name "HG2 ") OR { 2017} (segid " " and resid "5 " and name "HD21") (segid " " and resid "34 " and name "HG1 ") OR { 2017} (segid " " and resid "5 " and name "HD22") (segid " " and resid "30 " and name "HB ") OR { 2017} (segid " " and resid "5 " and name "HD21") (segid " " and resid "30 " and name "HB ") ASSI { 2014} (segid " " and resid "5 " and name "HD21") (segid " " and resid "13 " and name "HG12") 5.000 5.000 0.000 peak 2014 weight 0.10000E+01 volume -0.92000E+00 ppm1 0.690 ppm2 0.914 OR { 2014} (segid " " and resid "5 " and name "HD22") (segid " " and resid "13 " and name "HG13") OR { 2014} (segid " " and resid "5 " and name "HD21") (segid " " and resid "13 " and name "HG23") OR { 2014} (segid " " and resid "5 " and name "HD23") (segid " " and resid "13 " and name "HG13") OR { 2014} (segid " " and resid "5 " and name "HD21") (segid " " and resid "13 " and name "HG13") OR { 2014} (segid " " and resid "5 " and name "HD22") (segid " " and resid "13 " and name "HG11") OR { 2014} (segid " " and resid "5 " and name "HD23") (segid " " and resid "13 " and name "HG11") OR { 2014} (segid " " and resid "5 " and name "HD21") (segid " " and resid "13 " and name "HG21") OR { 2014} (segid " " and resid "5 " and name "HD21") (segid " " and resid "13 " and name "HG22") OR { 2014} (segid " " and resid "5 " and name "HD21") (segid " " and resid "13 " and name "HG11") OR { 2014} (segid " " and resid "5 " and name "HD23") (segid " " and resid "13 " and name "HG23") OR { 2014} (segid " " and resid "5 " and name "HD23") (segid " " and resid "13 " and name "HG22") ASSI { 2001} (segid " " and resid "5 " and name "HD21") (segid " " and resid "5 " and name "HB2 ") 5.000 5.000 0.000 peak 2001 weight 0.10000E+01 volume -0.12460E+01 ppm1 0.690 ppm2 1.125 OR { 2001} (segid " " and resid "5 " and name "HD23") (segid " " and resid "5 " and name "HB2 ") OR { 2001} (segid " " and resid "5 " and name "HD22") (segid " " and resid "5 " and name "HB2 ") OR { 2001} (segid " " and resid "5 " and name "HD21") (segid " " and resid "7 " and name "HG22") OR { 2001} (segid " " and resid "5 " and name "HD21") (segid " " and resid "7 " and name "HG23") ASSI { 2023} (segid " " and resid "5 " and name "HD23") (segid " " and resid "34 " and name "HB2 ") 6.000 6.000 0.000 peak 2023 weight 0.10000E+01 volume -0.15800E+00 ppm1 0.690 ppm2 1.652 OR { 2023} (segid " " and resid "5 " and name "HD21") (segid " " and resid "34 " and name "HB2 ") OR { 2023} (segid " " and resid "5 " and name "HD23") (segid " " and resid "15 " and name "HB ") OR { 2023} (segid " " and resid "5 " and name "HD22") (segid " " and resid "34 " and name "HB2 ") OR { 2023} (segid " " and resid "5 " and name "HD21") (segid " " and resid "15 " and name "HB ") OR { 2023} (segid " " and resid "5 " and name "HD22") (segid " " and resid "15 " and name "HB ") OR { 2023} (segid " " and resid "5 " and name "HD21") (segid " " and resid "6 " and name "HB1 ") OR { 2023} (segid " " and resid "5 " and name "HD23") (segid " " and resid "11 " and name "HD2 ") OR { 2023} (segid " " and resid "5 " and name "HD23") (segid " " and resid "6 " and name "HB1 ") OR { 2023} (segid " " and resid "5 " and name "HD21") (segid " " and resid "11 " and name "HD1 ") OR { 2023} (segid " " and resid "5 " and name "HD22") (segid " " and resid "6 " and name "HB1 ") OR { 2023} (segid " " and resid "5 " and name "HD21") (segid " " and resid "11 " and name "HB2 ") OR { 2023} (segid " " and resid "5 " and name "HD23") (segid " " and resid "11 " and name "HB2 ") OR { 2023} (segid " " and resid "5 " and name "HD23") (segid " " and resid "11 " and name "HD1 ") OR { 2023} (segid " " and resid "5 " and name "HD21") (segid " " and resid "11 " and name "HD2 ") OR { 2023} (segid " " and resid "5 " and name "HD22") (segid " " and resid "27 " and name "HG1 ") OR { 2023} (segid " " and resid "5 " and name "HD22") (segid " " and resid "27 " and name "HD2 ") OR { 2023} (segid " " and resid "5 " and name "HD23") (segid " " and resid "29 " and name "HD2 ") ASSI { 2031} (segid " " and resid "6 " and name "HA ") (segid " " and resid "5 " and name "HD23") 6.000 6.000 0.000 peak 2031 weight 0.10000E+01 volume -0.72000E-01 ppm1 5.209 ppm2 0.730 OR { 2031} (segid " " and resid "6 " and name "HA ") (segid " " and resid "5 " and name "HD22") OR { 2031} (segid " " and resid "6 " and name "HA ") (segid " " and resid "5 " and name "HD21") OR { 2031} (segid " " and resid "6 " and name "HA ") (segid " " and resid "5 " and name "HD12") OR { 2031} (segid " " and resid "6 " and name "HA ") (segid " " and resid "5 " and name "HD13") OR { 2031} (segid " " and resid "6 " and name "HA ") (segid " " and resid "5 " and name "HD11") ASSI { 2029} (segid " " and resid "6 " and name "HA ") (segid " " and resid "13 " and name "HG12") 6.000 6.000 0.000 peak 2029 weight 0.10000E+01 volume -0.20900E+00 ppm1 5.196 ppm2 0.914 OR { 2029} (segid " " and resid "6 " and name "HA ") (segid " " and resid "13 " and name "HG13") OR { 2029} (segid " " and resid "6 " and name "HA ") (segid " " and resid "13 " and name "HG23") OR { 2029} (segid " " and resid "6 " and name "HA ") (segid " " and resid "13 " and name "HG21") OR { 2029} (segid " " and resid "6 " and name "HA ") (segid " " and resid "13 " and name "HG11") ASSI { 2030} (segid " " and resid "6 " and name "HA ") (segid " " and resid "5 " and name "HA ") 6.000 6.000 0.000 peak 2030 weight 0.10000E+01 volume -0.11600E+00 ppm1 5.196 ppm2 5.420 ASSI { 2032} (segid " " and resid "6 " and name "HA ") (segid " " and resid "7 " and name "HA ") 6.000 6.000 0.000 peak 2032 weight 0.10000E+01 volume -0.69000E-01 ppm1 5.209 ppm2 4.709 ASSI { 2035} (segid " " and resid "6 " and name "HB1 ") (segid " " and resid "6 " and name "HB2 ") 3.300 3.300 0.000 peak 2035 weight 0.10000E+01 volume -0.32500E+01 ppm1 1.665 ppm2 1.336 OR { 2035} (segid " " and resid "6 " and name "HB1 ") (segid " " and resid "6 " and name "HG1 ") ASSI { 2039} (segid " " and resid "6 " and name "HB1 ") (segid " " and resid "66 " and name "HG22") 6.000 6.000 0.000 peak 2039 weight 0.10000E+01 volume -0.27800E+00 ppm1 1.652 ppm2 0.941 OR { 2039} (segid " " and resid "6 " and name "HB1 ") (segid " " and resid "66 " and name "HG21") OR { 2039} (segid " " and resid "6 " and name "HB1 ") (segid " " and resid "66 " and name "HG23") OR { 2039} (segid " " and resid "6 " and name "HB1 ") (segid " " and resid "8 " and name "HD22") OR { 2039} (segid " " and resid "6 " and name "HB1 ") (segid " " and resid "67 " and name "HG23") ASSI { 2047} (segid " " and resid "6 " and name "HB2 ") (segid " " and resid "6 " and name "HE2 ") 6.000 6.000 0.000 peak 2047 weight 0.10000E+01 volume -0.11200E+00 ppm1 1.336 ppm2 2.890 OR { 2047} (segid " " and resid "6 " and name "HB2 ") (segid " " and resid "6 " and name "HE1 ") ASSI { 2057} (segid " " and resid "6 " and name "HD1 ") (segid " " and resid "66 " and name "HG21") 5.000 5.000 0.000 peak 2057 weight 0.10000E+01 volume -0.41500E+00 ppm1 1.547 ppm2 0.941 OR { 2057} (segid " " and resid "6 " and name "HD2 ") (segid " " and resid "66 " and name "HG21") OR { 2057} (segid " " and resid "6 " and name "HD2 ") (segid " " and resid "66 " and name "HG22") OR { 2057} (segid " " and resid "6 " and name "HD1 ") (segid " " and resid "66 " and name "HG23") OR { 2057} (segid " " and resid "6 " and name "HD1 ") (segid " " and resid "66 " and name "HG22") ASSI { 2054} (segid " " and resid "6 " and name "HD1 ") (segid " " and resid "6 " and name "HG2 ") 5.000 5.000 0.000 peak 2054 weight 0.10000E+01 volume -0.10180E+01 ppm1 1.547 ppm2 1.230 OR { 2054} (segid " " and resid "6 " and name "HD2 ") (segid " " and resid "6 " and name "HG2 ") ASSI { 2049} (segid " " and resid "6 " and name "HD1 ") (segid " " and resid "6 " and name "HG1 ") 3.300 3.300 0.000 peak 2049 weight 0.10000E+01 volume -0.22370E+01 ppm1 1.547 ppm2 1.389 OR { 2049} (segid " " and resid "6 " and name "HD2 ") (segid " " and resid "6 " and name "HG1 ") ASSI { 2041} (segid " " and resid "6 " and name "HG1 ") (segid " " and resid "6 " and name "HG2 ") 3.300 3.300 0.000 peak 2041 weight 0.10000E+01 volume -0.29620E+01 ppm1 1.402 ppm2 1.230 ASSI { 2051} (segid " " and resid "6 " and name "HG1 ") (segid " " and resid "6 " and name "HE1 ") 5.000 5.000 0.000 peak 2051 weight 0.10000E+01 volume -0.36300E+00 ppm1 1.389 ppm2 2.890 OR { 2051} (segid " " and resid "6 " and name "HG1 ") (segid " " and resid "6 " and name "HE2 ") ASSI { 2078} (segid " " and resid "7 " and name "HG21") (segid " " and resid "5 " and name "HD23") 5.000 5.000 0.000 peak 2078 weight 0.10000E+01 volume -0.66100E+00 ppm1 1.165 ppm2 0.677 OR { 2078} (segid " " and resid "7 " and name "HG22") (segid " " and resid "5 " and name "HD23") OR { 2078} (segid " " and resid "7 " and name "HG21") (segid " " and resid "5 " and name "HD21") OR { 2078} (segid " " and resid "7 " and name "HG22") (segid " " and resid "5 " and name "HD21") OR { 2078} (segid " " and resid "7 " and name "HG22") (segid " " and resid "5 " and name "HD22") OR { 2078} (segid " " and resid "7 " and name "HG23") (segid " " and resid "5 " and name "HD23") OR { 2078} (segid " " and resid "7 " and name "HG23") (segid " " and resid "5 " and name "HD21") ASSI { 2088} (segid " " and resid "7 " and name "HG22") (segid " " and resid "13 " and name "HB ") 6.000 6.000 0.000 peak 2088 weight 0.10000E+01 volume -0.15700E+00 ppm1 1.165 ppm2 2.153 OR { 2088} (segid " " and resid "7 " and name "HG23") (segid " " and resid "13 " and name "HB ") OR { 2088} (segid " " and resid "7 " and name "HG21") (segid " " and resid "13 " and name "HB ") ASSI { 2083} (segid " " and resid "7 " and name "HG22") (segid " " and resid "12 " and name "HA ") 5.000 5.000 0.000 peak 2083 weight 0.10000E+01 volume -0.30000E+00 ppm1 1.165 ppm2 5.315 OR { 2083} (segid " " and resid "7 " and name "HG23") (segid " " and resid "12 " and name "HA ") OR { 2083} (segid " " and resid "7 " and name "HG21") (segid " " and resid "12 " and name "HA ") ASSI { 2092} (segid " " and resid "8 " and name "HA ") (segid " " and resid "70 " and name "HG23") 6.000 6.000 0.000 peak 2092 weight 0.10000E+01 volume -0.11400E+00 ppm1 4.287 ppm2 0.809 OR { 2092} (segid " " and resid "8 " and name "HA ") (segid " " and resid "69 " and name "HD23") OR { 2092} (segid " " and resid "8 " and name "HA ") (segid " " and resid "70 " and name "HG22") OR { 2092} (segid " " and resid "8 " and name "HA ") (segid " " and resid "69 " and name "HD22") OR { 2092} (segid " " and resid "8 " and name "HA ") (segid " " and resid "70 " and name "HG21") OR { 2092} (segid " " and resid "8 " and name "HA ") (segid " " and resid "69 " and name "HD21") ASSI { 2114} (segid " " and resid "8 " and name "HD13") (segid " " and resid "9 " and name "HG21") 6.000 6.000 0.000 peak 2114 weight 0.10000E+01 volume -0.10900E+00 ppm1 1.020 ppm2 1.283 OR { 2114} (segid " " and resid "8 " and name "HD11") (segid " " and resid "9 " and name "HG22") OR { 2114} (segid " " and resid "8 " and name "HD12") (segid " " and resid "9 " and name "HG23") OR { 2114} (segid " " and resid "8 " and name "HD13") (segid " " and resid "9 " and name "HG22") OR { 2114} (segid " " and resid "8 " and name "HD12") (segid " " and resid "9 " and name "HG22") OR { 2114} (segid " " and resid "8 " and name "HD11") (segid " " and resid "9 " and name "HG23") OR { 2114} (segid " " and resid "8 " and name "HD13") (segid " " and resid "9 " and name "HG23") OR { 2114} (segid " " and resid "8 " and name "HD12") (segid " " and resid "9 " and name "HG21") OR { 2114} (segid " " and resid "8 " and name "HD11") (segid " " and resid "9 " and name "HG21") OR { 2114} (segid " " and resid "8 " and name "HD13") (segid " " and resid "69 " and name "HB2 ") ASSI { 2116} (segid " " and resid "8 " and name "HD11") (segid " " and resid "69 " and name "HG ") 6.000 6.000 0.000 peak 2116 weight 0.10000E+01 volume -0.10200E+00 ppm1 1.020 ppm2 1.389 OR { 2116} (segid " " and resid "8 " and name "HD12") (segid " " and resid "69 " and name "HG ") OR { 2116} (segid " " and resid "8 " and name "HD11") (segid " " and resid "36 " and name "HG11") ASSI { 2113} (segid " " and resid "8 " and name "HD11") (segid " " and resid "71 " and name "HB2 ") 5.000 5.000 0.000 peak 2113 weight 0.10000E+01 volume -0.35000E+00 ppm1 1.020 ppm2 1.626 OR { 2113} (segid " " and resid "8 " and name "HD13") (segid " " and resid "71 " and name "HB2 ") OR { 2113} (segid " " and resid "8 " and name "HD12") (segid " " and resid "71 " and name "HB2 ") OR { 2113} (segid " " and resid "8 " and name "HD12") (segid " " and resid "71 " and name "HG ") OR { 2113} (segid " " and resid "8 " and name "HD12") (segid " " and resid "71 " and name "HB1 ") OR { 2113} (segid " " and resid "8 " and name "HD11") (segid " " and resid "71 " and name "HG ") ASSI { 2125} (segid " " and resid "8 " and name "HD21") (segid " " and resid "71 " and name "HB2 ") 5.000 5.000 0.000 peak 2125 weight 0.10000E+01 volume -0.45100E+00 ppm1 0.967 ppm2 1.599 OR { 2125} (segid " " and resid "8 " and name "HD23") (segid " " and resid "71 " and name "HB2 ") OR { 2125} (segid " " and resid "8 " and name "HD22") (segid " " and resid "71 " and name "HB2 ") ASSI { 2123} (segid " " and resid "8 " and name "HD23") (segid " " and resid "69 " and name "HG ") 5.000 5.000 0.000 peak 2123 weight 0.10000E+01 volume -0.38400E+00 ppm1 0.967 ppm2 1.415 OR { 2123} (segid " " and resid "8 " and name "HD21") (segid " " and resid "69 " and name "HG ") OR { 2123} (segid " " and resid "8 " and name "HD22") (segid " " and resid "69 " and name "HG ") ASSI { 2104} (segid " " and resid "8 " and name "HG ") (segid " " and resid "69 " and name "HD22") 5.000 5.000 0.000 peak 2104 weight 0.10000E+01 volume -0.37800E+00 ppm1 1.836 ppm2 0.809 OR { 2104} (segid " " and resid "8 " and name "HG ") (segid " " and resid "69 " and name "HD23") OR { 2104} (segid " " and resid "8 " and name "HG ") (segid " " and resid "69 " and name "HD21") OR { 2104} (segid " " and resid "8 " and name "HG ") (segid " " and resid "36 " and name "HD12") OR { 2104} (segid " " and resid "8 " and name "HG ") (segid " " and resid "36 " and name "HD13") OR { 2104} (segid " " and resid "8 " and name "HG ") (segid " " and resid "36 " and name "HD11") ASSI { 2149} (segid " " and resid "11 " and name "HB1 ") (segid " " and resid "11 " and name "HB2 ") 5.000 5.000 0.000 peak 2149 weight 0.10000E+01 volume -0.14530E+01 ppm1 1.797 ppm2 1.678 OR { 2149} (segid " " and resid "11 " and name "HB1 ") (segid " " and resid "11 " and name "HD1 ") OR { 2149} (segid " " and resid "11 " and name "HB1 ") (segid " " and resid "11 " and name "HD2 ") ASSI { 2161} (segid " " and resid "11 " and name "HB2 ") (segid " " and resid "11 " and name "HB1 ") 5.000 5.000 0.000 peak 2161 weight 0.10000E+01 volume -0.12120E+01 ppm1 1.678 ppm2 1.784 ASSI { 2185} (segid " " and resid "11 " and name "HD1 ") (segid " " and resid "13 " and name "HG22") 6.000 6.000 0.000 peak 2185 weight 0.10000E+01 volume -0.12200E+00 ppm1 1.626 ppm2 0.914 OR { 2185} (segid " " and resid "11 " and name "HD2 ") (segid " " and resid "13 " and name "HG23") OR { 2185} (segid " " and resid "11 " and name "HD2 ") (segid " " and resid "13 " and name "HG11") OR { 2185} (segid " " and resid "11 " and name "HD2 ") (segid " " and resid "13 " and name "HG22") OR { 2185} (segid " " and resid "11 " and name "HD2 ") (segid " " and resid "13 " and name "HG21") OR { 2185} (segid " " and resid "11 " and name "HD1 ") (segid " " and resid "13 " and name "HG21") ASSI { 2183} (segid " " and resid "11 " and name "HD1 ") (segid " " and resid "7 " and name "HG22") 6.000 6.000 0.000 peak 2183 weight 0.10000E+01 volume -0.18200E+00 ppm1 1.626 ppm2 1.204 OR { 2183} (segid " " and resid "11 " and name "HD2 ") (segid " " and resid "7 " and name "HG21") OR { 2183} (segid " " and resid "11 " and name "HD1 ") (segid " " and resid "7 " and name "HG21") OR { 2183} (segid " " and resid "11 " and name "HD2 ") (segid " " and resid "7 " and name "HG22") ASSI { 2179} (segid " " and resid "11 " and name "HD2 ") (segid " " and resid "11 " and name "HE1 ") 5.000 5.000 0.000 peak 2179 weight 0.10000E+01 volume -0.67200E+00 ppm1 1.639 ppm2 2.917 OR { 2179} (segid " " and resid "11 " and name "HD1 ") (segid " " and resid "11 " and name "HE2 ") OR { 2179} (segid " " and resid "11 " and name "HD2 ") (segid " " and resid "11 " and name "HE2 ") OR { 2179} (segid " " and resid "11 " and name "HD1 ") (segid " " and resid "11 " and name "HE1 ") ASSI { 2182} (segid " " and resid "11 " and name "HD2 ") (segid " " and resid "11 " and name "HA ") 6.000 6.000 0.000 peak 2182 weight 0.10000E+01 volume -0.17300E+00 ppm1 1.639 ppm2 4.340 OR { 2182} (segid " " and resid "11 " and name "HD1 ") (segid " " and resid "11 " and name "HA ") ASSI { 2170} (segid " " and resid "11 " and name "HG1 ") (segid " " and resid "11 " and name "HB1 ") 5.000 5.000 0.000 peak 2170 weight 0.10000E+01 volume -0.79500E+00 ppm1 1.428 ppm2 1.784 ASSI { 2175} (segid " " and resid "11 " and name "HG1 ") (segid " " and resid "11 " and name "HE1 ") 5.000 5.000 0.000 peak 2175 weight 0.10000E+01 volume -0.33200E+00 ppm1 1.428 ppm2 2.917 OR { 2175} (segid " " and resid "11 " and name "HG1 ") (segid " " and resid "11 " and name "HE2 ") ASSI { 2176} (segid " " and resid "11 " and name "HG2 ") (segid " " and resid "11 " and name "HE1 ") 6.000 6.000 0.000 peak 2176 weight 0.10000E+01 volume -0.26300E+00 ppm1 1.270 ppm2 2.917 OR { 2176} (segid " " and resid "11 " and name "HG2 ") (segid " " and resid "11 " and name "HE2 ") ASSI { 2188} (segid " " and resid "12 " and name "HA ") (segid " " and resid "13 " and name "HG22") 6.000 6.000 0.000 peak 2188 weight 0.10000E+01 volume -0.25400E+00 ppm1 5.302 ppm2 0.914 OR { 2188} (segid " " and resid "12 " and name "HA ") (segid " " and resid "13 " and name "HG21") OR { 2188} (segid " " and resid "12 " and name "HA ") (segid " " and resid "13 " and name "HG11") OR { 2188} (segid " " and resid "12 " and name "HA ") (segid " " and resid "13 " and name "HG23") OR { 2188} (segid " " and resid "12 " and name "HA ") (segid " " and resid "13 " and name "HG12") ASSI { 2193} (segid " " and resid "12 " and name "HA ") (segid " " and resid "11 " and name "HD1 ") 6.000 6.000 0.000 peak 2193 weight 0.10000E+01 volume -0.16800E+00 ppm1 5.302 ppm2 1.652 OR { 2193} (segid " " and resid "12 " and name "HA ") (segid " " and resid "11 " and name "HD2 ") OR { 2193} (segid " " and resid "12 " and name "HA ") (segid " " and resid "11 " and name "HB2 ") OR { 2193} (segid " " and resid "12 " and name "HA ") (segid " " and resid "6 " and name "HB1 ") ASSI { 2201} (segid " " and resid "12 " and name "HG22") (segid " " and resid "6 " and name "HG1 ") 6.000 6.000 0.000 peak 2201 weight 0.10000E+01 volume -0.29000E+00 ppm1 1.059 ppm2 1.362 OR { 2201} (segid " " and resid "12 " and name "HG21") (segid " " and resid "6 " and name "HG1 ") OR { 2201} (segid " " and resid "12 " and name "HG23") (segid " " and resid "6 " and name "HG1 ") OR { 2201} (segid " " and resid "12 " and name "HG22") (segid " " and resid "6 " and name "HB2 ") ASSI { 2211} (segid " " and resid "12 " and name "HG21") (segid " " and resid "6 " and name "HB1 ") 6.000 6.000 0.000 peak 2211 weight 0.10000E+01 volume -0.16400E+00 ppm1 1.059 ppm2 1.652 OR { 2211} (segid " " and resid "12 " and name "HG23") (segid " " and resid "6 " and name "HB1 ") OR { 2211} (segid " " and resid "12 " and name "HG22") (segid " " and resid "6 " and name "HB1 ") OR { 2211} (segid " " and resid "12 " and name "HG22") (segid " " and resid "11 " and name "HD1 ") OR { 2211} (segid " " and resid "12 " and name "HG21") (segid " " and resid "11 " and name "HD2 ") OR { 2211} (segid " " and resid "12 " and name "HG22") (segid " " and resid "11 " and name "HD2 ") OR { 2211} (segid " " and resid "12 " and name "HG21") (segid " " and resid "11 " and name "HD1 ") ASSI { 2209} (segid " " and resid "12 " and name "HG21") (segid " " and resid "13 " and name "HA ") 6.000 6.000 0.000 peak 2209 weight 0.10000E+01 volume -0.12800E+00 ppm1 1.046 ppm2 4.656 OR { 2209} (segid " " and resid "12 " and name "HG23") (segid " " and resid "13 " and name "HA ") OR { 2209} (segid " " and resid "12 " and name "HG22") (segid " " and resid "13 " and name "HA ") ASSI { 2215} (segid " " and resid "13 " and name "HB ") (segid " " and resid "33 " and name "HE1 ") 6.000 6.000 0.000 peak 2215 weight 0.10000E+01 volume -0.13300E+00 ppm1 2.153 ppm2 3.101 OR { 2215} (segid " " and resid "13 " and name "HB ") (segid " " and resid "33 " and name "HE2 ") ASSI { 2238} (segid " " and resid "13 " and name "HG22") (segid " " and resid "7 " and name "HG21") 5.000 5.000 0.000 peak 2238 weight 0.10000E+01 volume -0.18260E+01 ppm1 0.888 ppm2 1.151 OR { 2238} (segid " " and resid "13 " and name "HG23") (segid " " and resid "7 " and name "HG23") OR { 2238} (segid " " and resid "13 " and name "HG23") (segid " " and resid "7 " and name "HG21") OR { 2238} (segid " " and resid "13 " and name "HG22") (segid " " and resid "7 " and name "HG23") OR { 2238} (segid " " and resid "13 " and name "HG22") (segid " " and resid "7 " and name "HG22") OR { 2238} (segid " " and resid "13 " and name "HG21") (segid " " and resid "7 " and name "HG21") OR { 2238} (segid " " and resid "13 " and name "HG23") (segid " " and resid "7 " and name "HG22") ASSI { 2242} (segid " " and resid "13 " and name "HG23") (segid " " and resid "11 " and name "HG2 ") 5.000 5.000 0.000 peak 2242 weight 0.10000E+01 volume -0.58100E+00 ppm1 0.888 ppm2 1.283 OR { 2242} (segid " " and resid "13 " and name "HG23") (segid " " and resid "15 " and name "HG12") OR { 2242} (segid " " and resid "13 " and name "HG21") (segid " " and resid "11 " and name "HG2 ") OR { 2242} (segid " " and resid "13 " and name "HG22") (segid " " and resid "11 " and name "HG2 ") OR { 2242} (segid " " and resid "13 " and name "HG23") (segid " " and resid "5 " and name "HG ") OR { 2242} (segid " " and resid "13 " and name "HG22") (segid " " and resid "5 " and name "HG ") ASSI { 2248} (segid " " and resid "13 " and name "HG21") (segid " " and resid "11 " and name "HG1 ") 6.000 6.000 0.000 peak 2248 weight 0.10000E+01 volume -0.24300E+00 ppm1 0.888 ppm2 1.389 OR { 2248} (segid " " and resid "13 " and name "HG23") (segid " " and resid "15 " and name "HG11") OR { 2248} (segid " " and resid "13 " and name "HG23") (segid " " and resid "11 " and name "HG1 ") ASSI { 2246} (segid " " and resid "13 " and name "HG22") (segid " " and resid "11 " and name "HD1 ") 5.000 5.000 0.000 peak 2246 weight 0.10000E+01 volume -0.35600E+00 ppm1 0.888 ppm2 1.599 OR { 2246} (segid " " and resid "13 " and name "HG22") (segid " " and resid "11 " and name "HD2 ") OR { 2246} (segid " " and resid "13 " and name "HG21") (segid " " and resid "11 " and name "HD2 ") OR { 2246} (segid " " and resid "13 " and name "HG21") (segid " " and resid "11 " and name "HD1 ") ASSI { 2245} (segid " " and resid "13 " and name "HG22") (segid " " and resid "33 " and name "HD1 ") 5.000 5.000 0.000 peak 2245 weight 0.10000E+01 volume -0.45800E+00 ppm1 0.888 ppm2 1.705 OR { 2245} (segid " " and resid "13 " and name "HG23") (segid " " and resid "33 " and name "HD1 ") OR { 2245} (segid " " and resid "13 " and name "HG21") (segid " " and resid "33 " and name "HD1 ") OR { 2245} (segid " " and resid "13 " and name "HG21") (segid " " and resid "33 " and name "HD2 ") OR { 2245} (segid " " and resid "13 " and name "HG23") (segid " " and resid "33 " and name "HD2 ") ASSI { 2250} (segid " " and resid "13 " and name "HG23") (segid " " and resid "7 " and name "HB ") 6.000 6.000 0.000 peak 2250 weight 0.10000E+01 volume -0.92000E-01 ppm1 0.888 ppm2 4.788 OR { 2250} (segid " " and resid "13 " and name "HG22") (segid " " and resid "7 " and name "HB ") OR { 2250} (segid " " and resid "13 " and name "HG21") (segid " " and resid "7 " and name "HB ") ASSI { 2251} (segid " " and resid "13 " and name "HG21") (segid " " and resid "5 " and name "HA ") 6.000 6.000 0.000 peak 2251 weight 0.10000E+01 volume -0.70000E-01 ppm1 0.888 ppm2 5.446 OR { 2251} (segid " " and resid "13 " and name "HG21") (segid " " and resid "4 " and name "HA ") OR { 2251} (segid " " and resid "13 " and name "HG22") (segid " " and resid "5 " and name "HA ") OR { 2251} (segid " " and resid "13 " and name "HG23") (segid " " and resid "5 " and name "HA ") OR { 2251} (segid " " and resid "13 " and name "HG23") (segid " " and resid "4 " and name "HA ") ASSI { 2240} (segid " " and resid "13 " and name "HG23") (segid " " and resid "5 " and name "HD21") 5.000 5.000 0.000 peak 2240 weight 0.10000E+01 volume -0.95200E+00 ppm1 0.888 ppm2 0.677 OR { 2240} (segid " " and resid "13 " and name "HG23") (segid " " and resid "5 " and name "HD22") OR { 2240} (segid " " and resid "13 " and name "HG21") (segid " " and resid "5 " and name "HD21") OR { 2240} (segid " " and resid "13 " and name "HG22") (segid " " and resid "5 " and name "HD22") OR { 2240} (segid " " and resid "13 " and name "HG22") (segid " " and resid "5 " and name "HD21") OR { 2240} (segid " " and resid "13 " and name "HG22") (segid " " and resid "15 " and name "HD12") OR { 2240} (segid " " and resid "13 " and name "HG23") (segid " " and resid "5 " and name "HD23") OR { 2240} (segid " " and resid "13 " and name "HG22") (segid " " and resid "5 " and name "HD23") OR { 2240} (segid " " and resid "13 " and name "HG21") (segid " " and resid "15 " and name "HD11") ASSI { 2249} (segid " " and resid "13 " and name "HG22") (segid " " and resid "12 " and name "HA ") 6.000 6.000 0.000 peak 2249 weight 0.10000E+01 volume -0.14300E+00 ppm1 0.888 ppm2 5.315 OR { 2249} (segid " " and resid "13 " and name "HG21") (segid " " and resid "12 " and name "HA ") OR { 2249} (segid " " and resid "13 " and name "HG23") (segid " " and resid "12 " and name "HA ") ASSI { 2254} (segid " " and resid "14 " and name "HA ") (segid " " and resid "4 " and name "HB2 ") 6.000 6.000 0.000 peak 2254 weight 0.10000E+01 volume -0.77000E-01 ppm1 5.117 ppm2 3.128 OR { 2254} (segid " " and resid "14 " and name "HA ") (segid " " and resid "33 " and name "HE2 ") OR { 2254} (segid " " and resid "14 " and name "HA ") (segid " " and resid "33 " and name "HE1 ") ASSI { 2226} (segid " " and resid "14 " and name "HA ") (segid " " and resid "13 " and name "HG22") 6.000 6.000 0.000 peak 2226 weight 0.10000E+01 volume -0.18700E+00 ppm1 5.117 ppm2 0.914 OR { 2226} (segid " " and resid "14 " and name "HA ") (segid " " and resid "13 " and name "HG12") OR { 2226} (segid " " and resid "14 " and name "HA ") (segid " " and resid "13 " and name "HG11") OR { 2226} (segid " " and resid "14 " and name "HA ") (segid " " and resid "13 " and name "HG13") OR { 2226} (segid " " and resid "14 " and name "HA ") (segid " " and resid "13 " and name "HG23") ASSI { 2252} (segid " " and resid "14 " and name "HA ") (segid " " and resid "15 " and name "HG12") 6.000 6.000 0.000 peak 2252 weight 0.10000E+01 volume -0.10900E+00 ppm1 5.117 ppm2 1.230 ASSI { 2255} (segid " " and resid "14 " and name "HA ") (segid " " and resid "13 " and name "HA ") 6.000 6.000 0.000 peak 2255 weight 0.10000E+01 volume -0.53000E-01 ppm1 5.117 ppm2 4.656 ASSI { 2259} (segid " " and resid "14 " and name "HA ") (segid " " and resid "4 " and name "HE1 ") 6.000 6.000 0.000 peak 2259 weight 0.10000E+01 volume -0.64000E-01 ppm1 5.104 ppm2 7.265 OR { 2259} (segid " " and resid "14 " and name "HA ") (segid " " and resid "4 " and name "HE2 ") ASSI { 2257} (segid " " and resid "14 " and name "HB ") (segid " " and resid "2 " and name "HG2 ") 6.000 6.000 0.000 peak 2257 weight 0.10000E+01 volume -0.78000E-01 ppm1 4.024 ppm2 1.995 ASSI { 2234} (segid " " and resid "14 " and name "HB ") (segid " " and resid "2 " and name "HB2 ") 6.000 6.000 0.000 peak 2234 weight 0.10000E+01 volume -0.14200E+00 ppm1 4.023 ppm2 1.672 ASSI { 2265} (segid " " and resid "14 " and name "HG23") (segid " " and resid "2 " and name "HB1 ") 5.000 5.000 0.000 peak 2265 weight 0.10000E+01 volume -0.51300E+00 ppm1 1.112 ppm2 1.889 OR { 2265} (segid " " and resid "14 " and name "HG21") (segid " " and resid "2 " and name "HB1 ") OR { 2265} (segid " " and resid "14 " and name "HG22") (segid " " and resid "2 " and name "HB1 ") ASSI { 2263} (segid " " and resid "14 " and name "HG21") (segid " " and resid "2 " and name "HG2 ") 5.000 5.000 0.000 peak 2263 weight 0.10000E+01 volume -0.65300E+00 ppm1 1.112 ppm2 1.995 OR { 2263} (segid " " and resid "14 " and name "HG22") (segid " " and resid "2 " and name "HG2 ") OR { 2263} (segid " " and resid "14 " and name "HG23") (segid " " and resid "2 " and name "HG2 ") ASSI { 2273} (segid " " and resid "14 " and name "HG23") (segid " " and resid "16 " and name "HG2 ") 6.000 6.000 0.000 peak 2273 weight 0.10000E+01 volume -0.79000E-01 ppm1 1.112 ppm2 2.153 OR { 2273} (segid " " and resid "14 " and name "HG22") (segid " " and resid "16 " and name "HG2 ") OR { 2273} (segid " " and resid "14 " and name "HG21") (segid " " and resid "16 " and name "HG2 ") OR { 2273} (segid " " and resid "14 " and name "HG22") (segid " " and resid "13 " and name "HB ") OR { 2273} (segid " " and resid "14 " and name "HG21") (segid " " and resid "13 " and name "HB ") OR { 2273} (segid " " and resid "14 " and name "HG23") (segid " " and resid "13 " and name "HB ") OR { 2273} (segid " " and resid "14 " and name "HG23") (segid " " and resid "64 " and name "HG1 ") ASSI { 2272} (segid " " and resid "14 " and name "HG22") (segid " " and resid "4 " and name "HB2 ") 6.000 6.000 0.000 peak 2272 weight 0.10000E+01 volume -0.10800E+00 ppm1 1.112 ppm2 3.128 OR { 2272} (segid " " and resid "14 " and name "HG21") (segid " " and resid "4 " and name "HB2 ") OR { 2272} (segid " " and resid "14 " and name "HG23") (segid " " and resid "4 " and name "HB2 ") OR { 2272} (segid " " and resid "14 " and name "HG21") (segid " " and resid "64 " and name "HA ") OR { 2272} (segid " " and resid "14 " and name "HG23") (segid " " and resid "64 " and name "HA ") OR { 2272} (segid " " and resid "14 " and name "HG22") (segid " " and resid "64 " and name "HA ") OR { 2272} (segid " " and resid "14 " and name "HG21") (segid " " and resid "33 " and name "HE1 ") OR { 2272} (segid " " and resid "14 " and name "HG22") (segid " " and resid "33 " and name "HE1 ") ASSI { 2268} (segid " " and resid "15 " and name "HA ") (segid " " and resid "15 " and name "HD12") 5.000 5.000 0.000 peak 2268 weight 0.10000E+01 volume -0.14580E+01 ppm1 4.419 ppm2 0.651 OR { 2268} (segid " " and resid "15 " and name "HA ") (segid " " and resid "15 " and name "HD11") ASSI { 2286} (segid " " and resid "15 " and name "HA ") (segid " " and resid "33 " and name "HE2 ") 6.000 6.000 0.000 peak 2286 weight 0.10000E+01 volume -0.18300E+00 ppm1 4.419 ppm2 3.101 OR { 2286} (segid " " and resid "15 " and name "HA ") (segid " " and resid "33 " and name "HE1 ") ASSI { 2283} (segid " " and resid "15 " and name "HA ") (segid " " and resid "16 " and name "HB2 ") 5.000 5.000 0.000 peak 2283 weight 0.10000E+01 volume -0.37300E+00 ppm1 4.406 ppm2 1.889 OR { 2283} (segid " " and resid "15 " and name "HA ") (segid " " and resid "29 " and name "HD1 ") OR { 2283} (segid " " and resid "15 " and name "HA ") (segid " " and resid "29 " and name "HB1 ") OR { 2283} (segid " " and resid "15 " and name "HA ") (segid " " and resid "2 " and name "HB1 ") ASSI { 2297} (segid " " and resid "15 " and name "HB ") (segid " " and resid "5 " and name "HB2 ") 6.000 6.000 0.000 peak 2297 weight 0.10000E+01 volume -0.10400E+00 ppm1 1.692 ppm2 1.099 OR { 2297} (segid " " and resid "15 " and name "HB ") (segid " " and resid "14 " and name "HG23") OR { 2297} (segid " " and resid "15 " and name "HB ") (segid " " and resid "14 " and name "HG21") ASSI { 2291} (segid " " and resid "15 " and name "HB ") (segid " " and resid "15 " and name "HG12") 5.000 5.000 0.000 peak 2291 weight 0.10000E+01 volume -0.79800E+00 ppm1 1.705 ppm2 1.230 ASSI { 2288} (segid " " and resid "15 " and name "HB ") (segid " " and resid "15 " and name "HG11") 5.000 5.000 0.000 peak 2288 weight 0.10000E+01 volume -0.82800E+00 ppm1 1.705 ppm2 1.389 ASSI { 4872} (segid " " and resid "15 " and name "HB ") (segid " " and resid "15 " and name "HD13") 5.000 5.000 0.000 peak 4872 weight 0.10000E+01 volume -0.82000E+00 ppm1 1.696 ppm2 0.660 OR { 4872} (segid " " and resid "15 " and name "HB ") (segid " " and resid "15 " and name "HD12") OR { 4872} (segid " " and resid "15 " and name "HB ") (segid " " and resid "15 " and name "HD11") OR { 4872} (segid " " and resid "15 " and name "HB ") (segid " " and resid "17 " and name "HG11") OR { 4872} (segid " " and resid "15 " and name "HB ") (segid " " and resid "17 " and name "HG12") ASSI { 2338} (segid " " and resid "15 " and name "HD13") (segid " " and resid "15 " and name "HG12") 5.000 5.000 0.000 peak 2338 weight 0.10000E+01 volume -0.15220E+01 ppm1 0.651 ppm2 1.257 OR { 2338} (segid " " and resid "15 " and name "HD11") (segid " " and resid "15 " and name "HG12") OR { 2338} (segid " " and resid "15 " and name "HD12") (segid " " and resid "15 " and name "HG12") ASSI { 2346} (segid " " and resid "15 " and name "HD12") (segid " " and resid "13 " and name "HB ") 6.000 6.000 0.000 peak 2346 weight 0.10000E+01 volume -0.28200E+00 ppm1 0.664 ppm2 2.153 OR { 2346} (segid " " and resid "15 " and name "HD11") (segid " " and resid "13 " and name "HB ") OR { 2346} (segid " " and resid "15 " and name "HD13") (segid " " and resid "13 " and name "HB ") ASSI { 2324} (segid " " and resid "15 " and name "HG23") (segid " " and resid "17 " and name "HG23") 6.000 6.000 0.000 peak 2324 weight 0.10000E+01 volume -0.24600E+00 ppm1 0.941 ppm2 0.387 OR { 2324} (segid " " and resid "15 " and name "HG21") (segid " " and resid "17 " and name "HG23") OR { 2324} (segid " " and resid "15 " and name "HG21") (segid " " and resid "17 " and name "HG21") OR { 2324} (segid " " and resid "15 " and name "HG22") (segid " " and resid "17 " and name "HG22") OR { 2324} (segid " " and resid "15 " and name "HG22") (segid " " and resid "17 " and name "HG23") OR { 2324} (segid " " and resid "15 " and name "HG22") (segid " " and resid "17 " and name "HG21") OR { 2324} (segid " " and resid "15 " and name "HG21") (segid " " and resid "17 " and name "HG22") ASSI { 2321} (segid " " and resid "15 " and name "HG23") (segid " " and resid "26 " and name "HD1 ") 5.000 5.000 0.000 peak 2321 weight 0.10000E+01 volume -0.46000E+00 ppm1 0.941 ppm2 7.080 OR { 2321} (segid " " and resid "15 " and name "HG21") (segid " " and resid "26 " and name "HD1 ") OR { 2321} (segid " " and resid "15 " and name "HG22") (segid " " and resid "26 " and name "HD1 ") OR { 2321} (segid " " and resid "15 " and name "HG21") (segid " " and resid "26 " and name "HD2 ") OR { 2321} (segid " " and resid "15 " and name "HG23") (segid " " and resid "26 " and name "HD2 ") ASSI { 4893} (segid " " and resid "15 " and name "HG22") (segid " " and resid "29 " and name "HB1 ") 5.000 5.000 0.000 peak 4893 weight 0.10000E+01 volume -0.19870E+01 ppm1 0.938 ppm2 1.877 OR { 4893} (segid " " and resid "15 " and name "HG21") (segid " " and resid "29 " and name "HB1 ") OR { 4893} (segid " " and resid "15 " and name "HG21") (segid " " and resid "29 " and name "HD1 ") OR { 4893} (segid " " and resid "15 " and name "HG23") (segid " " and resid "29 " and name "HD1 ") OR { 4893} (segid " " and resid "15 " and name "HG22") (segid " " and resid "29 " and name "HD1 ") ASSI { 4897} (segid " " and resid "15 " and name "HG21") (segid " " and resid "29 " and name "HD2 ") 3.300 3.300 0.000 peak 4897 weight 0.10000E+01 volume -0.33190E+01 ppm1 0.938 ppm2 1.682 OR { 4897} (segid " " and resid "15 " and name "HG21") (segid " " and resid "15 " and name "HB ") OR { 4897} (segid " " and resid "15 " and name "HG22") (segid " " and resid "15 " and name "HB ") OR { 4897} (segid " " and resid "15 " and name "HG23") (segid " " and resid "15 " and name "HB ") OR { 4897} (segid " " and resid "15 " and name "HG22") (segid " " and resid "29 " and name "HD2 ") ASSI { 2313} (segid " " and resid "15 " and name "HG22") (segid " " and resid "15 " and name "HD11") 2.700 2.700 0.000 peak 2313 weight 0.10000E+01 volume -0.40810E+01 ppm1 0.941 ppm2 0.651 OR { 2313} (segid " " and resid "15 " and name "HG21") (segid " " and resid "15 " and name "HD11") OR { 2313} (segid " " and resid "15 " and name "HG23") (segid " " and resid "15 " and name "HD13") OR { 2313} (segid " " and resid "15 " and name "HG22") (segid " " and resid "15 " and name "HD13") OR { 2313} (segid " " and resid "15 " and name "HG21") (segid " " and resid "15 " and name "HD13") OR { 2313} (segid " " and resid "15 " and name "HG23") (segid " " and resid "17 " and name "HG11") OR { 2313} (segid " " and resid "15 " and name "HG23") (segid " " and resid "17 " and name "HG13") OR { 2313} (segid " " and resid "15 " and name "HG23") (segid " " and resid "15 " and name "HD11") OR { 2313} (segid " " and resid "15 " and name "HG22") (segid " " and resid "17 " and name "HG12") OR { 2313} (segid " " and resid "15 " and name "HG22") (segid " " and resid "17 " and name "HG11") OR { 2313} (segid " " and resid "15 " and name "HG21") (segid " " and resid "17 " and name "HG12") OR { 2313} (segid " " and resid "15 " and name "HG21") (segid " " and resid "17 " and name "HG13") OR { 2313} (segid " " and resid "15 " and name "HG21") (segid " " and resid "17 " and name "HG11") ASSI { 2323} (segid " " and resid "15 " and name "HG23") (segid " " and resid "29 " and name "HG2 ") 5.000 5.000 0.000 peak 2323 weight 0.10000E+01 volume -0.34300E+00 ppm1 0.941 ppm2 1.573 OR { 2323} (segid " " and resid "15 " and name "HG22") (segid " " and resid "33 " and name "HG1 ") OR { 2323} (segid " " and resid "15 " and name "HG21") (segid " " and resid "29 " and name "HG2 ") OR { 2323} (segid " " and resid "15 " and name "HG23") (segid " " and resid "33 " and name "HG1 ") OR { 2323} (segid " " and resid "15 " and name "HG21") (segid " " and resid "33 " and name "HG1 ") OR { 2323} (segid " " and resid "15 " and name "HG22") (segid " " and resid "29 " and name "HG2 ") ASSI { 2327} (segid " " and resid "15 " and name "HG22") (segid " " and resid "29 " and name "HE2 ") 6.000 6.000 0.000 peak 2327 weight 0.10000E+01 volume -0.19100E+00 ppm1 0.941 ppm2 3.101 OR { 2327} (segid " " and resid "15 " and name "HG21") (segid " " and resid "29 " and name "HE2 ") OR { 2327} (segid " " and resid "15 " and name "HG23") (segid " " and resid "29 " and name "HE2 ") OR { 2327} (segid " " and resid "15 " and name "HG23") (segid " " and resid "33 " and name "HE2 ") OR { 2327} (segid " " and resid "15 " and name "HG23") (segid " " and resid "33 " and name "HE1 ") OR { 2327} (segid " " and resid "15 " and name "HG21") (segid " " and resid "33 " and name "HE2 ") ASSI { 2328} (segid " " and resid "15 " and name "HG23") (segid " " and resid "26 " and name "HA ") 6.000 6.000 0.000 peak 2328 weight 0.10000E+01 volume -0.19500E+00 ppm1 0.941 ppm2 4.577 OR { 2328} (segid " " and resid "15 " and name "HG23") (segid " " and resid "17 " and name "HA ") OR { 2328} (segid " " and resid "15 " and name "HG22") (segid " " and resid "17 " and name "HA ") OR { 2328} (segid " " and resid "15 " and name "HG21") (segid " " and resid "17 " and name "HA ") OR { 2328} (segid " " and resid "15 " and name "HG22") (segid " " and resid "26 " and name "HA ") ASSI { 3378} (segid " " and resid "16 " and name "HA ") (segid " " and resid "2 " and name "HB2 ") 6.000 6.000 0.000 peak 3378 weight 0.10000E+01 volume -0.10100E+00 ppm1 4.919 ppm2 1.678 ASSI { 4918} (segid " " and resid "16 " and name "HB1 ") (segid " " and resid "16 " and name "HG2 ") 3.300 3.300 0.000 peak 4918 weight 0.10000E+01 volume -0.23600E+01 ppm1 1.955 ppm2 2.126 ASSI { 2354} (segid " " and resid "16 " and name "HG1 ") (segid " " and resid "16 " and name "HB1 ") 3.300 3.300 0.000 peak 2354 weight 0.10000E+01 volume -0.21640E+01 ppm1 2.219 ppm2 1.942 OR { 2354} (segid " " and resid "16 " and name "HG1 ") (segid " " and resid "2 " and name "HG2 ") ASSI { 2333} (segid " " and resid "16 " and name "HG1 ") (segid " " and resid "16 " and name "HG2 ") 2.700 2.700 0.000 peak 2333 weight 0.10000E+01 volume -0.78580E+01 ppm1 2.219 ppm2 2.126 ASSI { 2355} (segid " " and resid "16 " and name "HG1 ") (segid " " and resid "16 " and name "HA ") 5.000 5.000 0.000 peak 2355 weight 0.10000E+01 volume -0.37600E+00 ppm1 2.219 ppm2 4.919 ASSI { 2357} (segid " " and resid "16 " and name "HG2 ") (segid " " and resid "2 " and name "HG2 ") 3.300 3.300 0.000 peak 2357 weight 0.10000E+01 volume -0.24040E+01 ppm1 2.113 ppm2 1.942 OR { 2357} (segid " " and resid "16 " and name "HG2 ") (segid " " and resid "16 " and name "HB1 ") ASSI { 2359} (segid " " and resid "16 " and name "HG2 ") (segid " " and resid "16 " and name "HA ") 5.000 5.000 0.000 peak 2359 weight 0.10000E+01 volume -0.40700E+00 ppm1 2.113 ppm2 4.919 ASSI { 2394} (segid " " and resid "17 " and name "HG13") (segid " " and resid "1 " and name "HG1 ") 6.000 6.000 0.000 peak 2394 weight 0.10000E+01 volume -0.70000E-01 ppm1 0.651 ppm2 2.495 OR { 2394} (segid " " and resid "17 " and name "HG12") (segid " " and resid "1 " and name "HG1 ") OR { 2394} (segid " " and resid "17 " and name "HG11") (segid " " and resid "1 " and name "HG1 ") ASSI { 2381} (segid " " and resid "17 " and name "HG13") (segid " " and resid "17 " and name "HG22") 3.300 3.300 0.000 peak 2381 weight 0.10000E+01 volume -0.37360E+01 ppm1 0.651 ppm2 0.387 OR { 2381} (segid " " and resid "17 " and name "HG11") (segid " " and resid "17 " and name "HG22") OR { 2381} (segid " " and resid "17 " and name "HG12") (segid " " and resid "17 " and name "HG22") OR { 2381} (segid " " and resid "17 " and name "HG12") (segid " " and resid "17 " and name "HG23") OR { 2381} (segid " " and resid "17 " and name "HG12") (segid " " and resid "17 " and name "HG21") OR { 2381} (segid " " and resid "17 " and name "HG11") (segid " " and resid "17 " and name "HG23") OR { 2381} (segid " " and resid "17 " and name "HG11") (segid " " and resid "17 " and name "HG21") OR { 2381} (segid " " and resid "17 " and name "HG13") (segid " " and resid "17 " and name "HG23") ASSI { 2386} (segid " " and resid "17 " and name "HG13") (segid " " and resid "29 " and name "HD2 ") 5.000 5.000 0.000 peak 2386 weight 0.10000E+01 volume -0.88400E+00 ppm1 0.648 ppm2 1.696 OR { 2386} (segid " " and resid "17 " and name "HG12") (segid " " and resid "29 " and name "HD2 ") OR { 2386} (segid " " and resid "17 " and name "HG11") (segid " " and resid "29 " and name "HD2 ") OR { 2386} (segid " " and resid "17 " and name "HG12") (segid " " and resid "15 " and name "HB ") ASSI { 2388} (segid " " and resid "17 " and name "HG11") (segid " " and resid "29 " and name "HD1 ") 5.000 5.000 0.000 peak 2388 weight 0.10000E+01 volume -0.45000E+00 ppm1 0.651 ppm2 1.863 OR { 2388} (segid " " and resid "17 " and name "HG12") (segid " " and resid "29 " and name "HD1 ") OR { 2388} (segid " " and resid "17 " and name "HG13") (segid " " and resid "29 " and name "HD1 ") ASSI { 2382} (segid " " and resid "17 " and name "HG12") (segid " " and resid "17 " and name "HB ") 3.300 3.300 0.000 peak 2382 weight 0.10000E+01 volume -0.24920E+01 ppm1 0.651 ppm2 2.100 OR { 2382} (segid " " and resid "17 " and name "HG11") (segid " " and resid "17 " and name "HB ") OR { 2382} (segid " " and resid "17 " and name "HG13") (segid " " and resid "17 " and name "HB ") ASSI { 2393} (segid " " and resid "17 " and name "HG12") (segid " " and resid "29 " and name "HE2 ") 6.000 6.000 0.000 peak 2393 weight 0.10000E+01 volume -0.11800E+00 ppm1 0.638 ppm2 3.101 OR { 2393} (segid " " and resid "17 " and name "HG13") (segid " " and resid "29 " and name "HE2 ") OR { 2393} (segid " " and resid "17 " and name "HG11") (segid " " and resid "29 " and name "HE2 ") ASSI { 2391} (segid " " and resid "17 " and name "HG13") (segid " " and resid "16 " and name "HA ") 6.000 6.000 0.000 peak 2391 weight 0.10000E+01 volume -0.11000E+00 ppm1 0.638 ppm2 4.919 OR { 2391} (segid " " and resid "17 " and name "HG12") (segid " " and resid "16 " and name "HA ") OR { 2391} (segid " " and resid "17 " and name "HG11") (segid " " and resid "16 " and name "HA ") ASSI { 2385} (segid " " and resid "17 " and name "HG11") (segid " " and resid "26 " and name "HD1 ") 5.000 5.000 0.000 peak 2385 weight 0.10000E+01 volume -0.76800E+00 ppm1 0.651 ppm2 7.080 OR { 2385} (segid " " and resid "17 " and name "HG13") (segid " " and resid "26 " and name "HD1 ") OR { 2385} (segid " " and resid "17 " and name "HG11") (segid " " and resid "26 " and name "HD2 ") OR { 2385} (segid " " and resid "17 " and name "HG12") (segid " " and resid "26 " and name "HD2 ") ASSI { 2395} (segid " " and resid "17 " and name "HG21") (segid " " and resid "3 " and name "HG23") 3.300 3.300 0.000 peak 2395 weight 0.10000E+01 volume -0.35870E+01 ppm1 0.387 ppm2 0.598 OR { 2395} (segid " " and resid "17 " and name "HG22") (segid " " and resid "17 " and name "HG13") OR { 2395} (segid " " and resid "17 " and name "HG21") (segid " " and resid "3 " and name "HG11") OR { 2395} (segid " " and resid "17 " and name "HG22") (segid " " and resid "17 " and name "HG11") OR { 2395} (segid " " and resid "17 " and name "HG23") (segid " " and resid "3 " and name "HG22") OR { 2395} (segid " " and resid "17 " and name "HG23") (segid " " and resid "3 " and name "HG21") OR { 2395} (segid " " and resid "17 " and name "HG22") (segid " " and resid "3 " and name "HG12") OR { 2395} (segid " " and resid "17 " and name "HG22") (segid " " and resid "17 " and name "HG12") OR { 2395} (segid " " and resid "17 " and name "HG23") (segid " " and resid "17 " and name "HG12") OR { 2395} (segid " " and resid "17 " and name "HG21") (segid " " and resid "17 " and name "HG12") OR { 2395} (segid " " and resid "17 " and name "HG23") (segid " " and resid "17 " and name "HG11") OR { 2395} (segid " " and resid "17 " and name "HG21") (segid " " and resid "17 " and name "HG11") OR { 2395} (segid " " and resid "17 " and name "HG23") (segid " " and resid "17 " and name "HG13") OR { 2395} (segid " " and resid "17 " and name "HG21") (segid " " and resid "3 " and name "HG21") OR { 2395} (segid " " and resid "17 " and name "HG22") (segid " " and resid "3 " and name "HG11") OR { 2395} (segid " " and resid "17 " and name "HG22") (segid " " and resid "3 " and name "HG22") OR { 2395} (segid " " and resid "17 " and name "HG23") (segid " " and resid "3 " and name "HG12") ASSI { 2404} (segid " " and resid "17 " and name "HG21") (segid " " and resid "5 " and name "HD13") 6.000 6.000 0.000 peak 2404 weight 0.10000E+01 volume -0.13600E+00 ppm1 0.387 ppm2 0.782 OR { 2404} (segid " " and resid "17 " and name "HG23") (segid " " and resid "5 " and name "HD13") OR { 2404} (segid " " and resid "17 " and name "HG21") (segid " " and resid "5 " and name "HD12") OR { 2404} (segid " " and resid "17 " and name "HG23") (segid " " and resid "5 " and name "HD12") OR { 2404} (segid " " and resid "17 " and name "HG21") (segid " " and resid "5 " and name "HD11") OR { 2404} (segid " " and resid "17 " and name "HG22") (segid " " and resid "5 " and name "HD12") OR { 2404} (segid " " and resid "17 " and name "HG22") (segid " " and resid "5 " and name "HD13") OR { 2404} (segid " " and resid "17 " and name "HG22") (segid " " and resid "5 " and name "HD11") OR { 2404} (segid " " and resid "17 " and name "HG21") (segid " " and resid "43 " and name "HD12") OR { 2404} (segid " " and resid "17 " and name "HG22") (segid " " and resid "43 " and name "HD12") OR { 2404} (segid " " and resid "17 " and name "HG21") (segid " " and resid "43 " and name "HD13") OR { 2404} (segid " " and resid "17 " and name "HG23") (segid " " and resid "5 " and name "HD11") OR { 2404} (segid " " and resid "17 " and name "HG21") (segid " " and resid "43 " and name "HD11") OR { 2404} (segid " " and resid "17 " and name "HG23") (segid " " and resid "43 " and name "HD12") OR { 2404} (segid " " and resid "17 " and name "HG22") (segid " " and resid "43 " and name "HD13") OR { 2404} (segid " " and resid "17 " and name "HG22") (segid " " and resid "43 " and name "HD11") OR { 2404} (segid " " and resid "17 " and name "HG23") (segid " " and resid "43 " and name "HD11") OR { 2404} (segid " " and resid "17 " and name "HG23") (segid " " and resid "43 " and name "HD13") OR { 2404} (segid " " and resid "17 " and name "HG23") (segid " " and resid "43 " and name "HD22") OR { 2404} (segid " " and resid "17 " and name "HG22") (segid " " and resid "43 " and name "HD23") ASSI { 2402} (segid " " and resid "17 " and name "HG23") (segid " " and resid "56 " and name "HG ") 6.000 6.000 0.000 peak 2402 weight 0.10000E+01 volume -0.25900E+00 ppm1 0.387 ppm2 1.678 OR { 2402} (segid " " and resid "17 " and name "HG21") (segid " " and resid "15 " and name "HB ") OR { 2402} (segid " " and resid "17 " and name "HG23") (segid " " and resid "15 " and name "HB ") OR { 2402} (segid " " and resid "17 " and name "HG21") (segid " " and resid "56 " and name "HG ") OR { 2402} (segid " " and resid "17 " and name "HG22") (segid " " and resid "15 " and name "HB ") ASSI { 2407} (segid " " and resid "17 " and name "HG23") (segid " " and resid "56 " and name "HB2 ") 6.000 6.000 0.000 peak 2407 weight 0.10000E+01 volume -0.18300E+00 ppm1 0.387 ppm2 1.863 OR { 2407} (segid " " and resid "17 " and name "HG21") (segid " " and resid "56 " and name "HB2 ") OR { 2407} (segid " " and resid "17 " and name "HG22") (segid " " and resid "56 " and name "HB2 ") OR { 2407} (segid " " and resid "17 " and name "HG23") (segid " " and resid "16 " and name "HB2 ") OR { 2407} (segid " " and resid "17 " and name "HG21") (segid " " and resid "16 " and name "HB2 ") OR { 2407} (segid " " and resid "17 " and name "HG23") (segid " " and resid "29 " and name "HD1 ") OR { 2407} (segid " " and resid "17 " and name "HG22") (segid " " and resid "16 " and name "HB2 ") OR { 2407} (segid " " and resid "17 " and name "HG21") (segid " " and resid "29 " and name "HD1 ") OR { 2407} (segid " " and resid "17 " and name "HG21") (segid " " and resid "2 " and name "HB1 ") OR { 2407} (segid " " and resid "17 " and name "HG22") (segid " " and resid "29 " and name "HD1 ") OR { 2407} (segid " " and resid "17 " and name "HG23") (segid " " and resid "2 " and name "HB1 ") OR { 2407} (segid " " and resid "17 " and name "HG22") (segid " " and resid "2 " and name "HB1 ") OR { 2407} (segid " " and resid "17 " and name "HG23") (segid " " and resid "29 " and name "HG1 ") ASSI { 2400} (segid " " and resid "17 " and name "HG21") (segid " " and resid "1 " and name "HG1 ") 5.000 5.000 0.000 peak 2400 weight 0.10000E+01 volume -0.65400E+00 ppm1 0.387 ppm2 2.495 OR { 2400} (segid " " and resid "17 " and name "HG22") (segid " " and resid "1 " and name "HG1 ") ASSI { 2413} (segid " " and resid "17 " and name "HG21") (segid " " and resid "2 " and name "HA ") 6.000 6.000 0.000 peak 2413 weight 0.10000E+01 volume -0.71000E-01 ppm1 0.387 ppm2 4.788 OR { 2413} (segid " " and resid "17 " and name "HG23") (segid " " and resid "2 " and name "HA ") OR { 2413} (segid " " and resid "17 " and name "HG22") (segid " " and resid "2 " and name "HA ") ASSI { 2412} (segid " " and resid "17 " and name "HG23") (segid " " and resid "16 " and name "HA ") 6.000 6.000 0.000 peak 2412 weight 0.10000E+01 volume -0.10400E+00 ppm1 0.387 ppm2 4.893 OR { 2412} (segid " " and resid "17 " and name "HG22") (segid " " and resid "16 " and name "HA ") OR { 2412} (segid " " and resid "17 " and name "HG21") (segid " " and resid "16 " and name "HA ") ASSI { 2406} (segid " " and resid "17 " and name "HG23") (segid " " and resid "56 " and name "HB2 ") 6.000 6.000 0.000 peak 2406 weight 0.10000E+01 volume -0.19200E+00 ppm1 0.387 ppm2 1.889 OR { 2406} (segid " " and resid "17 " and name "HG21") (segid " " and resid "56 " and name "HB2 ") OR { 2406} (segid " " and resid "17 " and name "HG22") (segid " " and resid "56 " and name "HB2 ") OR { 2406} (segid " " and resid "17 " and name "HG23") (segid " " and resid "16 " and name "HB2 ") OR { 2406} (segid " " and resid "17 " and name "HG21") (segid " " and resid "16 " and name "HB2 ") OR { 2406} (segid " " and resid "17 " and name "HG23") (segid " " and resid "29 " and name "HD1 ") OR { 2406} (segid " " and resid "17 " and name "HG22") (segid " " and resid "16 " and name "HB2 ") OR { 2406} (segid " " and resid "17 " and name "HG21") (segid " " and resid "29 " and name "HD1 ") OR { 2406} (segid " " and resid "17 " and name "HG21") (segid " " and resid "2 " and name "HB1 ") OR { 2406} (segid " " and resid "17 " and name "HG22") (segid " " and resid "29 " and name "HD1 ") OR { 2406} (segid " " and resid "17 " and name "HG23") (segid " " and resid "2 " and name "HB1 ") OR { 2406} (segid " " and resid "17 " and name "HG21") (segid " " and resid "63 " and name "HB1 ") OR { 2406} (segid " " and resid "17 " and name "HG22") (segid " " and resid "2 " and name "HB1 ") OR { 2406} (segid " " and resid "17 " and name "HG23") (segid " " and resid "29 " and name "HG1 ") ASSI { 2410} (segid " " and resid "17 " and name "HG22") (segid " " and resid "1 " and name "HA ") 6.000 6.000 0.000 peak 2410 weight 0.10000E+01 volume -0.98000E-01 ppm1 0.387 ppm2 4.182 OR { 2410} (segid " " and resid "17 " and name "HG21") (segid " " and resid "1 " and name "HA ") OR { 2410} (segid " " and resid "17 " and name "HG21") (segid " " and resid "3 " and name "HA ") OR { 2410} (segid " " and resid "17 " and name "HG23") (segid " " and resid "3 " and name "HA ") OR { 2410} (segid " " and resid "17 " and name "HG23") (segid " " and resid "1 " and name "HA ") OR { 2410} (segid " " and resid "17 " and name "HG22") (segid " " and resid "3 " and name "HA ") ASSI { 4971} (segid " " and resid "18 " and name "HA ") (segid " " and resid "18 " and name "HG2 ") 5.000 5.000 0.000 peak 4971 weight 0.10000E+01 volume -0.89600E+00 ppm1 5.017 ppm2 2.200 ASSI { 2422} (segid " " and resid "18 " and name "HA ") (segid " " and resid "1 " and name "HG1 ") 6.000 6.000 0.000 peak 2422 weight 0.10000E+01 volume -0.27000E+00 ppm1 5.012 ppm2 2.495 ASSI { 2436} (segid " " and resid "18 " and name "HG1 ") (segid " " and resid "18 " and name "HB1 ") 5.000 5.000 0.000 peak 2436 weight 0.10000E+01 volume -0.16190E+01 ppm1 2.350 ppm2 2.100 OR { 2436} (segid " " and resid "18 " and name "HG1 ") (segid " " and resid "1 " and name "HB1 ") ASSI { 2437} (segid " " and resid "18 " and name "HG1 ") (segid " " and resid "18 " and name "HB2 ") 5.000 5.000 0.000 peak 2437 weight 0.10000E+01 volume -0.12730E+01 ppm1 2.350 ppm2 1.652 ASSI { 2435} (segid " " and resid "18 " and name "HG1 ") (segid " " and resid "18 " and name "HG2 ") 2.700 2.700 0.000 peak 2435 weight 0.10000E+01 volume -0.49380E+01 ppm1 2.350 ppm2 2.205 ASSI { 2440} (segid " " and resid "18 " and name "HG2 ") (segid " " and resid "18 " and name "HB2 ") 5.000 5.000 0.000 peak 2440 weight 0.10000E+01 volume -0.11210E+01 ppm1 2.205 ppm2 1.652 ASSI { 2452} (segid " " and resid "19 " and name "HA ") (segid " " and resid "56 " and name "HG ") 6.000 6.000 0.000 peak 2452 weight 0.10000E+01 volume -0.22000E+00 ppm1 3.997 ppm2 1.652 ASSI { 2453} (segid " " and resid "19 " and name "HA ") (segid " " and resid "18 " and name "HA ") 6.000 6.000 0.000 peak 2453 weight 0.10000E+01 volume -0.80000E-01 ppm1 3.984 ppm2 5.025 ASSI { 2455} (segid " " and resid "19 " and name "HB1 ") (segid " " and resid "19 " and name "HB2 ") 2.700 2.700 0.000 peak 2455 weight 0.10000E+01 volume -0.48770E+01 ppm1 2.337 ppm2 2.021 OR { 2455} (segid " " and resid "19 " and name "HB1 ") (segid " " and resid "19 " and name "HG2 ") ASSI { 2458} (segid " " and resid "19 " and name "HB1 ") (segid " " and resid "57 " and name "HB1 ") 5.000 5.000 0.000 peak 2458 weight 0.10000E+01 volume -0.81400E+00 ppm1 2.337 ppm2 3.734 ASSI { 2466} (segid " " and resid "19 " and name "HB2 ") (segid " " and resid "1 " and name "HE2 ") 6.000 6.000 0.000 peak 2466 weight 0.10000E+01 volume -0.20100E+00 ppm1 2.021 ppm2 1.520 OR { 2466} (segid " " and resid "19 " and name "HB2 ") (segid " " and resid "1 " and name "HE3 ") OR { 2466} (segid " " and resid "19 " and name "HB2 ") (segid " " and resid "1 " and name "HE1 ") ASSI { 2463} (segid " " and resid "19 " and name "HB2 ") (segid " " and resid "19 " and name "HG1 ") 5.000 5.000 0.000 peak 2463 weight 0.10000E+01 volume -0.16320E+01 ppm1 2.021 ppm2 2.205 ASSI { 2461} (segid " " and resid "19 " and name "HB2 ") (segid " " and resid "19 " and name "HB1 ") 3.300 3.300 0.000 peak 2461 weight 0.10000E+01 volume -0.33420E+01 ppm1 2.021 ppm2 2.337 ASSI { 2465} (segid " " and resid "19 " and name "HB2 ") (segid " " and resid "57 " and name "HB1 ") 5.000 5.000 0.000 peak 2465 weight 0.10000E+01 volume -0.84700E+00 ppm1 2.021 ppm2 3.734 ASSI { 2482} (segid " " and resid "19 " and name "HD1 ") (segid " " and resid "19 " and name "HG1 ") 5.000 5.000 0.000 peak 2482 weight 0.10000E+01 volume -0.10720E+01 ppm1 4.024 ppm2 2.205 OR { 2482} (segid " " and resid "19 " and name "HD1 ") (segid " " and resid "18 " and name "HG2 ") ASSI { 2489} (segid " " and resid "19 " and name "HD2 ") (segid " " and resid "19 " and name "HG2 ") 5.000 5.000 0.000 peak 2489 weight 0.10000E+01 volume -0.14000E+01 ppm1 3.734 ppm2 2.021 OR { 2489} (segid " " and resid "19 " and name "HD2 ") (segid " " and resid "1 " and name "HB2 ") OR { 2489} (segid " " and resid "19 " and name "HD2 ") (segid " " and resid "19 " and name "HB2 ") ASSI { 2491} (segid " " and resid "19 " and name "HD2 ") (segid " " and resid "19 " and name "HB1 ") 5.000 5.000 0.000 peak 2491 weight 0.10000E+01 volume -0.36000E+00 ppm1 3.734 ppm2 2.337 OR { 2491} (segid " " and resid "19 " and name "HD2 ") (segid " " and resid "18 " and name "HG1 ") ASSI { 2469} (segid " " and resid "19 " and name "HG2 ") (segid " " and resid "19 " and name "HG1 ") 3.300 3.300 0.000 peak 2469 weight 0.10000E+01 volume -0.30000E+01 ppm1 2.021 ppm2 2.205 ASSI { 2473} (segid " " and resid "19 " and name "HG2 ") (segid " " and resid "19 " and name "HB1 ") 5.000 5.000 0.000 peak 2473 weight 0.10000E+01 volume -0.18790E+01 ppm1 2.021 ppm2 2.337 ASSI { 2477} (segid " " and resid "19 " and name "HG2 ") (segid " " and resid "19 " and name "HD2 ") 5.000 5.000 0.000 peak 2477 weight 0.10000E+01 volume -0.10500E+01 ppm1 2.018 ppm2 3.737 ASSI { 2476} (segid " " and resid "19 " and name "HG2 ") (segid " " and resid "19 " and name "HD1 ") 5.000 5.000 0.000 peak 2476 weight 0.10000E+01 volume -0.10660E+01 ppm1 2.015 ppm2 4.003 OR { 2476} (segid " " and resid "19 " and name "HG2 ") (segid " " and resid "19 " and name "HA ") ASSI { 2507} (segid " " and resid "20 " and name "HB1 ") (segid " " and resid "55 " and name "HG23") 6.000 6.000 0.000 peak 2507 weight 0.10000E+01 volume -0.10500E+00 ppm1 3.773 ppm2 1.151 OR { 2507} (segid " " and resid "20 " and name "HB1 ") (segid " " and resid "55 " and name "HG21") OR { 2507} (segid " " and resid "20 " and name "HB1 ") (segid " " and resid "55 " and name "HG22") ASSI { 2504} (segid " " and resid "20 " and name "HB2 ") (segid " " and resid "55 " and name "HG23") 6.000 6.000 0.000 peak 2504 weight 0.10000E+01 volume -0.14000E+00 ppm1 4.142 ppm2 1.151 OR { 2504} (segid " " and resid "20 " and name "HB2 ") (segid " " and resid "55 " and name "HG21") OR { 2504} (segid " " and resid "20 " and name "HB2 ") (segid " " and resid "55 " and name "HG22") ASSI { 2509} (segid " " and resid "21 " and name "HA ") (segid " " and resid "21 " and name "HB2 ") 6.000 6.000 0.000 peak 2509 weight 0.10000E+01 volume -0.77000E-01 ppm1 4.669 ppm2 2.917 OR { 2509} (segid " " and resid "21 " and name "HA ") (segid " " and resid "25 " and name "HB2 ") ASSI { 2522} (segid " " and resid "21 " and name "HB1 ") (segid " " and resid "56 " and name "HG ") 6.000 6.000 0.000 peak 2522 weight 0.10000E+01 volume -0.16000E+00 ppm1 2.601 ppm2 1.678 OR { 2522} (segid " " and resid "21 " and name "HB1 ") (segid " " and resid "18 " and name "HB2 ") OR { 2522} (segid " " and resid "21 " and name "HB1 ") (segid " " and resid "29 " and name "HD2 ") ASSI { 2516} (segid " " and resid "21 " and name "HB1 ") (segid " " and resid "21 " and name "HB2 ") 3.300 3.300 0.000 peak 2516 weight 0.10000E+01 volume -0.34610E+01 ppm1 2.574 ppm2 2.917 ASSI { 2520} (segid " " and resid "21 " and name "HB1 ") (segid " " and resid "25 " and name "HB1 ") 5.000 5.000 0.000 peak 2520 weight 0.10000E+01 volume -0.36800E+00 ppm1 2.601 ppm2 3.075 ASSI { 2513} (segid " " and resid "21 " and name "HB2 ") (segid " " and resid "56 " and name "HG ") 6.000 6.000 0.000 peak 2513 weight 0.10000E+01 volume -0.28600E+00 ppm1 2.917 ppm2 1.678 OR { 2513} (segid " " and resid "21 " and name "HB2 ") (segid " " and resid "18 " and name "HB2 ") ASSI { 2527} (segid " " and resid "22 " and name "HG22") (segid " " and resid "55 " and name "HB ") 6.000 6.000 0.000 peak 2527 weight 0.10000E+01 volume -0.15100E+00 ppm1 1.336 ppm2 4.471 OR { 2527} (segid " " and resid "22 " and name "HG23") (segid " " and resid "55 " and name "HB ") OR { 2527} (segid " " and resid "22 " and name "HG21") (segid " " and resid "55 " and name "HB ") ASSI { 2529} (segid " " and resid "22 " and name "HG21") (segid " " and resid "53 " and name "HA2 ") 6.000 6.000 0.000 peak 2529 weight 0.10000E+01 volume -0.89000E-01 ppm1 1.336 ppm2 3.944 OR { 2529} (segid " " and resid "22 " and name "HG23") (segid " " and resid "53 " and name "HA2 ") OR { 2529} (segid " " and resid "22 " and name "HG22") (segid " " and resid "53 " and name "HA2 ") ASSI { 2538} (segid " " and resid "23 " and name "HA ") (segid " " and resid "27 " and name "HD2 ") 6.000 6.000 0.000 peak 2538 weight 0.10000E+01 volume -0.12000E+00 ppm1 3.589 ppm2 1.652 OR { 2538} (segid " " and resid "23 " and name "HA ") (segid " " and resid "27 " and name "HG1 ") OR { 2538} (segid " " and resid "23 " and name "HA ") (segid " " and resid "56 " and name "HG ") ASSI { 2540} (segid " " and resid "23 " and name "HA ") (segid " " and resid "52 " and name "HA ") 6.000 6.000 0.000 peak 2540 weight 0.10000E+01 volume -0.86000E-01 ppm1 3.576 ppm2 4.392 OR { 2540} (segid " " and resid "23 " and name "HA ") (segid " " and resid "27 " and name "HA ") ASSI { 2582} (segid " " and resid "23 " and name "HG12") (segid " " and resid "50 " and name "HD12") 6.000 6.000 0.000 peak 2582 weight 0.10000E+01 volume -0.29300E+00 ppm1 0.848 ppm2 0.572 OR { 2582} (segid " " and resid "23 " and name "HG12") (segid " " and resid "50 " and name "HD13") OR { 2582} (segid " " and resid "23 " and name "HG13") (segid " " and resid "50 " and name "HD13") OR { 2582} (segid " " and resid "23 " and name "HG13") (segid " " and resid "50 " and name "HD12") OR { 2582} (segid " " and resid "23 " and name "HG11") (segid " " and resid "50 " and name "HD11") ASSI { 2584} (segid " " and resid "23 " and name "HG12") (segid " " and resid "50 " and name "HD21") 6.000 6.000 0.000 peak 2584 weight 0.10000E+01 volume -0.19400E+00 ppm1 0.848 ppm2 0.150 OR { 2584} (segid " " and resid "23 " and name "HG11") (segid " " and resid "50 " and name "HD21") OR { 2584} (segid " " and resid "23 " and name "HG13") (segid " " and resid "50 " and name "HD23") OR { 2584} (segid " " and resid "23 " and name "HG11") (segid " " and resid "50 " and name "HD23") ASSI { 2580} (segid " " and resid "23 " and name "HG12") (segid " " and resid "27 " and name "HD2 ") 5.000 5.000 0.000 peak 2580 weight 0.10000E+01 volume -0.83600E+00 ppm1 0.848 ppm2 1.652 OR { 2580} (segid " " and resid "23 " and name "HG13") (segid " " and resid "27 " and name "HD2 ") OR { 2580} (segid " " and resid "23 " and name "HG11") (segid " " and resid "27 " and name "HD2 ") OR { 2580} (segid " " and resid "23 " and name "HG12") (segid " " and resid "27 " and name "HG1 ") OR { 2580} (segid " " and resid "23 " and name "HG13") (segid " " and resid "27 " and name "HG1 ") OR { 2580} (segid " " and resid "23 " and name "HG13") (segid " " and resid "27 " and name "HD1 ") ASSI { 2591} (segid " " and resid "23 " and name "HG11") (segid " " and resid "27 " and name "HB2 ") 6.000 6.000 0.000 peak 2591 weight 0.10000E+01 volume -0.13900E+00 ppm1 0.848 ppm2 2.021 OR { 2591} (segid " " and resid "23 " and name "HG12") (segid " " and resid "27 " and name "HB2 ") OR { 2591} (segid " " and resid "23 " and name "HG13") (segid " " and resid "27 " and name "HB2 ") OR { 2591} (segid " " and resid "23 " and name "HG13") (segid " " and resid "24 " and name "HB2 ") OR { 2591} (segid " " and resid "23 " and name "HG11") (segid " " and resid "24 " and name "HB2 ") ASSI { 2573} (segid " " and resid "23 " and name "HG12") (segid " " and resid "23 " and name "HB ") 3.300 3.300 0.000 peak 2573 weight 0.10000E+01 volume -0.22570E+01 ppm1 0.848 ppm2 2.284 OR { 2573} (segid " " and resid "23 " and name "HG13") (segid " " and resid "23 " and name "HB ") OR { 2573} (segid " " and resid "23 " and name "HG11") (segid " " and resid "23 " and name "HB ") ASSI { 2590} (segid " " and resid "23 " and name "HG12") (segid " " and resid "26 " and name "HB2 ") 6.000 6.000 0.000 peak 2590 weight 0.10000E+01 volume -0.90000E-01 ppm1 0.861 ppm2 3.207 OR { 2590} (segid " " and resid "23 " and name "HG13") (segid " " and resid "26 " and name "HB2 ") OR { 2590} (segid " " and resid "23 " and name "HG11") (segid " " and resid "26 " and name "HB2 ") ASSI { 2537} (segid " " and resid "23 " and name "HG21") (segid " " and resid "23 " and name "HG11") 2.700 2.700 0.000 peak 2537 weight 0.10000E+01 volume -0.41690E+01 ppm1 1.059 ppm2 0.835 OR { 2537} (segid " " and resid "23 " and name "HG23") (segid " " and resid "23 " and name "HG12") OR { 2537} (segid " " and resid "23 " and name "HG21") (segid " " and resid "23 " and name "HG13") OR { 2537} (segid " " and resid "23 " and name "HG23") (segid " " and resid "23 " and name "HG11") OR { 2537} (segid " " and resid "23 " and name "HG21") (segid " " and resid "23 " and name "HG12") OR { 2537} (segid " " and resid "23 " and name "HG23") (segid " " and resid "23 " and name "HG13") OR { 2537} (segid " " and resid "23 " and name "HG22") (segid " " and resid "23 " and name "HG11") OR { 2537} (segid " " and resid "23 " and name "HG22") (segid " " and resid "23 " and name "HG12") ASSI { 2553} (segid " " and resid "23 " and name "HG22") (segid " " and resid "50 " and name "HD22") 5.000 5.000 0.000 peak 2553 weight 0.10000E+01 volume -0.48000E+00 ppm1 1.059 ppm2 0.150 OR { 2553} (segid " " and resid "23 " and name "HG21") (segid " " and resid "50 " and name "HD22") OR { 2553} (segid " " and resid "23 " and name "HG23") (segid " " and resid "50 " and name "HD23") OR { 2553} (segid " " and resid "23 " and name "HG22") (segid " " and resid "50 " and name "HD23") OR { 2553} (segid " " and resid "23 " and name "HG23") (segid " " and resid "50 " and name "HD22") ASSI { 2556} (segid " " and resid "23 " and name "HG23") (segid " " and resid "50 " and name "HD12") 5.000 5.000 0.000 peak 2556 weight 0.10000E+01 volume -0.50300E+00 ppm1 1.059 ppm2 0.572 OR { 2556} (segid " " and resid "23 " and name "HG23") (segid " " and resid "50 " and name "HD13") OR { 2556} (segid " " and resid "23 " and name "HG21") (segid " " and resid "50 " and name "HD13") OR { 2556} (segid " " and resid "23 " and name "HG21") (segid " " and resid "50 " and name "HD11") ASSI { 2554} (segid " " and resid "23 " and name "HG23") (segid " " and resid "50 " and name "HB2 ") 5.000 5.000 0.000 peak 2554 weight 0.10000E+01 volume -0.64000E+00 ppm1 1.059 ppm2 1.520 OR { 2554} (segid " " and resid "23 " and name "HG21") (segid " " and resid "50 " and name "HB2 ") OR { 2554} (segid " " and resid "23 " and name "HG22") (segid " " and resid "50 " and name "HB2 ") ASSI { 2562} (segid " " and resid "23 " and name "HG23") (segid " " and resid "54 " and name "HG2 ") 6.000 6.000 0.000 peak 2562 weight 0.10000E+01 volume -0.26900E+00 ppm1 1.059 ppm2 1.678 OR { 2562} (segid " " and resid "23 " and name "HG21") (segid " " and resid "54 " and name "HG2 ") OR { 2562} (segid " " and resid "23 " and name "HG21") (segid " " and resid "56 " and name "HG ") OR { 2562} (segid " " and resid "23 " and name "HG23") (segid " " and resid "56 " and name "HG ") OR { 2562} (segid " " and resid "23 " and name "HG22") (segid " " and resid "54 " and name "HG2 ") OR { 2562} (segid " " and resid "23 " and name "HG22") (segid " " and resid "56 " and name "HG ") ASSI { 2568} (segid " " and resid "23 " and name "HG22") (segid " " and resid "54 " and name "HG1 ") 6.000 6.000 0.000 peak 2568 weight 0.10000E+01 volume -0.16700E+00 ppm1 1.059 ppm2 1.916 OR { 2568} (segid " " and resid "23 " and name "HG23") (segid " " and resid "54 " and name "HG1 ") ASSI { 2541} (segid " " and resid "23 " and name "HG22") (segid " " and resid "23 " and name "HB ") 3.300 3.300 0.000 peak 2541 weight 0.10000E+01 volume -0.24440E+01 ppm1 1.059 ppm2 2.284 OR { 2541} (segid " " and resid "23 " and name "HG23") (segid " " and resid "23 " and name "HB ") OR { 2541} (segid " " and resid "23 " and name "HG21") (segid " " and resid "23 " and name "HB ") ASSI { 2551} (segid " " and resid "23 " and name "HG23") (segid " " and resid "54 " and name "HB2 ") 5.000 5.000 0.000 peak 2551 weight 0.10000E+01 volume -0.95300E+00 ppm1 1.059 ppm2 2.390 OR { 2551} (segid " " and resid "23 " and name "HG21") (segid " " and resid "54 " and name "HB2 ") OR { 2551} (segid " " and resid "23 " and name "HG22") (segid " " and resid "54 " and name "HB2 ") OR { 2551} (segid " " and resid "23 " and name "HG23") (segid " " and resid "54 " and name "HB1 ") OR { 2551} (segid " " and resid "23 " and name "HG21") (segid " " and resid "54 " and name "HB1 ") ASSI { 2572} (segid " " and resid "23 " and name "HG21") (segid " " and resid "27 " and name "HE2 ") 6.000 6.000 0.000 peak 2572 weight 0.10000E+01 volume -0.92000E-01 ppm1 1.072 ppm2 2.627 OR { 2572} (segid " " and resid "23 " and name "HG22") (segid " " and resid "27 " and name "HE2 ") OR { 2572} (segid " " and resid "23 " and name "HG23") (segid " " and resid "27 " and name "HE2 ") OR { 2572} (segid " " and resid "23 " and name "HG22") (segid " " and resid "59 " and name "HB2 ") OR { 2572} (segid " " and resid "23 " and name "HG21") (segid " " and resid "52 " and name "HB1 ") OR { 2572} (segid " " and resid "23 " and name "HG22") (segid " " and resid "52 " and name "HB1 ") OR { 2572} (segid " " and resid "23 " and name "HG23") (segid " " and resid "59 " and name "HB2 ") OR { 2572} (segid " " and resid "23 " and name "HG23") (segid " " and resid "52 " and name "HB1 ") ASSI { 2570} (segid " " and resid "23 " and name "HG21") (segid " " and resid "26 " and name "HB2 ") 6.000 6.000 0.000 peak 2570 weight 0.10000E+01 volume -0.13000E+00 ppm1 1.059 ppm2 3.180 OR { 2570} (segid " " and resid "23 " and name "HG23") (segid " " and resid "54 " and name "HD1 ") OR { 2570} (segid " " and resid "23 " and name "HG21") (segid " " and resid "54 " and name "HD2 ") OR { 2570} (segid " " and resid "23 " and name "HG22") (segid " " and resid "54 " and name "HD2 ") OR { 2570} (segid " " and resid "23 " and name "HG22") (segid " " and resid "54 " and name "HD1 ") OR { 2570} (segid " " and resid "23 " and name "HG23") (segid " " and resid "54 " and name "HD2 ") OR { 2570} (segid " " and resid "23 " and name "HG21") (segid " " and resid "54 " and name "HD1 ") ASSI { 2567} (segid " " and resid "23 " and name "HG23") (segid " " and resid "54 " and name "HA ") 6.000 6.000 0.000 peak 2567 weight 0.10000E+01 volume -0.19500E+00 ppm1 1.059 ppm2 4.814 OR { 2567} (segid " " and resid "23 " and name "HG21") (segid " " and resid "54 " and name "HA ") OR { 2567} (segid " " and resid "23 " and name "HG22") (segid " " and resid "54 " and name "HA ") OR { 2567} (segid " " and resid "23 " and name "HG22") (segid " " and resid "22 " and name "HB ") OR { 2567} (segid " " and resid "23 " and name "HG21") (segid " " and resid "22 " and name "HB ") OR { 2567} (segid " " and resid "23 " and name "HG23") (segid " " and resid "22 " and name "HB ") ASSI { 2597} (segid " " and resid "24 " and name "HA ") (segid " " and resid "38 " and name "HB1 ") 6.000 6.000 0.000 peak 2597 weight 0.10000E+01 volume -0.25500E+00 ppm1 3.944 ppm2 2.258 OR { 2597} (segid " " and resid "24 " and name "HA ") (segid " " and resid "23 " and name "HB ") ASSI { 2600} (segid " " and resid "24 " and name "HA ") (segid " " and resid "23 " and name "HA ") 6.000 6.000 0.000 peak 2600 weight 0.10000E+01 volume -0.69000E-01 ppm1 3.944 ppm2 3.576 OR { 2600} (segid " " and resid "24 " and name "HA ") (segid " " and resid "26 " and name "HB1 ") ASSI { 2601} (segid " " and resid "24 " and name "HA ") (segid " " and resid "25 " and name "HA ") 6.000 6.000 0.000 peak 2601 weight 0.10000E+01 volume -0.64000E-01 ppm1 3.944 ppm2 4.551 OR { 2601} (segid " " and resid "24 " and name "HA ") (segid " " and resid "26 " and name "HA ") ASSI { 2607} (segid " " and resid "24 " and name "HB1 ") (segid " " and resid "52 " and name "HB1 ") 6.000 6.000 0.000 peak 2607 weight 0.10000E+01 volume -0.14000E+00 ppm1 2.087 ppm2 2.653 ASSI { 2606} (segid " " and resid "24 " and name "HB1 ") (segid " " and resid "22 " and name "HB ") 6.000 6.000 0.000 peak 2606 weight 0.10000E+01 volume -0.90000E-01 ppm1 2.087 ppm2 4.814 ASSI { 2608} (segid " " and resid "24 " and name "HB2 ") (segid " " and resid "22 " and name "HB ") 6.000 6.000 0.000 peak 2608 weight 0.10000E+01 volume -0.94000E-01 ppm1 2.034 ppm2 4.814 ASSI { 2610} (segid " " and resid "24 " and name "HG1 ") (segid " " and resid "24 " and name "HG2 ") 3.300 3.300 0.000 peak 2610 weight 0.10000E+01 volume -0.36360E+01 ppm1 2.522 ppm2 2.363 ASSI { 2623} (segid " " and resid "25 " and name "HB1 ") (segid " " and resid "21 " and name "HA ") 6.000 6.000 0.000 peak 2623 weight 0.10000E+01 volume -0.12200E+00 ppm1 3.088 ppm2 4.682 ASSI { 2626} (segid " " and resid "25 " and name "HB2 ") (segid " " and resid "21 " and name "HB1 ") 5.000 5.000 0.000 peak 2626 weight 0.10000E+01 volume -0.33900E+00 ppm1 2.930 ppm2 2.601 ASSI { 2633} (segid " " and resid "26 " and name "HA ") (segid " " and resid "29 " and name "HG2 ") 6.000 6.000 0.000 peak 2633 weight 0.10000E+01 volume -0.13300E+00 ppm1 4.551 ppm2 1.573 ASSI { 2630} (segid " " and resid "26 " and name "HA ") (segid " " and resid "29 " and name "HG1 ") 5.000 5.000 0.000 peak 2630 weight 0.10000E+01 volume -0.44100E+00 ppm1 4.551 ppm2 1.889 OR { 2630} (segid " " and resid "26 " and name "HA ") (segid " " and resid "29 " and name "HD1 ") ASSI { 2632} (segid " " and resid "26 " and name "HA ") (segid " " and resid "29 " and name "HB2 ") 5.000 5.000 0.000 peak 2632 weight 0.10000E+01 volume -0.37100E+00 ppm1 4.551 ppm2 2.205 ASSI { 2627} (segid " " and resid "26 " and name "HA ") (segid " " and resid "26 " and name "HD1 ") 5.000 5.000 0.000 peak 2627 weight 0.10000E+01 volume -0.90500E+00 ppm1 4.551 ppm2 7.080 OR { 2627} (segid " " and resid "26 " and name "HA ") (segid " " and resid "26 " and name "HD2 ") ASSI { 2637} (segid " " and resid "26 " and name "HB1 ") (segid " " and resid "56 " and name "HD23") 6.000 6.000 0.000 peak 2637 weight 0.10000E+01 volume -0.22300E+00 ppm1 3.562 ppm2 0.308 OR { 2637} (segid " " and resid "26 " and name "HB1 ") (segid " " and resid "56 " and name "HD22") OR { 2637} (segid " " and resid "26 " and name "HB1 ") (segid " " and resid "56 " and name "HD21") OR { 2637} (segid " " and resid "26 " and name "HB1 ") (segid " " and resid "30 " and name "HG12") ASSI { 2663} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "56 " and name "HD13") 5.000 5.000 0.000 peak 2663 weight 0.10000E+01 volume -0.35500E+00 ppm1 7.067 ppm2 0.396 OR { 2663} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "17 " and name "HG22") OR { 2663} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "56 " and name "HD12") OR { 2663} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "56 " and name "HD11") OR { 2663} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "56 " and name "HD12") OR { 2663} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "61 " and name "HD12") OR { 2663} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "56 " and name "HD11") OR { 2663} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "17 " and name "HG21") OR { 2663} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "17 " and name "HG21") OR { 2663} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "17 " and name "HG22") OR { 2663} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "61 " and name "HD12") ASSI { 2657} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "17 " and name "HG11") 5.000 5.000 0.000 peak 2657 weight 0.10000E+01 volume -0.78300E+00 ppm1 7.067 ppm2 0.651 OR { 2657} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "17 " and name "HG12") OR { 2657} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "17 " and name "HG13") OR { 2657} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "17 " and name "HG11") OR { 2657} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "17 " and name "HG12") ASSI { 2666} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "29 " and name "HD1 ") 6.000 6.000 0.000 peak 2666 weight 0.10000E+01 volume -0.15600E+00 ppm1 7.067 ppm2 1.863 OR { 2666} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "29 " and name "HB1 ") OR { 2666} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "29 " and name "HG1 ") OR { 2666} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "29 " and name "HD1 ") OR { 2666} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "29 " and name "HB1 ") ASSI { 2682} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "67 " and name "HG12") 6.000 6.000 0.000 peak 2682 weight 0.10000E+01 volume -0.15700E+00 ppm1 6.883 ppm2 1.204 OR { 2682} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "15 " and name "HG12") OR { 2682} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "67 " and name "HG12") ASSI { 2675} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "26 " and name "HA ") 6.000 6.000 0.000 peak 2675 weight 0.10000E+01 volume -0.97000E-01 ppm1 6.896 ppm2 4.551 OR { 2675} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "26 " and name "HA ") ASSI { 5219} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "5 " and name "HD12") 5.000 5.000 0.000 peak 5219 weight 0.10000E+01 volume -0.74300E+00 ppm1 6.891 ppm2 0.750 OR { 5219} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "43 " and name "HD12") OR { 5219} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "5 " and name "HD13") OR { 5219} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "43 " and name "HD13") OR { 5219} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "5 " and name "HD12") OR { 5219} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "5 " and name "HD13") OR { 5219} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "43 " and name "HD13") ASSI { 2681} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "15 " and name "HG11") 6.000 6.000 0.000 peak 2681 weight 0.10000E+01 volume -0.13500E+00 ppm1 6.883 ppm2 1.362 OR { 2681} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "30 " and name "HG11") OR { 2681} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "30 " and name "HG11") ASSI { 2678} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "67 " and name "HB ") 6.000 6.000 0.000 peak 2678 weight 0.10000E+01 volume -0.16000E+00 ppm1 6.883 ppm2 1.863 OR { 2678} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "29 " and name "HB1 ") OR { 2678} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "29 " and name "HD1 ") OR { 2678} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "67 " and name "HB ") OR { 2678} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "29 " and name "HD1 ") OR { 2678} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "29 " and name "HB1 ") ASSI { 5189} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "67 " and name "HD11") 5.000 5.000 0.000 peak 5189 weight 0.10000E+01 volume -0.10250E+01 ppm1 6.813 ppm2 0.655 OR { 5189} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "67 " and name "HD13") OR { 5189} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "67 " and name "HD12") OR { 5189} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "15 " and name "HD13") OR { 5189} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "15 " and name "HD11") OR { 5189} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "15 " and name "HD12") ASSI { 2287} (segid " " and resid "27 " and name "HA ") (segid " " and resid "30 " and name "HG12") 6.000 6.000 0.000 peak 2287 weight 0.10000E+01 volume -0.16400E+00 ppm1 4.379 ppm2 0.334 ASSI { 2290} (segid " " and resid "27 " and name "HA ") (segid " " and resid "38 " and name "HB1 ") 6.000 6.000 0.000 peak 2290 weight 0.10000E+01 volume -0.12100E+00 ppm1 4.379 ppm2 2.258 OR { 2290} (segid " " and resid "27 " and name "HA ") (segid " " and resid "29 " and name "HB2 ") ASSI { 2686} (segid " " and resid "27 " and name "HB1 ") (segid " " and resid "27 " and name "HD2 ") 5.000 5.000 0.000 peak 2686 weight 0.10000E+01 volume -0.15550E+01 ppm1 1.428 ppm2 1.626 OR { 2686} (segid " " and resid "27 " and name "HB1 ") (segid " " and resid "27 " and name "HD1 ") OR { 2686} (segid " " and resid "27 " and name "HB1 ") (segid " " and resid "27 " and name "HG1 ") OR { 2686} (segid " " and resid "27 " and name "HB1 ") (segid " " and resid "38 " and name "HG2 ") ASSI { 2673} (segid " " and resid "27 " and name "HB1 ") (segid " " and resid "27 " and name "HB2 ") 5.000 5.000 0.000 peak 2673 weight 0.10000E+01 volume -0.17660E+01 ppm1 1.428 ppm2 2.021 ASSI { 2688} (segid " " and resid "27 " and name "HB1 ") (segid " " and resid "38 " and name "HB1 ") 5.000 5.000 0.000 peak 2688 weight 0.10000E+01 volume -0.35700E+00 ppm1 1.428 ppm2 2.258 ASSI { 2718} (segid " " and resid "27 " and name "HE1 ") (segid " " and resid "38 " and name "HB2 ") 6.000 6.000 0.000 peak 2718 weight 0.10000E+01 volume -0.15500E+00 ppm1 2.746 ppm2 2.021 OR { 2718} (segid " " and resid "27 " and name "HE1 ") (segid " " and resid "27 " and name "HB2 ") ASSI { 2709} (segid " " and resid "27 " and name "HE1 ") (segid " " and resid "27 " and name "HE2 ") 2.700 2.700 0.000 peak 2709 weight 0.10000E+01 volume -0.40300E+01 ppm1 2.759 ppm2 2.601 ASSI { 2717} (segid " " and resid "27 " and name "HE1 ") (segid " " and resid "38 " and name "HA ") 6.000 6.000 0.000 peak 2717 weight 0.10000E+01 volume -0.72000E-01 ppm1 2.759 ppm2 4.076 OR { 2717} (segid " " and resid "27 " and name "HE1 ") (segid " " and resid "41 " and name "HA ") ASSI { 2719} (segid " " and resid "27 " and name "HE1 ") (segid " " and resid "27 " and name "HA ") 6.000 6.000 0.000 peak 2719 weight 0.10000E+01 volume -0.10800E+00 ppm1 2.759 ppm2 4.392 OR { 2719} (segid " " and resid "27 " and name "HE1 ") (segid " " and resid "42 " and name "HA ") OR { 2719} (segid " " and resid "27 " and name "HE1 ") (segid " " and resid "52 " and name "HA ") ASSI { 2723} (segid " " and resid "27 " and name "HE2 ") (segid " " and resid "52 " and name "HA ") 6.000 6.000 0.000 peak 2723 weight 0.10000E+01 volume -0.11000E+00 ppm1 2.614 ppm2 4.392 OR { 2723} (segid " " and resid "27 " and name "HE2 ") (segid " " and resid "27 " and name "HA ") OR { 2723} (segid " " and resid "27 " and name "HE2 ") (segid " " and resid "42 " and name "HA ") OR { 2723} (segid " " and resid "27 " and name "HE2 ") (segid " " and resid "39 " and name "HA ") ASSI { 2724} (segid " " and resid "27 " and name "HE2 ") (segid " " and resid "41 " and name "HB1 ") 6.000 6.000 0.000 peak 2724 weight 0.10000E+01 volume -0.11800E+00 ppm1 2.614 ppm2 1.784 ASSI { 2693} (segid " " and resid "27 " and name "HG1 ") (segid " " and resid "27 " and name "HB2 ") 5.000 5.000 0.000 peak 2693 weight 0.10000E+01 volume -0.76800E+00 ppm1 1.626 ppm2 2.021 ASSI { 2694} (segid " " and resid "27 " and name "HG1 ") (segid " " and resid "43 " and name "HD12") 5.000 5.000 0.000 peak 2694 weight 0.10000E+01 volume -0.82300E+00 ppm1 1.612 ppm2 0.809 OR { 2694} (segid " " and resid "27 " and name "HG1 ") (segid " " and resid "43 " and name "HD11") OR { 2694} (segid " " and resid "27 " and name "HG1 ") (segid " " and resid "23 " and name "HG12") OR { 2694} (segid " " and resid "27 " and name "HG1 ") (segid " " and resid "23 " and name "HG13") ASSI { 2734} (segid " " and resid "28 " and name "HA ") (segid " " and resid "31 " and name "HG1 ") 6.000 6.000 0.000 peak 2734 weight 0.10000E+01 volume -0.24300E+00 ppm1 4.168 ppm2 2.258 OR { 2734} (segid " " and resid "28 " and name "HA ") (segid " " and resid "38 " and name "HB1 ") ASSI { 2736} (segid " " and resid "28 " and name "HB1 ") (segid " " and resid "29 " and name "HG1 ") 5.000 5.000 0.000 peak 2736 weight 0.10000E+01 volume -0.46400E+00 ppm1 1.639 ppm2 1.863 OR { 2736} (segid " " and resid "28 " and name "HB2 ") (segid " " and resid "29 " and name "HG1 ") OR { 2736} (segid " " and resid "28 " and name "HB3 ") (segid " " and resid "29 " and name "HG1 ") OR { 2736} (segid " " and resid "28 " and name "HB3 ") (segid " " and resid "31 " and name "HB2 ") OR { 2736} (segid " " and resid "28 " and name "HB1 ") (segid " " and resid "31 " and name "HB2 ") OR { 2736} (segid " " and resid "28 " and name "HB3 ") (segid " " and resid "29 " and name "HD1 ") OR { 2736} (segid " " and resid "28 " and name "HB2 ") (segid " " and resid "31 " and name "HB2 ") OR { 2736} (segid " " and resid "28 " and name "HB1 ") (segid " " and resid "29 " and name "HD1 ") ASSI { 2737} (segid " " and resid "28 " and name "HB3 ") (segid " " and resid "27 " and name "HB2 ") 6.000 6.000 0.000 peak 2737 weight 0.10000E+01 volume -0.25400E+00 ppm1 1.639 ppm2 2.021 OR { 2737} (segid " " and resid "28 " and name "HB1 ") (segid " " and resid "27 " and name "HB2 ") OR { 2737} (segid " " and resid "28 " and name "HB2 ") (segid " " and resid "27 " and name "HB2 ") OR { 2737} (segid " " and resid "28 " and name "HB3 ") (segid " " and resid "24 " and name "HB2 ") OR { 2737} (segid " " and resid "28 " and name "HB2 ") (segid " " and resid "24 " and name "HB2 ") OR { 2737} (segid " " and resid "28 " and name "HB2 ") (segid " " and resid "38 " and name "HB2 ") ASSI { 2739} (segid " " and resid "28 " and name "HB3 ") (segid " " and resid "38 " and name "HG1 ") 6.000 6.000 0.000 peak 2739 weight 0.10000E+01 volume -0.23700E+00 ppm1 1.639 ppm2 2.205 OR { 2739} (segid " " and resid "28 " and name "HB1 ") (segid " " and resid "38 " and name "HG1 ") OR { 2739} (segid " " and resid "28 " and name "HB2 ") (segid " " and resid "38 " and name "HG1 ") OR { 2739} (segid " " and resid "28 " and name "HB2 ") (segid " " and resid "29 " and name "HB2 ") OR { 2739} (segid " " and resid "28 " and name "HB3 ") (segid " " and resid "29 " and name "HB2 ") OR { 2739} (segid " " and resid "28 " and name "HB1 ") (segid " " and resid "29 " and name "HB2 ") ASSI { 2741} (segid " " and resid "28 " and name "HB3 ") (segid " " and resid "25 " and name "HB2 ") 6.000 6.000 0.000 peak 2741 weight 0.10000E+01 volume -0.12400E+00 ppm1 1.626 ppm2 2.943 OR { 2741} (segid " " and resid "28 " and name "HB2 ") (segid " " and resid "25 " and name "HB2 ") OR { 2741} (segid " " and resid "28 " and name "HB1 ") (segid " " and resid "25 " and name "HB2 ") ASSI { 2738} (segid " " and resid "28 " and name "HB3 ") (segid " " and resid "25 " and name "HB1 ") 6.000 6.000 0.000 peak 2738 weight 0.10000E+01 volume -0.13200E+00 ppm1 1.639 ppm2 3.075 OR { 2738} (segid " " and resid "28 " and name "HB2 ") (segid " " and resid "25 " and name "HB1 ") OR { 2738} (segid " " and resid "28 " and name "HB1 ") (segid " " and resid "25 " and name "HB1 ") OR { 2738} (segid " " and resid "28 " and name "HB3 ") (segid " " and resid "29 " and name "HE2 ") OR { 2738} (segid " " and resid "28 " and name "HB2 ") (segid " " and resid "29 " and name "HE2 ") OR { 2738} (segid " " and resid "28 " and name "HB1 ") (segid " " and resid "29 " and name "HE2 ") ASSI { 2744} (segid " " and resid "28 " and name "HB3 ") (segid " " and resid "38 " and name "HD1 ") 6.000 6.000 0.000 peak 2744 weight 0.10000E+01 volume -0.98000E-01 ppm1 1.626 ppm2 3.734 OR { 2744} (segid " " and resid "28 " and name "HB1 ") (segid " " and resid "38 " and name "HD1 ") OR { 2744} (segid " " and resid "28 " and name "HB2 ") (segid " " and resid "38 " and name "HD1 ") OR { 2744} (segid " " and resid "28 " and name "HB3 ") (segid " " and resid "38 " and name "HD2 ") OR { 2744} (segid " " and resid "28 " and name "HB2 ") (segid " " and resid "38 " and name "HD2 ") ASSI { 2745} (segid " " and resid "29 " and name "HA ") (segid " " and resid "29 " and name "HG1 ") 5.000 5.000 0.000 peak 2745 weight 0.10000E+01 volume 0.10000E+01 ppm1 4.182 ppm2 1.889 OR { 2745} (segid " " and resid "29 " and name "HA ") (segid " " and resid "29 " and name "HB1 ") OR { 2745} (segid " " and resid "29 " and name "HA ") (segid " " and resid "29 " and name "HD1 ") ASSI { 2755} (segid " " and resid "29 " and name "HB1 ") (segid " " and resid "29 " and name "HG2 ") 5.000 5.000 0.000 peak 2755 weight 0.10000E+01 volume -0.90000E+00 ppm1 1.889 ppm2 1.573 ASSI { 2759} (segid " " and resid "29 " and name "HB1 ") (segid " " and resid "15 " and name "HD12") 6.000 6.000 0.000 peak 2759 weight 0.10000E+01 volume -0.17500E+00 ppm1 1.889 ppm2 0.651 OR { 2759} (segid " " and resid "29 " and name "HB1 ") (segid " " and resid "15 " and name "HD11") OR { 2759} (segid " " and resid "29 " and name "HB1 ") (segid " " and resid "15 " and name "HD13") OR { 2759} (segid " " and resid "29 " and name "HB1 ") (segid " " and resid "17 " and name "HG11") ASSI { 2760} (segid " " and resid "29 " and name "HB1 ") (segid " " and resid "29 " and name "HE2 ") 6.000 6.000 0.000 peak 2760 weight 0.10000E+01 volume -0.93000E-01 ppm1 1.876 ppm2 3.075 OR { 2760} (segid " " and resid "29 " and name "HB1 ") (segid " " and resid "33 " and name "HE2 ") ASSI { 2706} (segid " " and resid "29 " and name "HB2 ") (segid " " and resid "29 " and name "HB1 ") 2.700 2.700 0.000 peak 2706 weight 0.10000E+01 volume -0.51590E+01 ppm1 2.205 ppm2 1.889 OR { 2706} (segid " " and resid "29 " and name "HB2 ") (segid " " and resid "29 " and name "HD1 ") OR { 2706} (segid " " and resid "29 " and name "HB2 ") (segid " " and resid "29 " and name "HG1 ") ASSI { 2752} (segid " " and resid "29 " and name "HB2 ") (segid " " and resid "15 " and name "HD11") 6.000 6.000 0.000 peak 2752 weight 0.10000E+01 volume -0.14700E+00 ppm1 2.219 ppm2 0.651 OR { 2752} (segid " " and resid "29 " and name "HB2 ") (segid " " and resid "15 " and name "HD12") OR { 2752} (segid " " and resid "29 " and name "HB2 ") (segid " " and resid "15 " and name "HD13") OR { 2752} (segid " " and resid "29 " and name "HB2 ") (segid " " and resid "17 " and name "HG13") OR { 2752} (segid " " and resid "29 " and name "HB2 ") (segid " " and resid "17 " and name "HG11") ASSI { 2763} (segid " " and resid "29 " and name "HG1 ") (segid " " and resid "29 " and name "HD2 ") 5.000 5.000 0.000 peak 2763 weight 0.10000E+01 volume -0.98700E+00 ppm1 1.836 ppm2 1.678 ASSI { 2761} (segid " " and resid "29 " and name "HG1 ") (segid " " and resid "29 " and name "HG2 ") 3.300 3.300 0.000 peak 2761 weight 0.10000E+01 volume -0.22190E+01 ppm1 1.850 ppm2 1.573 ASSI { 2764} (segid " " and resid "29 " and name "HG1 ") (segid " " and resid "29 " and name "HB2 ") 5.000 5.000 0.000 peak 2764 weight 0.10000E+01 volume -0.77200E+00 ppm1 1.850 ppm2 2.205 ASSI { 2794} (segid " " and resid "30 " and name "HA ") (segid " " and resid "33 " and name "HD1 ") 6.000 6.000 0.000 peak 2794 weight 0.10000E+01 volume -0.13600E+00 ppm1 3.325 ppm2 1.705 OR { 2794} (segid " " and resid "30 " and name "HA ") (segid " " and resid "33 " and name "HD2 ") ASSI { 2796} (segid " " and resid "30 " and name "HA ") (segid " " and resid "29 " and name "HB2 ") 6.000 6.000 0.000 peak 2796 weight 0.10000E+01 volume -0.87000E-01 ppm1 3.325 ppm2 2.232 OR { 2796} (segid " " and resid "30 " and name "HA ") (segid " " and resid "34 " and name "HB1 ") ASSI { 2792} (segid " " and resid "30 " and name "HA ") (segid " " and resid "5 " and name "HD11") 6.000 6.000 0.000 peak 2792 weight 0.10000E+01 volume -0.20600E+00 ppm1 3.325 ppm2 0.782 OR { 2792} (segid " " and resid "30 " and name "HA ") (segid " " and resid "5 " and name "HD12") OR { 2792} (segid " " and resid "30 " and name "HA ") (segid " " and resid "5 " and name "HD13") OR { 2792} (segid " " and resid "30 " and name "HA ") (segid " " and resid "69 " and name "HD22") OR { 2792} (segid " " and resid "30 " and name "HA ") (segid " " and resid "69 " and name "HD23") OR { 2792} (segid " " and resid "30 " and name "HA ") (segid " " and resid "69 " and name "HD21") OR { 2792} (segid " " and resid "30 " and name "HA ") (segid " " and resid "36 " and name "HD13") OR { 2792} (segid " " and resid "30 " and name "HA ") (segid " " and resid "36 " and name "HD12") OR { 2792} (segid " " and resid "30 " and name "HA ") (segid " " and resid "43 " and name "HD21") OR { 2792} (segid " " and resid "30 " and name "HA ") (segid " " and resid "43 " and name "HD22") OR { 2792} (segid " " and resid "30 " and name "HA ") (segid " " and resid "36 " and name "HD11") ASSI { 2824} (segid " " and resid "30 " and name "HD12") (segid " " and resid "5 " and name "HD13") 2.700 2.700 0.000 peak 2824 weight 0.10000E+01 volume -0.47680E+01 ppm1 0.045 ppm2 0.756 OR { 2824} (segid " " and resid "30 " and name "HD11") (segid " " and resid "43 " and name "HD12") OR { 2824} (segid " " and resid "30 " and name "HD12") (segid " " and resid "5 " and name "HD11") OR { 2824} (segid " " and resid "30 " and name "HD11") (segid " " and resid "43 " and name "HD21") OR { 2824} (segid " " and resid "30 " and name "HD12") (segid " " and resid "43 " and name "HD23") OR { 2824} (segid " " and resid "30 " and name "HD11") (segid " " and resid "43 " and name "HD11") OR { 2824} (segid " " and resid "30 " and name "HD13") (segid " " and resid "43 " and name "HD21") OR { 2824} (segid " " and resid "30 " and name "HD12") (segid " " and resid "43 " and name "HD11") OR { 2824} (segid " " and resid "30 " and name "HD11") (segid " " and resid "43 " and name "HD22") OR { 2824} (segid " " and resid "30 " and name "HD12") (segid " " and resid "43 " and name "HD22") OR { 2824} (segid " " and resid "30 " and name "HD12") (segid " " and resid "43 " and name "HD13") OR { 2824} (segid " " and resid "30 " and name "HD12") (segid " " and resid "43 " and name "HD21") OR { 2824} (segid " " and resid "30 " and name "HD13") (segid " " and resid "43 " and name "HD22") OR { 2824} (segid " " and resid "30 " and name "HD12") (segid " " and resid "43 " and name "HD12") OR { 2824} (segid " " and resid "30 " and name "HD11") (segid " " and resid "43 " and name "HD13") OR { 2824} (segid " " and resid "30 " and name "HD11") (segid " " and resid "43 " and name "HD23") OR { 2824} (segid " " and resid "30 " and name "HD13") (segid " " and resid "43 " and name "HD12") ASSI { 2844} (segid " " and resid "30 " and name "HD11") (segid " " and resid "67 " and name "HG22") 5.000 5.000 0.000 peak 2844 weight 0.10000E+01 volume -0.37500E+00 ppm1 0.045 ppm2 0.967 OR { 2844} (segid " " and resid "30 " and name "HD13") (segid " " and resid "67 " and name "HG21") OR { 2844} (segid " " and resid "30 " and name "HD12") (segid " " and resid "67 " and name "HG21") OR { 2844} (segid " " and resid "30 " and name "HD12") (segid " " and resid "67 " and name "HG22") OR { 2844} (segid " " and resid "30 " and name "HD11") (segid " " and resid "67 " and name "HG21") OR { 2844} (segid " " and resid "30 " and name "HD11") (segid " " and resid "67 " and name "HG23") OR { 2844} (segid " " and resid "30 " and name "HD12") (segid " " and resid "67 " and name "HG23") OR { 2844} (segid " " and resid "30 " and name "HD13") (segid " " and resid "67 " and name "HG22") OR { 2844} (segid " " and resid "30 " and name "HD13") (segid " " and resid "67 " and name "HG23") OR { 2844} (segid " " and resid "30 " and name "HD12") (segid " " and resid "15 " and name "HG22") OR { 2844} (segid " " and resid "30 " and name "HD12") (segid " " and resid "15 " and name "HG23") OR { 2844} (segid " " and resid "30 " and name "HD11") (segid " " and resid "15 " and name "HG21") OR { 2844} (segid " " and resid "30 " and name "HD13") (segid " " and resid "15 " and name "HG23") OR { 2844} (segid " " and resid "30 " and name "HD13") (segid " " and resid "15 " and name "HG22") OR { 2844} (segid " " and resid "30 " and name "HD11") (segid " " and resid "15 " and name "HG22") OR { 2844} (segid " " and resid "30 " and name "HD13") (segid " " and resid "13 " and name "HG12") ASSI { 2846} (segid " " and resid "30 " and name "HD11") (segid " " and resid "27 " and name "HG1 ") 5.000 5.000 0.000 peak 2846 weight 0.10000E+01 volume -0.36100E+00 ppm1 0.045 ppm2 1.599 OR { 2846} (segid " " and resid "30 " and name "HD13") (segid " " and resid "27 " and name "HG1 ") OR { 2846} (segid " " and resid "30 " and name "HD11") (segid " " and resid "27 " and name "HD1 ") OR { 2846} (segid " " and resid "30 " and name "HD13") (segid " " and resid "27 " and name "HD1 ") OR { 2846} (segid " " and resid "30 " and name "HD13") (segid " " and resid "27 " and name "HD2 ") OR { 2846} (segid " " and resid "30 " and name "HD12") (segid " " and resid "27 " and name "HG1 ") OR { 2846} (segid " " and resid "30 " and name "HD12") (segid " " and resid "27 " and name "HD2 ") OR { 2846} (segid " " and resid "30 " and name "HD11") (segid " " and resid "27 " and name "HD2 ") OR { 2846} (segid " " and resid "30 " and name "HD13") (segid " " and resid "41 " and name "HG2 ") ASSI { 2848} (segid " " and resid "30 " and name "HD12") (segid " " and resid "67 " and name "HB ") 5.000 5.000 0.000 peak 2848 weight 0.10000E+01 volume -0.30300E+00 ppm1 0.045 ppm2 1.863 OR { 2848} (segid " " and resid "30 " and name "HD11") (segid " " and resid "69 " and name "HB1 ") OR { 2848} (segid " " and resid "30 " and name "HD12") (segid " " and resid "5 " and name "HB1 ") OR { 2848} (segid " " and resid "30 " and name "HD12") (segid " " and resid "69 " and name "HB1 ") OR { 2848} (segid " " and resid "30 " and name "HD13") (segid " " and resid "5 " and name "HB1 ") OR { 2848} (segid " " and resid "30 " and name "HD11") (segid " " and resid "67 " and name "HB ") OR { 2848} (segid " " and resid "30 " and name "HD13") (segid " " and resid "69 " and name "HB1 ") OR { 2848} (segid " " and resid "30 " and name "HD13") (segid " " and resid "67 " and name "HB ") OR { 2848} (segid " " and resid "30 " and name "HD11") (segid " " and resid "5 " and name "HB1 ") OR { 2848} (segid " " and resid "30 " and name "HD11") (segid " " and resid "29 " and name "HB1 ") OR { 2848} (segid " " and resid "30 " and name "HD13") (segid " " and resid "29 " and name "HB1 ") OR { 2848} (segid " " and resid "30 " and name "HD13") (segid " " and resid "29 " and name "HD1 ") OR { 2848} (segid " " and resid "30 " and name "HD12") (segid " " and resid "29 " and name "HB1 ") OR { 2848} (segid " " and resid "30 " and name "HD11") (segid " " and resid "29 " and name "HD1 ") OR { 2848} (segid " " and resid "30 " and name "HD13") (segid " " and resid "33 " and name "HB2 ") OR { 2848} (segid " " and resid "30 " and name "HD13") (segid " " and resid "31 " and name "HB2 ") OR { 2848} (segid " " and resid "30 " and name "HD12") (segid " " and resid "29 " and name "HD1 ") ASSI { 2853} (segid " " and resid "30 " and name "HD13") (segid " " and resid "29 " and name "HB2 ") 6.000 6.000 0.000 peak 2853 weight 0.10000E+01 volume -0.91000E-01 ppm1 0.045 ppm2 2.232 OR { 2853} (segid " " and resid "30 " and name "HD11") (segid " " and resid "29 " and name "HB2 ") OR { 2853} (segid " " and resid "30 " and name "HD12") (segid " " and resid "29 " and name "HB2 ") OR { 2853} (segid " " and resid "30 " and name "HD11") (segid " " and resid "38 " and name "HG1 ") OR { 2853} (segid " " and resid "30 " and name "HD11") (segid " " and resid "38 " and name "HB1 ") OR { 2853} (segid " " and resid "30 " and name "HD13") (segid " " and resid "38 " and name "HB1 ") OR { 2853} (segid " " and resid "30 " and name "HD13") (segid " " and resid "38 " and name "HG1 ") OR { 2853} (segid " " and resid "30 " and name "HD12") (segid " " and resid "38 " and name "HB1 ") ASSI { 2810} (segid " " and resid "30 " and name "HG11") (segid " " and resid "5 " and name "HD11") 6.000 6.000 0.000 peak 2810 weight 0.10000E+01 volume -0.24500E+00 ppm1 1.323 ppm2 0.756 OR { 2810} (segid " " and resid "30 " and name "HG11") (segid " " and resid "5 " and name "HD12") OR { 2810} (segid " " and resid "30 " and name "HG11") (segid " " and resid "5 " and name "HD13") OR { 2810} (segid " " and resid "30 " and name "HG11") (segid " " and resid "43 " and name "HD12") OR { 2810} (segid " " and resid "30 " and name "HG11") (segid " " and resid "43 " and name "HD21") OR { 2810} (segid " " and resid "30 " and name "HG11") (segid " " and resid "43 " and name "HD11") OR { 2810} (segid " " and resid "30 " and name "HG11") (segid " " and resid "43 " and name "HD13") OR { 2810} (segid " " and resid "30 " and name "HG11") (segid " " and resid "43 " and name "HD23") ASSI { 2809} (segid " " and resid "30 " and name "HG11") (segid " " and resid "15 " and name "HG21") 6.000 6.000 0.000 peak 2809 weight 0.10000E+01 volume -0.91000E-01 ppm1 1.309 ppm2 0.941 OR { 2809} (segid " " and resid "30 " and name "HG11") (segid " " and resid "15 " and name "HG22") OR { 2809} (segid " " and resid "30 " and name "HG11") (segid " " and resid "15 " and name "HG23") OR { 2809} (segid " " and resid "30 " and name "HG11") (segid " " and resid "13 " and name "HG13") ASSI { 5322} (segid " " and resid "30 " and name "HG12") (segid " " and resid "5 " and name "HD23") 5.000 5.000 0.000 peak 5322 weight 0.10000E+01 volume -0.57400E+00 ppm1 0.329 ppm2 0.652 OR { 5322} (segid " " and resid "30 " and name "HG12") (segid " " and resid "5 " and name "HD22") OR { 5322} (segid " " and resid "30 " and name "HG12") (segid " " and resid "5 " and name "HD21") OR { 5322} (segid " " and resid "30 " and name "HG12") (segid " " and resid "15 " and name "HD12") ASSI { 2818} (segid " " and resid "30 " and name "HG12") (segid " " and resid "5 " and name "HD11") 5.000 5.000 0.000 peak 2818 weight 0.10000E+01 volume -0.34100E+00 ppm1 0.334 ppm2 0.756 OR { 2818} (segid " " and resid "30 " and name "HG12") (segid " " and resid "5 " and name "HD13") OR { 2818} (segid " " and resid "30 " and name "HG12") (segid " " and resid "5 " and name "HD12") OR { 2818} (segid " " and resid "30 " and name "HG12") (segid " " and resid "69 " and name "HD22") OR { 2818} (segid " " and resid "30 " and name "HG12") (segid " " and resid "43 " and name "HD22") OR { 2818} (segid " " and resid "30 " and name "HG12") (segid " " and resid "43 " and name "HD11") ASSI { 2820} (segid " " and resid "30 " and name "HG23") (segid " " and resid "69 " and name "HD13") 3.300 3.300 0.000 peak 2820 weight 0.10000E+01 volume -0.20790E+01 ppm1 0.532 ppm2 0.809 OR { 2820} (segid " " and resid "30 " and name "HG23") (segid " " and resid "69 " and name "HD12") OR { 2820} (segid " " and resid "30 " and name "HG22") (segid " " and resid "69 " and name "HD22") OR { 2820} (segid " " and resid "30 " and name "HG21") (segid " " and resid "69 " and name "HD13") OR { 2820} (segid " " and resid "30 " and name "HG23") (segid " " and resid "69 " and name "HD22") OR { 2820} (segid " " and resid "30 " and name "HG21") (segid " " and resid "69 " and name "HD22") OR { 2820} (segid " " and resid "30 " and name "HG21") (segid " " and resid "69 " and name "HD23") OR { 2820} (segid " " and resid "30 " and name "HG21") (segid " " and resid "69 " and name "HD21") OR { 2820} (segid " " and resid "30 " and name "HG21") (segid " " and resid "69 " and name "HD11") OR { 2820} (segid " " and resid "30 " and name "HG23") (segid " " and resid "69 " and name "HD11") OR { 2820} (segid " " and resid "30 " and name "HG22") (segid " " and resid "69 " and name "HD12") OR { 2820} (segid " " and resid "30 " and name "HG23") (segid " " and resid "69 " and name "HD23") ASSI { 2823} (segid " " and resid "30 " and name "HG23") (segid " " and resid "69 " and name "HD13") 5.000 5.000 0.000 peak 2823 weight 0.10000E+01 volume -0.10470E+01 ppm1 0.532 ppm2 0.888 OR { 2823} (segid " " and resid "30 " and name "HG23") (segid " " and resid "69 " and name "HD12") OR { 2823} (segid " " and resid "30 " and name "HG21") (segid " " and resid "69 " and name "HD13") OR { 2823} (segid " " and resid "30 " and name "HG22") (segid " " and resid "69 " and name "HD13") OR { 2823} (segid " " and resid "30 " and name "HG21") (segid " " and resid "69 " and name "HD11") OR { 2823} (segid " " and resid "30 " and name "HG23") (segid " " and resid "69 " and name "HD11") OR { 2823} (segid " " and resid "30 " and name "HG22") (segid " " and resid "69 " and name "HD12") ASSI { 2831} (segid " " and resid "30 " and name "HG21") (segid " " and resid "33 " and name "HB2 ") 5.000 5.000 0.000 peak 2831 weight 0.10000E+01 volume -0.37700E+00 ppm1 0.532 ppm2 1.863 OR { 2831} (segid " " and resid "30 " and name "HG23") (segid " " and resid "33 " and name "HB2 ") OR { 2831} (segid " " and resid "30 " and name "HG22") (segid " " and resid "33 " and name "HB2 ") OR { 2831} (segid " " and resid "30 " and name "HG22") (segid " " and resid "69 " and name "HB1 ") OR { 2831} (segid " " and resid "30 " and name "HG23") (segid " " and resid "5 " and name "HB1 ") OR { 2831} (segid " " and resid "30 " and name "HG22") (segid " " and resid "31 " and name "HB2 ") OR { 2831} (segid " " and resid "30 " and name "HG23") (segid " " and resid "31 " and name "HB2 ") ASSI { 2829} (segid " " and resid "30 " and name "HG23") (segid " " and resid "34 " and name "HB1 ") 5.000 5.000 0.000 peak 2829 weight 0.10000E+01 volume -0.39300E+00 ppm1 0.519 ppm2 2.284 OR { 2829} (segid " " and resid "30 " and name "HG21") (segid " " and resid "34 " and name "HB1 ") OR { 2829} (segid " " and resid "30 " and name "HG22") (segid " " and resid "34 " and name "HB1 ") OR { 2829} (segid " " and resid "30 " and name "HG22") (segid " " and resid "31 " and name "HG1 ") ASSI { 2836} (segid " " and resid "30 " and name "HG23") (segid " " and resid "41 " and name "HG1 ") 6.000 6.000 0.000 peak 2836 weight 0.10000E+01 volume -0.11600E+00 ppm1 0.532 ppm2 2.495 OR { 2836} (segid " " and resid "30 " and name "HG22") (segid " " and resid "41 " and name "HG1 ") OR { 2836} (segid " " and resid "30 " and name "HG21") (segid " " and resid "41 " and name "HG1 ") ASSI { 2834} (segid " " and resid "30 " and name "HG23") (segid " " and resid "34 " and name "HA ") 6.000 6.000 0.000 peak 2834 weight 0.10000E+01 volume -0.96000E-01 ppm1 0.532 ppm2 4.498 OR { 2834} (segid " " and resid "30 " and name "HG22") (segid " " and resid "34 " and name "HA ") OR { 2834} (segid " " and resid "30 " and name "HG21") (segid " " and resid "34 " and name "HA ") OR { 2834} (segid " " and resid "30 " and name "HG23") (segid " " and resid "36 " and name "HA ") OR { 2834} (segid " " and resid "30 " and name "HG22") (segid " " and resid "36 " and name "HA ") ASSI { 2856} (segid " " and resid "31 " and name "HA ") (segid " " and resid "30 " and name "HG22") 6.000 6.000 0.000 peak 2856 weight 0.10000E+01 volume 0.72000E-01 ppm1 3.786 ppm2 0.519 OR { 2856} (segid " " and resid "31 " and name "HA ") (segid " " and resid "30 " and name "HG23") OR { 2856} (segid " " and resid "31 " and name "HA ") (segid " " and resid "30 " and name "HG21") ASSI { 2860} (segid " " and resid "31 " and name "HA ") (segid " " and resid "36 " and name "HB ") 6.000 6.000 0.000 peak 2860 weight 0.10000E+01 volume 0.34000E-01 ppm1 3.786 ppm2 1.494 ASSI { 2859} (segid " " and resid "31 " and name "HA ") (segid " " and resid "34 " and name "HB2 ") 6.000 6.000 0.000 peak 2859 weight 0.10000E+01 volume 0.44000E-01 ppm1 3.786 ppm2 1.626 OR { 2859} (segid " " and resid "31 " and name "HA ") (segid " " and resid "38 " and name "HG2 ") ASSI { 2857} (segid " " and resid "31 " and name "HA ") (segid " " and resid "35 " and name "HA1 ") 6.000 6.000 0.000 peak 2857 weight 0.10000E+01 volume 0.82000E-01 ppm1 3.786 ppm2 4.155 ASSI { 2865} (segid " " and resid "31 " and name "HB2 ") (segid " " and resid "31 " and name "HG1 ") 5.000 5.000 0.000 peak 2865 weight 0.10000E+01 volume -0.90000E+00 ppm1 1.889 ppm2 2.258 ASSI { 2847} (segid " " and resid "31 " and name "HG1 ") (segid " " and resid "31 " and name "HG2 ") 3.300 3.300 0.000 peak 2847 weight 0.10000E+01 volume -0.35040E+01 ppm1 2.258 ppm2 1.889 OR { 2847} (segid " " and resid "31 " and name "HG1 ") (segid " " and resid "31 " and name "HB2 ") ASSI { 2870} (segid " " and resid "31 " and name "HG1 ") (segid " " and resid "31 " and name "HA ") 5.000 5.000 0.000 peak 2870 weight 0.10000E+01 volume -0.48500E+00 ppm1 2.271 ppm2 3.786 ASSI { 2872} (segid " " and resid "31 " and name "HG1 ") (segid " " and resid "32 " and name "HA ") 6.000 6.000 0.000 peak 2872 weight 0.10000E+01 volume -0.11500E+00 ppm1 2.258 ppm2 4.313 ASSI { 2892} (segid " " and resid "31 " and name "HG2 ") (segid " " and resid "31 " and name "HG1 ") 3.300 3.300 0.000 peak 2892 weight 0.10000E+01 volume -0.28490E+01 ppm1 1.902 ppm2 2.258 ASSI { 2901} (segid " " and resid "31 " and name "HG2 ") (segid " " and resid "37 " and name "HA ") 6.000 6.000 0.000 peak 2901 weight 0.10000E+01 volume -0.22000E+00 ppm1 1.902 ppm2 4.603 ASSI { 2885} (segid " " and resid "32 " and name "HB1 ") (segid " " and resid "33 " and name "HG1 ") 6.000 6.000 0.000 peak 2885 weight 0.10000E+01 volume -0.13000E+00 ppm1 2.825 ppm2 1.599 OR { 2885} (segid " " and resid "32 " and name "HB1 ") (segid " " and resid "33 " and name "HG2 ") OR { 2885} (segid " " and resid "32 " and name "HB1 ") (segid " " and resid "29 " and name "HG2 ") OR { 2885} (segid " " and resid "32 " and name "HB1 ") (segid " " and resid "28 " and name "HB1 ") ASSI { 2884} (segid " " and resid "32 " and name "HB1 ") (segid " " and resid "31 " and name "HG2 ") 6.000 6.000 0.000 peak 2884 weight 0.10000E+01 volume -0.14700E+00 ppm1 2.825 ppm2 1.863 OR { 2884} (segid " " and resid "32 " and name "HB1 ") (segid " " and resid "29 " and name "HB1 ") OR { 2884} (segid " " and resid "32 " and name "HB1 ") (segid " " and resid "33 " and name "HB2 ") OR { 2884} (segid " " and resid "32 " and name "HB1 ") (segid " " and resid "29 " and name "HG1 ") OR { 2884} (segid " " and resid "32 " and name "HB1 ") (segid " " and resid "29 " and name "HD1 ") ASSI { 2871} (segid " " and resid "32 " and name "HB1 ") (segid " " and resid "32 " and name "HB2 ") 2.700 2.700 0.000 peak 2871 weight 0.10000E+01 volume -0.71550E+01 ppm1 2.838 ppm2 2.732 ASSI { 2889} (segid " " and resid "32 " and name "HB2 ") (segid " " and resid "33 " and name "HG1 ") 6.000 6.000 0.000 peak 2889 weight 0.10000E+01 volume -0.10700E+00 ppm1 2.759 ppm2 1.599 OR { 2889} (segid " " and resid "32 " and name "HB2 ") (segid " " and resid "33 " and name "HG2 ") OR { 2889} (segid " " and resid "32 " and name "HB2 ") (segid " " and resid "28 " and name "HB1 ") ASSI { 2899} (segid " " and resid "33 " and name "HB1 ") (segid " " and resid "15 " and name "HD12") 6.000 6.000 0.000 peak 2899 weight 0.10000E+01 volume -0.26400E+00 ppm1 1.942 ppm2 0.651 OR { 2899} (segid " " and resid "33 " and name "HB1 ") (segid " " and resid "15 " and name "HD13") OR { 2899} (segid " " and resid "33 " and name "HB1 ") (segid " " and resid "15 " and name "HD11") OR { 2899} (segid " " and resid "33 " and name "HB1 ") (segid " " and resid "5 " and name "HD21") ASSI { 2903} (segid " " and resid "33 " and name "HB1 ") (segid " " and resid "13 " and name "HG11") 6.000 6.000 0.000 peak 2903 weight 0.10000E+01 volume -0.10900E+00 ppm1 1.942 ppm2 0.941 OR { 2903} (segid " " and resid "33 " and name "HB1 ") (segid " " and resid "13 " and name "HG13") OR { 2903} (segid " " and resid "33 " and name "HB1 ") (segid " " and resid "13 " and name "HG12") ASSI { 2877} (segid " " and resid "33 " and name "HB1 ") (segid " " and resid "33 " and name "HB2 ") 2.700 2.700 0.000 peak 2877 weight 0.10000E+01 volume -0.84580E+01 ppm1 1.929 ppm2 1.863 ASSI { 2902} (segid " " and resid "33 " and name "HB1 ") (segid " " and resid "33 " and name "HE2 ") 6.000 6.000 0.000 peak 2902 weight 0.10000E+01 volume -0.93000E-01 ppm1 1.942 ppm2 3.101 OR { 2902} (segid " " and resid "33 " and name "HB1 ") (segid " " and resid "33 " and name "HE1 ") ASSI { 2923} (segid " " and resid "33 " and name "HD1 ") (segid " " and resid "33 " and name "HB1 ") 5.000 5.000 0.000 peak 2923 weight 0.10000E+01 volume -0.45400E+00 ppm1 1.718 ppm2 1.942 OR { 2923} (segid " " and resid "33 " and name "HD2 ") (segid " " and resid "33 " and name "HB1 ") ASSI { 2917} (segid " " and resid "33 " and name "HD1 ") (segid " " and resid "33 " and name "HE2 ") 5.000 5.000 0.000 peak 2917 weight 0.10000E+01 volume -0.87000E+00 ppm1 1.718 ppm2 3.101 OR { 2917} (segid " " and resid "33 " and name "HD2 ") (segid " " and resid "33 " and name "HE1 ") OR { 2917} (segid " " and resid "33 " and name "HD2 ") (segid " " and resid "33 " and name "HE2 ") OR { 2917} (segid " " and resid "33 " and name "HD1 ") (segid " " and resid "33 " and name "HE1 ") ASSI { 2919} (segid " " and resid "33 " and name "HD1 ") (segid " " and resid "33 " and name "HB2 ") 5.000 5.000 0.000 peak 2919 weight 0.10000E+01 volume -0.77400E+00 ppm1 1.718 ppm2 1.863 OR { 2919} (segid " " and resid "33 " and name "HD2 ") (segid " " and resid "33 " and name "HB2 ") ASSI { 2930} (segid " " and resid "33 " and name "HE1 ") (segid " " and resid "15 " and name "HD12") 5.000 5.000 0.000 peak 2930 weight 0.10000E+01 volume -0.36200E+00 ppm1 3.114 ppm2 0.651 OR { 2930} (segid " " and resid "33 " and name "HE1 ") (segid " " and resid "15 " and name "HD11") OR { 2930} (segid " " and resid "33 " and name "HE1 ") (segid " " and resid "15 " and name "HD13") ASSI { 2929} (segid " " and resid "33 " and name "HE2 ") (segid " " and resid "15 " and name "HG23") 5.000 5.000 0.000 peak 2929 weight 0.10000E+01 volume -0.67600E+00 ppm1 3.101 ppm2 0.941 OR { 2929} (segid " " and resid "33 " and name "HE1 ") (segid " " and resid "15 " and name "HG23") OR { 2929} (segid " " and resid "33 " and name "HE1 ") (segid " " and resid "13 " and name "HG11") OR { 2929} (segid " " and resid "33 " and name "HE2 ") (segid " " and resid "15 " and name "HG21") OR { 2929} (segid " " and resid "33 " and name "HE1 ") (segid " " and resid "13 " and name "HG13") OR { 2929} (segid " " and resid "33 " and name "HE1 ") (segid " " and resid "13 " and name "HG12") OR { 2929} (segid " " and resid "33 " and name "HE1 ") (segid " " and resid "15 " and name "HG21") OR { 2929} (segid " " and resid "33 " and name "HE2 ") (segid " " and resid "13 " and name "HG12") ASSI { 2934} (segid " " and resid "33 " and name "HE1 ") (segid " " and resid "15 " and name "HG12") 6.000 6.000 0.000 peak 2934 weight 0.10000E+01 volume -0.87000E-01 ppm1 3.114 ppm2 1.257 OR { 2934} (segid " " and resid "33 " and name "HE2 ") (segid " " and resid "15 " and name "HG12") ASSI { 2932} (segid " " and resid "33 " and name "HE1 ") (segid " " and resid "13 " and name "HB ") 6.000 6.000 0.000 peak 2932 weight 0.10000E+01 volume -0.26200E+00 ppm1 3.114 ppm2 2.153 OR { 2932} (segid " " and resid "33 " and name "HE2 ") (segid " " and resid "13 " and name "HB ") OR { 2932} (segid " " and resid "33 " and name "HE1 ") (segid " " and resid "16 " and name "HG2 ") ASSI { 2933} (segid " " and resid "33 " and name "HE1 ") (segid " " and resid "33 " and name "HA ") 6.000 6.000 0.000 peak 2933 weight 0.10000E+01 volume -0.80000E-01 ppm1 3.114 ppm2 4.313 OR { 2933} (segid " " and resid "33 " and name "HE2 ") (segid " " and resid "33 " and name "HA ") ASSI { 2873} (segid " " and resid "34 " and name "HB2 ") (segid " " and resid "34 " and name "HB1 ") 3.300 3.300 0.000 peak 2873 weight 0.10000E+01 volume -0.26920E+01 ppm1 1.665 ppm2 2.284 ASSI { 2949} (segid " " and resid "34 " and name "HB2 ") (segid " " and resid "34 " and name "HA ") 5.000 5.000 0.000 peak 2949 weight 0.10000E+01 volume -0.50700E+00 ppm1 1.665 ppm2 4.471 ASSI { 2953} (segid " " and resid "34 " and name "HG2 ") (segid " " and resid "34 " and name "HB1 ") 3.300 3.300 0.000 peak 2953 weight 0.10000E+01 volume -0.21340E+01 ppm1 2.008 ppm2 2.284 OR { 2953} (segid " " and resid "34 " and name "HG1 ") (segid " " and resid "34 " and name "HB1 ") ASSI { 2971} (segid " " and resid "35 " and name "HA2 ") (segid " " and resid "31 " and name "HG1 ") 6.000 6.000 0.000 peak 2971 weight 0.10000E+01 volume -0.10500E+00 ppm1 3.931 ppm2 2.258 ASSI { 2973} (segid " " and resid "36 " and name "HA ") (segid " " and resid "41 " and name "HG1 ") 6.000 6.000 0.000 peak 2973 weight 0.10000E+01 volume -0.10000E+00 ppm1 4.498 ppm2 2.469 OR { 2973} (segid " " and resid "36 " and name "HA ") (segid " " and resid "40 " and name "HB1 ") ASSI { 2976} (segid " " and resid "36 " and name "HB ") (segid " " and resid "36 " and name "HD13") 5.000 5.000 0.000 peak 2976 weight 0.10000E+01 volume -0.83400E+00 ppm1 1.481 ppm2 0.782 OR { 2976} (segid " " and resid "36 " and name "HB ") (segid " " and resid "36 " and name "HD11") OR { 2976} (segid " " and resid "36 " and name "HB ") (segid " " and resid "36 " and name "HD12") ASSI { 3015} (segid " " and resid "36 " and name "HD13") (segid " " and resid "30 " and name "HG23") 5.000 5.000 0.000 peak 3015 weight 0.10000E+01 volume -0.32600E+00 ppm1 0.796 ppm2 0.519 OR { 3015} (segid " " and resid "36 " and name "HD12") (segid " " and resid "30 " and name "HG21") OR { 3015} (segid " " and resid "36 " and name "HD12") (segid " " and resid "30 " and name "HG23") OR { 3015} (segid " " and resid "36 " and name "HD12") (segid " " and resid "30 " and name "HG22") OR { 3015} (segid " " and resid "36 " and name "HD13") (segid " " and resid "30 " and name "HG22") OR { 3015} (segid " " and resid "36 " and name "HD13") (segid " " and resid "30 " and name "HG21") OR { 3015} (segid " " and resid "36 " and name "HD11") (segid " " and resid "30 " and name "HG22") ASSI { 3008} (segid " " and resid "36 " and name "HD12") (segid " " and resid "36 " and name "HG21") 3.300 3.300 0.000 peak 3008 weight 0.10000E+01 volume -0.33200E+01 ppm1 0.796 ppm2 0.914 OR { 3008} (segid " " and resid "36 " and name "HD12") (segid " " and resid "36 " and name "HG22") OR { 3008} (segid " " and resid "36 " and name "HD11") (segid " " and resid "36 " and name "HG21") OR { 3008} (segid " " and resid "36 " and name "HD13") (segid " " and resid "36 " and name "HG23") OR { 3008} (segid " " and resid "36 " and name "HD11") (segid " " and resid "36 " and name "HG22") OR { 3008} (segid " " and resid "36 " and name "HD13") (segid " " and resid "36 " and name "HG21") OR { 3008} (segid " " and resid "36 " and name "HD11") (segid " " and resid "36 " and name "HG23") OR { 3008} (segid " " and resid "36 " and name "HD12") (segid " " and resid "71 " and name "HD22") OR { 3008} (segid " " and resid "36 " and name "HD12") (segid " " and resid "71 " and name "HD23") OR { 3008} (segid " " and resid "36 " and name "HD12") (segid " " and resid "36 " and name "HG23") ASSI { 3020} (segid " " and resid "36 " and name "HD12") (segid " " and resid "8 " and name "HG ") 6.000 6.000 0.000 peak 3020 weight 0.10000E+01 volume -0.29300E+00 ppm1 0.796 ppm2 1.810 OR { 3020} (segid " " and resid "36 " and name "HD13") (segid " " and resid "8 " and name "HG ") OR { 3020} (segid " " and resid "36 " and name "HD11") (segid " " and resid "8 " and name "HG ") OR { 3020} (segid " " and resid "36 " and name "HD13") (segid " " and resid "69 " and name "HB1 ") OR { 3020} (segid " " and resid "36 " and name "HD12") (segid " " and resid "40 " and name "HB2 ") OR { 3020} (segid " " and resid "36 " and name "HD11") (segid " " and resid "69 " and name "HB1 ") OR { 3020} (segid " " and resid "36 " and name "HD12") (segid " " and resid "69 " and name "HB1 ") OR { 3020} (segid " " and resid "36 " and name "HD11") (segid " " and resid "40 " and name "HB2 ") ASSI { 2987} (segid " " and resid "36 " and name "HG11") (segid " " and resid "34 " and name "HB1 ") 6.000 6.000 0.000 peak 2987 weight 0.10000E+01 volume -0.20600E+00 ppm1 1.375 ppm2 2.284 ASSI { 2990} (segid " " and resid "36 " and name "HG12") (segid " " and resid "36 " and name "HG23") 5.000 5.000 0.000 peak 2990 weight 0.10000E+01 volume -0.58400E+00 ppm1 1.138 ppm2 0.888 OR { 2990} (segid " " and resid "36 " and name "HG12") (segid " " and resid "36 " and name "HG22") OR { 2990} (segid " " and resid "36 " and name "HG12") (segid " " and resid "36 " and name "HG21") ASSI { 3003} (segid " " and resid "36 " and name "HG23") (segid " " and resid "30 " and name "HG23") 5.000 5.000 0.000 peak 3003 weight 0.10000E+01 volume -0.37200E+00 ppm1 0.901 ppm2 0.519 OR { 3003} (segid " " and resid "36 " and name "HG21") (segid " " and resid "30 " and name "HG23") OR { 3003} (segid " " and resid "36 " and name "HG23") (segid " " and resid "30 " and name "HG21") OR { 3003} (segid " " and resid "36 " and name "HG22") (segid " " and resid "30 " and name "HG22") OR { 3003} (segid " " and resid "36 " and name "HG21") (segid " " and resid "30 " and name "HG22") OR { 3003} (segid " " and resid "36 " and name "HG23") (segid " " and resid "30 " and name "HG22") OR { 3003} (segid " " and resid "36 " and name "HG22") (segid " " and resid "30 " and name "HG23") OR { 3003} (segid " " and resid "36 " and name "HG22") (segid " " and resid "30 " and name "HG21") ASSI { 2984} (segid " " and resid "36 " and name "HG21") (segid " " and resid "36 " and name "HD12") 3.300 3.300 0.000 peak 2984 weight 0.10000E+01 volume -0.28400E+01 ppm1 0.901 ppm2 0.782 OR { 2984} (segid " " and resid "36 " and name "HG22") (segid " " and resid "36 " and name "HD12") OR { 2984} (segid " " and resid "36 " and name "HG21") (segid " " and resid "36 " and name "HD11") OR { 2984} (segid " " and resid "36 " and name "HG23") (segid " " and resid "36 " and name "HD13") OR { 2984} (segid " " and resid "36 " and name "HG22") (segid " " and resid "36 " and name "HD11") OR { 2984} (segid " " and resid "36 " and name "HG23") (segid " " and resid "36 " and name "HD11") OR { 2984} (segid " " and resid "36 " and name "HG23") (segid " " and resid "36 " and name "HD12") ASSI { 2998} (segid " " and resid "36 " and name "HG21") (segid " " and resid "36 " and name "HG11") 5.000 5.000 0.000 peak 2998 weight 0.10000E+01 volume -0.85800E+00 ppm1 0.901 ppm2 1.362 OR { 2998} (segid " " and resid "36 " and name "HG22") (segid " " and resid "36 " and name "HG11") OR { 2998} (segid " " and resid "36 " and name "HG23") (segid " " and resid "36 " and name "HG11") ASSI { 3005} (segid " " and resid "36 " and name "HG22") (segid " " and resid "37 " and name "HB2 ") 5.000 5.000 0.000 peak 3005 weight 0.10000E+01 volume -0.32100E+00 ppm1 0.901 ppm2 1.942 OR { 3005} (segid " " and resid "36 " and name "HG23") (segid " " and resid "37 " and name "HB2 ") OR { 3005} (segid " " and resid "36 " and name "HG23") (segid " " and resid "41 " and name "HB2 ") OR { 3005} (segid " " and resid "36 " and name "HG22") (segid " " and resid "41 " and name "HB2 ") OR { 3005} (segid " " and resid "36 " and name "HG21") (segid " " and resid "41 " and name "HB2 ") OR { 3005} (segid " " and resid "36 " and name "HG21") (segid " " and resid "37 " and name "HB2 ") ASSI { 2995} (segid " " and resid "36 " and name "HG21") (segid " " and resid "41 " and name "HG1 ") 5.000 5.000 0.000 peak 2995 weight 0.10000E+01 volume -0.16550E+01 ppm1 0.905 ppm2 2.478 OR { 2995} (segid " " and resid "36 " and name "HG23") (segid " " and resid "41 " and name "HG1 ") OR { 2995} (segid " " and resid "36 " and name "HG22") (segid " " and resid "41 " and name "HG1 ") ASSI { 3030} (segid " " and resid "37 " and name "HA ") (segid " " and resid "37 " and name "HD1 ") 6.000 6.000 0.000 peak 3030 weight 0.10000E+01 volume -0.80000E-01 ppm1 4.603 ppm2 4.155 ASSI { 3048} (segid " " and resid "37 " and name "HD1 ") (segid " " and resid "40 " and name "HB2 ") 6.000 6.000 0.000 peak 3048 weight 0.10000E+01 volume -0.18900E+00 ppm1 4.142 ppm2 1.784 ASSI { 3046} (segid " " and resid "37 " and name "HD1 ") (segid " " and resid "37 " and name "HB1 ") 5.000 5.000 0.000 peak 3046 weight 0.10000E+01 volume -0.36300E+00 ppm1 4.140 ppm2 2.395 OR { 3046} (segid " " and resid "37 " and name "HD1 ") (segid " " and resid "40 " and name "HG2 ") OR { 3046} (segid " " and resid "37 " and name "HD1 ") (segid " " and resid "40 " and name "HG1 ") ASSI { 3065} (segid " " and resid "37 " and name "HD2 ") (segid " " and resid "36 " and name "HG11") 6.000 6.000 0.000 peak 3065 weight 0.10000E+01 volume -0.95000E-01 ppm1 3.562 ppm2 1.362 ASSI { 3064} (segid " " and resid "37 " and name "HD2 ") (segid " " and resid "36 " and name "HG12") 6.000 6.000 0.000 peak 3064 weight 0.10000E+01 volume -0.92000E-01 ppm1 3.562 ppm2 1.125 ASSI { 3072} (segid " " and resid "37 " and name "HG2 ") (segid " " and resid "40 " and name "HB2 ") 6.000 6.000 0.000 peak 3072 weight 0.10000E+01 volume -0.22500E+00 ppm1 2.060 ppm2 1.784 ASSI { 3085} (segid " " and resid "38 " and name "HA ") (segid " " and resid "37 " and name "HA ") 6.000 6.000 0.000 peak 3085 weight 0.10000E+01 volume -0.71000E-01 ppm1 4.050 ppm2 4.603 ASSI { 3083} (segid " " and resid "38 " and name "HA ") (segid " " and resid "69 " and name "HD12") 6.000 6.000 0.000 peak 3083 weight 0.10000E+01 volume -0.12700E+00 ppm1 4.063 ppm2 0.809 OR { 3083} (segid " " and resid "38 " and name "HA ") (segid " " and resid "69 " and name "HD13") OR { 3083} (segid " " and resid "38 " and name "HA ") (segid " " and resid "69 " and name "HD11") OR { 3083} (segid " " and resid "38 " and name "HA ") (segid " " and resid "43 " and name "HD12") OR { 3083} (segid " " and resid "38 " and name "HA ") (segid " " and resid "43 " and name "HD13") OR { 3083} (segid " " and resid "38 " and name "HA ") (segid " " and resid "43 " and name "HD11") OR { 3083} (segid " " and resid "38 " and name "HA ") (segid " " and resid "23 " and name "HG12") OR { 3083} (segid " " and resid "38 " and name "HA ") (segid " " and resid "23 " and name "HG11") OR { 3083} (segid " " and resid "38 " and name "HA ") (segid " " and resid "69 " and name "HD23") OR { 3083} (segid " " and resid "38 " and name "HA ") (segid " " and resid "23 " and name "HG13") OR { 3083} (segid " " and resid "38 " and name "HA ") (segid " " and resid "36 " and name "HD13") ASSI { 5529} (segid " " and resid "38 " and name "HA ") (segid " " and resid "41 " and name "HG2 ") 5.000 5.000 0.000 peak 5529 weight 0.10000E+01 volume -0.18540E+01 ppm1 4.056 ppm2 1.610 OR { 5529} (segid " " and resid "38 " and name "HA ") (segid " " and resid "27 " and name "HD2 ") OR { 5529} (segid " " and resid "38 " and name "HA ") (segid " " and resid "27 " and name "HD1 ") ASSI { 3084} (segid " " and resid "38 " and name "HA ") (segid " " and resid "27 " and name "HE1 ") 6.000 6.000 0.000 peak 3084 weight 0.10000E+01 volume -0.98000E-01 ppm1 4.063 ppm2 2.759 ASSI { 3089} (segid " " and resid "38 " and name "HB2 ") (segid " " and resid "38 " and name "HG2 ") 5.000 5.000 0.000 peak 3089 weight 0.10000E+01 volume -0.85600E+00 ppm1 2.034 ppm2 1.626 OR { 3089} (segid " " and resid "38 " and name "HB2 ") (segid " " and resid "27 " and name "HD1 ") OR { 3089} (segid " " and resid "38 " and name "HB2 ") (segid " " and resid "27 " and name "HD2 ") ASSI { 3086} (segid " " and resid "38 " and name "HB2 ") (segid " " and resid "38 " and name "HB1 ") 3.300 3.300 0.000 peak 3086 weight 0.10000E+01 volume -0.30810E+01 ppm1 2.034 ppm2 2.258 ASSI { 3108} (segid " " and resid "38 " and name "HD2 ") (segid " " and resid "38 " and name "HB2 ") 5.000 5.000 0.000 peak 3108 weight 0.10000E+01 volume -0.10130E+01 ppm1 3.721 ppm2 2.047 OR { 3108} (segid " " and resid "38 " and name "HD1 ") (segid " " and resid "38 " and name "HB2 ") OR { 3108} (segid " " and resid "38 " and name "HD2 ") (segid " " and resid "37 " and name "HG1 ") ASSI { 3098} (segid " " and resid "38 " and name "HG2 ") (segid " " and resid "38 " and name "HB2 ") 5.000 5.000 0.000 peak 3098 weight 0.10000E+01 volume -0.73500E+00 ppm1 1.626 ppm2 2.021 ASSI { 3100} (segid " " and resid "38 " and name "HG2 ") (segid " " and resid "28 " and name "HA ") 6.000 6.000 0.000 peak 3100 weight 0.10000E+01 volume -0.23500E+00 ppm1 1.626 ppm2 4.155 ASSI { 3104} (segid " " and resid "38 " and name "HG2 ") (segid " " and resid "37 " and name "HA ") 6.000 6.000 0.000 peak 3104 weight 0.10000E+01 volume -0.14300E+00 ppm1 1.612 ppm2 4.603 ASSI { 3130} (segid " " and resid "40 " and name "HB2 ") (segid " " and resid "40 " and name "HB1 ") 3.300 3.300 0.000 peak 3130 weight 0.10000E+01 volume -0.29620E+01 ppm1 1.784 ppm2 2.469 ASSI { 3133} (segid " " and resid "40 " and name "HB2 ") (segid " " and resid "40 " and name "HA ") 5.000 5.000 0.000 peak 3133 weight 0.10000E+01 volume -0.56400E+00 ppm1 1.784 ppm2 4.471 ASSI { 3143} (segid " " and resid "41 " and name "HA ") (segid " " and resid "69 " and name "HD13") 5.000 5.000 0.000 peak 3143 weight 0.10000E+01 volume -0.15790E+01 ppm1 4.103 ppm2 0.861 OR { 3143} (segid " " and resid "41 " and name "HA ") (segid " " and resid "69 " and name "HD12") OR { 3143} (segid " " and resid "41 " and name "HA ") (segid " " and resid "36 " and name "HG21") OR { 3143} (segid " " and resid "41 " and name "HA ") (segid " " and resid "36 " and name "HG22") ASSI { 3149} (segid " " and resid "41 " and name "HA ") (segid " " and resid "72 " and name "HG2 ") 5.000 5.000 0.000 peak 3149 weight 0.10000E+01 volume -0.31900E+00 ppm1 4.089 ppm2 1.494 OR { 3149} (segid " " and resid "41 " and name "HA ") (segid " " and resid "72 " and name "HB2 ") OR { 3149} (segid " " and resid "41 " and name "HA ") (segid " " and resid "42 " and name "HB2 ") OR { 3149} (segid " " and resid "41 " and name "HA ") (segid " " and resid "36 " and name "HB ") OR { 3149} (segid " " and resid "41 " and name "HA ") (segid " " and resid "27 " and name "HG2 ") OR { 3149} (segid " " and resid "41 " and name "HA ") (segid " " and resid "43 " and name "HG ") ASSI { 3150} (segid " " and resid "41 " and name "HG1 ") (segid " " and resid "41 " and name "HG2 ") 6.000 6.000 0.000 peak 3150 weight 0.10000E+01 volume -0.27900E+00 ppm1 2.495 ppm2 1.599 ASSI { 3164} (segid " " and resid "41 " and name "HG1 ") (segid " " and resid "41 " and name "HB1 ") 6.000 6.000 0.000 peak 3164 weight 0.10000E+01 volume -0.95000E-01 ppm1 2.495 ppm2 1.810 ASSI { 3168} (segid " " and resid "41 " and name "HG2 ") (segid " " and resid "41 " and name "HB2 ") 6.000 6.000 0.000 peak 3168 weight 0.10000E+01 volume -0.90000E-02 ppm1 1.612 ppm2 1.916 ASSI { 3180} (segid " " and resid "42 " and name "HB1 ") (segid " " and resid "44 " and name "HD13") 6.000 6.000 0.000 peak 3180 weight 0.10000E+01 volume -0.69000E-01 ppm1 1.692 ppm2 0.651 OR { 3180} (segid " " and resid "42 " and name "HB1 ") (segid " " and resid "44 " and name "HD12") OR { 3180} (segid " " and resid "42 " and name "HB1 ") (segid " " and resid "44 " and name "HD11") ASSI { 3178} (segid " " and resid "42 " and name "HB1 ") (segid " " and resid "70 " and name "HB ") 5.000 5.000 0.000 peak 3178 weight 0.10000E+01 volume -0.33100E+00 ppm1 1.705 ppm2 2.074 ASSI { 3176} (segid " " and resid "42 " and name "HB2 ") (segid " " and resid "42 " and name "HG2 ") 5.000 5.000 0.000 peak 3176 weight 0.10000E+01 volume -0.14300E+01 ppm1 1.520 ppm2 1.283 ASSI { 3192} (segid " " and resid "42 " and name "HD1 ") (segid " " and resid "44 " and name "HD13") 5.000 5.000 0.000 peak 3192 weight 0.10000E+01 volume -0.36500E+00 ppm1 3.088 ppm2 0.651 OR { 3192} (segid " " and resid "42 " and name "HD1 ") (segid " " and resid "44 " and name "HD11") OR { 3192} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "44 " and name "HD13") OR { 3192} (segid " " and resid "42 " and name "HD1 ") (segid " " and resid "44 " and name "HD12") ASSI { 3194} (segid " " and resid "42 " and name "HD1 ") (segid " " and resid "70 " and name "HG13") 5.000 5.000 0.000 peak 3194 weight 0.10000E+01 volume -0.38900E+00 ppm1 3.088 ppm2 0.941 OR { 3194} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "70 " and name "HG13") OR { 3194} (segid " " and resid "42 " and name "HD1 ") (segid " " and resid "70 " and name "HG11") OR { 3194} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "70 " and name "HG11") OR { 3194} (segid " " and resid "42 " and name "HD1 ") (segid " " and resid "70 " and name "HG12") ASSI { 3186} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "72 " and name "HB2 ") 3.300 3.300 0.000 peak 3186 weight 0.10000E+01 volume -0.35530E+01 ppm1 3.088 ppm2 1.494 OR { 3186} (segid " " and resid "42 " and name "HD1 ") (segid " " and resid "72 " and name "HB2 ") OR { 3186} (segid " " and resid "42 " and name "HD1 ") (segid " " and resid "42 " and name "HB2 ") OR { 3186} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "72 " and name "HG1 ") OR { 3186} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "42 " and name "HB2 ") OR { 3186} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "42 " and name "HG1 ") OR { 3186} (segid " " and resid "42 " and name "HD1 ") (segid " " and resid "42 " and name "HG1 ") ASSI { 3188} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "42 " and name "HB1 ") 5.000 5.000 0.000 peak 3188 weight 0.10000E+01 volume -0.13420E+01 ppm1 3.088 ppm2 1.705 OR { 3188} (segid " " and resid "42 " and name "HD1 ") (segid " " and resid "42 " and name "HB1 ") OR { 3188} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "72 " and name "HB1 ") ASSI { 3195} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "70 " and name "HB ") 6.000 6.000 0.000 peak 3195 weight 0.10000E+01 volume -0.23900E+00 ppm1 3.088 ppm2 2.074 OR { 3195} (segid " " and resid "42 " and name "HD1 ") (segid " " and resid "70 " and name "HB ") ASSI { 3197} (segid " " and resid "43 " and name "HA ") (segid " " and resid "43 " and name "HD23") 3.300 3.300 0.000 peak 3197 weight 0.10000E+01 volume -0.26150E+01 ppm1 5.354 ppm2 0.756 OR { 3197} (segid " " and resid "43 " and name "HA ") (segid " " and resid "43 " and name "HD22") OR { 3197} (segid " " and resid "43 " and name "HA ") (segid " " and resid "43 " and name "HD21") ASSI { 3203} (segid " " and resid "43 " and name "HA ") (segid " " and resid "42 " and name "HG2 ") 6.000 6.000 0.000 peak 3203 weight 0.10000E+01 volume -0.15700E+00 ppm1 5.354 ppm2 1.257 OR { 3203} (segid " " and resid "43 " and name "HA ") (segid " " and resid "69 " and name "HB2 ") ASSI { 3205} (segid " " and resid "43 " and name "HB2 ") (segid " " and resid "50 " and name "HB2 ") 5.000 5.000 0.000 peak 3205 weight 0.10000E+01 volume -0.81500E+00 ppm1 1.757 ppm2 1.520 ASSI { 3224} (segid " " and resid "43 " and name "HD12") (segid " " and resid "50 " and name "HD11") 5.000 5.000 0.000 peak 3224 weight 0.10000E+01 volume -0.41100E+00 ppm1 0.796 ppm2 0.572 OR { 3224} (segid " " and resid "43 " and name "HD11") (segid " " and resid "50 " and name "HD11") OR { 3224} (segid " " and resid "43 " and name "HD12") (segid " " and resid "50 " and name "HD12") OR { 3224} (segid " " and resid "43 " and name "HD13") (segid " " and resid "50 " and name "HD12") OR { 3224} (segid " " and resid "43 " and name "HD12") (segid " " and resid "50 " and name "HD13") OR { 3224} (segid " " and resid "43 " and name "HD13") (segid " " and resid "50 " and name "HD11") ASSI { 3218} (segid " " and resid "43 " and name "HD13") (segid " " and resid "43 " and name "HG ") 5.000 5.000 0.000 peak 3218 weight 0.10000E+01 volume -0.14090E+01 ppm1 0.796 ppm2 1.468 OR { 3218} (segid " " and resid "43 " and name "HD12") (segid " " and resid "43 " and name "HG ") OR { 3218} (segid " " and resid "43 " and name "HD11") (segid " " and resid "43 " and name "HG ") ASSI { 3223} (segid " " and resid "43 " and name "HD13") (segid " " and resid "27 " and name "HD1 ") 5.000 5.000 0.000 peak 3223 weight 0.10000E+01 volume -0.84300E+00 ppm1 0.796 ppm2 1.599 OR { 3223} (segid " " and resid "43 " and name "HD12") (segid " " and resid "27 " and name "HG1 ") OR { 3223} (segid " " and resid "43 " and name "HD11") (segid " " and resid "27 " and name "HG1 ") OR { 3223} (segid " " and resid "43 " and name "HD11") (segid " " and resid "27 " and name "HD1 ") OR { 3223} (segid " " and resid "43 " and name "HD12") (segid " " and resid "27 " and name "HD2 ") ASSI { 3234} (segid " " and resid "43 " and name "HD13") (segid " " and resid "30 " and name "HB ") 6.000 6.000 0.000 peak 3234 weight 0.10000E+01 volume -0.16500E+00 ppm1 0.796 ppm2 2.021 OR { 3234} (segid " " and resid "43 " and name "HD12") (segid " " and resid "30 " and name "HB ") OR { 3234} (segid " " and resid "43 " and name "HD11") (segid " " and resid "30 " and name "HB ") OR { 3234} (segid " " and resid "43 " and name "HD11") (segid " " and resid "27 " and name "HB2 ") OR { 3234} (segid " " and resid "43 " and name "HD13") (segid " " and resid "27 " and name "HB2 ") OR { 3234} (segid " " and resid "43 " and name "HD12") (segid " " and resid "27 " and name "HB2 ") ASSI { 3210} (segid " " and resid "43 " and name "HD23") (segid " " and resid "43 " and name "HB1 ") 3.300 3.300 0.000 peak 3210 weight 0.10000E+01 volume -0.22830E+01 ppm1 0.756 ppm2 0.993 OR { 3210} (segid " " and resid "43 " and name "HD22") (segid " " and resid "43 " and name "HB1 ") OR { 3210} (segid " " and resid "43 " and name "HD21") (segid " " and resid "43 " and name "HB1 ") OR { 3210} (segid " " and resid "43 " and name "HD22") (segid " " and resid "67 " and name "HG21") OR { 3210} (segid " " and resid "43 " and name "HD23") (segid " " and resid "67 " and name "HG21") OR { 3210} (segid " " and resid "43 " and name "HD23") (segid " " and resid "67 " and name "HG22") ASSI { 3236} (segid " " and resid "43 " and name "HD23") (segid " " and resid "43 " and name "HG ") 5.000 5.000 0.000 peak 3236 weight 0.10000E+01 volume -0.19080E+01 ppm1 0.756 ppm2 1.468 OR { 3236} (segid " " and resid "43 " and name "HD22") (segid " " and resid "43 " and name "HG ") OR { 3236} (segid " " and resid "43 " and name "HD21") (segid " " and resid "43 " and name "HG ") ASSI { 3242} (segid " " and resid "43 " and name "HD22") (segid " " and resid "27 " and name "HD1 ") 5.000 5.000 0.000 peak 3242 weight 0.10000E+01 volume -0.38600E+00 ppm1 0.756 ppm2 1.599 OR { 3242} (segid " " and resid "43 " and name "HD23") (segid " " and resid "27 " and name "HD1 ") OR { 3242} (segid " " and resid "43 " and name "HD21") (segid " " and resid "27 " and name "HD1 ") OR { 3242} (segid " " and resid "43 " and name "HD23") (segid " " and resid "27 " and name "HG1 ") OR { 3242} (segid " " and resid "43 " and name "HD22") (segid " " and resid "27 " and name "HG1 ") OR { 3242} (segid " " and resid "43 " and name "HD22") (segid " " and resid "27 " and name "HD2 ") OR { 3242} (segid " " and resid "43 " and name "HD23") (segid " " and resid "27 " and name "HD2 ") ASSI { 3239} (segid " " and resid "43 " and name "HD22") (segid " " and resid "41 " and name "HB1 ") 5.000 5.000 0.000 peak 3239 weight 0.10000E+01 volume -0.87200E+00 ppm1 0.756 ppm2 1.757 OR { 3239} (segid " " and resid "43 " and name "HD23") (segid " " and resid "41 " and name "HB1 ") OR { 3239} (segid " " and resid "43 " and name "HD21") (segid " " and resid "41 " and name "HB1 ") OR { 3239} (segid " " and resid "43 " and name "HD23") (segid " " and resid "43 " and name "HB2 ") ASSI { 3243} (segid " " and resid "43 " and name "HD23") (segid " " and resid "42 " and name "HA ") 6.000 6.000 0.000 peak 3243 weight 0.10000E+01 volume -0.11500E+00 ppm1 0.769 ppm2 4.392 OR { 3243} (segid " " and resid "43 " and name "HD22") (segid " " and resid "27 " and name "HA ") OR { 3243} (segid " " and resid "43 " and name "HD23") (segid " " and resid "27 " and name "HA ") OR { 3243} (segid " " and resid "43 " and name "HD22") (segid " " and resid "42 " and name "HA ") OR { 3243} (segid " " and resid "43 " and name "HD21") (segid " " and resid "27 " and name "HA ") ASSI { 3161} (segid " " and resid "43 " and name "HG ") (segid " " and resid "43 " and name "HD13") 5.000 5.000 0.000 peak 3161 weight 0.10000E+01 volume -0.19210E+01 ppm1 1.468 ppm2 0.782 OR { 3161} (segid " " and resid "43 " and name "HG ") (segid " " and resid "43 " and name "HD12") OR { 3161} (segid " " and resid "43 " and name "HG ") (segid " " and resid "43 " and name "HD11") OR { 3161} (segid " " and resid "43 " and name "HG ") (segid " " and resid "43 " and name "HD23") OR { 3161} (segid " " and resid "43 " and name "HG ") (segid " " and resid "43 " and name "HD22") OR { 3161} (segid " " and resid "43 " and name "HG ") (segid " " and resid "43 " and name "HD21") ASSI { 5653} (segid " " and resid "44 " and name "HA ") (segid " " and resid "44 " and name "HD11") 5.000 5.000 0.000 peak 5653 weight 0.10000E+01 volume -0.14940E+01 ppm1 4.913 ppm2 0.675 OR { 5653} (segid " " and resid "44 " and name "HA ") (segid " " and resid "44 " and name "HD12") OR { 5653} (segid " " and resid "44 " and name "HA ") (segid " " and resid "44 " and name "HG23") OR { 5653} (segid " " and resid "44 " and name "HA ") (segid " " and resid "44 " and name "HG22") OR { 5653} (segid " " and resid "44 " and name "HA ") (segid " " and resid "44 " and name "HG21") ASSI { 3247} (segid " " and resid "44 " and name "HA ") (segid " " and resid "49 " and name "HB2 ") 6.000 6.000 0.000 peak 3247 weight 0.10000E+01 volume -0.11700E+00 ppm1 4.919 ppm2 1.968 OR { 3247} (segid " " and resid "44 " and name "HA ") (segid " " and resid "49 " and name "HB1 ") ASSI { 3250} (segid " " and resid "44 " and name "HB ") (segid " " and resid "44 " and name "HG11") 5.000 5.000 0.000 peak 3250 weight 0.10000E+01 volume -0.76100E+00 ppm1 1.784 ppm2 1.362 ASSI { 3281} (segid " " and resid "44 " and name "HD12") (segid " " and resid "42 " and name "HG1 ") 5.000 5.000 0.000 peak 3281 weight 0.10000E+01 volume -0.35500E+00 ppm1 0.664 ppm2 1.494 OR { 3281} (segid " " and resid "44 " and name "HD11") (segid " " and resid "42 " and name "HG1 ") OR { 3281} (segid " " and resid "44 " and name "HD13") (segid " " and resid "42 " and name "HG1 ") ASSI { 3277} (segid " " and resid "44 " and name "HD12") (segid " " and resid "44 " and name "HB ") 5.000 5.000 0.000 peak 3277 weight 0.10000E+01 volume -0.91100E+00 ppm1 0.664 ppm2 1.784 OR { 3277} (segid " " and resid "44 " and name "HD11") (segid " " and resid "44 " and name "HB ") OR { 3277} (segid " " and resid "44 " and name "HD13") (segid " " and resid "44 " and name "HB ") ASSI { 3280} (segid " " and resid "44 " and name "HD12") (segid " " and resid "49 " and name "HB2 ") 5.000 5.000 0.000 peak 3280 weight 0.10000E+01 volume -0.82000E+00 ppm1 0.664 ppm2 1.968 OR { 3280} (segid " " and resid "44 " and name "HD13") (segid " " and resid "49 " and name "HB1 ") OR { 3280} (segid " " and resid "44 " and name "HD12") (segid " " and resid "49 " and name "HB1 ") OR { 3280} (segid " " and resid "44 " and name "HD11") (segid " " and resid "49 " and name "HB1 ") ASSI { 3283} (segid " " and resid "44 " and name "HD11") (segid " " and resid "70 " and name "HB ") 5.000 5.000 0.000 peak 3283 weight 0.10000E+01 volume -0.32000E+00 ppm1 0.664 ppm2 2.074 OR { 3283} (segid " " and resid "44 " and name "HD13") (segid " " and resid "70 " and name "HB ") OR { 3283} (segid " " and resid "44 " and name "HD12") (segid " " and resid "70 " and name "HB ") ASSI { 3265} (segid " " and resid "44 " and name "HD11") (segid " " and resid "44 " and name "HA ") 3.300 3.300 0.000 peak 3265 weight 0.10000E+01 volume -0.22290E+01 ppm1 0.664 ppm2 4.901 OR { 3265} (segid " " and resid "44 " and name "HD11") (segid " " and resid "49 " and name "HA ") OR { 3265} (segid " " and resid "44 " and name "HD13") (segid " " and resid "44 " and name "HA ") OR { 3265} (segid " " and resid "44 " and name "HD12") (segid " " and resid "44 " and name "HA ") OR { 3265} (segid " " and resid "44 " and name "HD12") (segid " " and resid "49 " and name "HA ") ASSI { 3274} (segid " " and resid "44 " and name "HD11") (segid " " and resid "44 " and name "HG11") 3.300 3.300 0.000 peak 3274 weight 0.10000E+01 volume -0.22370E+01 ppm1 0.664 ppm2 1.362 OR { 3274} (segid " " and resid "44 " and name "HD12") (segid " " and resid "44 " and name "HG11") OR { 3274} (segid " " and resid "44 " and name "HD13") (segid " " and resid "44 " and name "HG11") ASSI { 5664} (segid " " and resid "44 " and name "HG12") (segid " " and resid "44 " and name "HA ") 5.000 5.000 0.000 peak 5664 weight 0.10000E+01 volume -0.61500E+00 ppm1 1.079 ppm2 4.897 OR { 5664} (segid " " and resid "44 " and name "HG12") (segid " " and resid "49 " and name "HA ") ASSI { 3253} (segid " " and resid "44 " and name "HG12") (segid " " and resid "44 " and name "HG11") 3.300 3.300 0.000 peak 3253 weight 0.10000E+01 volume -0.38130E+01 ppm1 1.085 ppm2 1.362 ASSI { 5669} (segid " " and resid "44 " and name "HG12") (segid " " and resid "44 " and name "HD13") 5.000 5.000 0.000 peak 5669 weight 0.10000E+01 volume -0.10120E+01 ppm1 1.079 ppm2 0.652 OR { 5669} (segid " " and resid "44 " and name "HG12") (segid " " and resid "44 " and name "HG22") OR { 5669} (segid " " and resid "44 " and name "HG12") (segid " " and resid "44 " and name "HD11") OR { 5669} (segid " " and resid "44 " and name "HG12") (segid " " and resid "44 " and name "HD12") OR { 5669} (segid " " and resid "44 " and name "HG12") (segid " " and resid "44 " and name "HG23") ASSI { 3271} (segid " " and resid "44 " and name "HG23") (segid " " and resid "67 " and name "HG21") 6.000 6.000 0.000 peak 3271 weight 0.10000E+01 volume -0.16800E+00 ppm1 0.690 ppm2 0.993 OR { 3271} (segid " " and resid "44 " and name "HG22") (segid " " and resid "67 " and name "HG21") OR { 3271} (segid " " and resid "44 " and name "HG23") (segid " " and resid "67 " and name "HG22") OR { 3271} (segid " " and resid "44 " and name "HG23") (segid " " and resid "67 " and name "HG23") OR { 3271} (segid " " and resid "44 " and name "HG21") (segid " " and resid "67 " and name "HG21") OR { 3271} (segid " " and resid "44 " and name "HG22") (segid " " and resid "67 " and name "HG23") OR { 3271} (segid " " and resid "44 " and name "HG22") (segid " " and resid "67 " and name "HG22") OR { 3271} (segid " " and resid "44 " and name "HG21") (segid " " and resid "67 " and name "HG22") OR { 3271} (segid " " and resid "44 " and name "HG21") (segid " " and resid "67 " and name "HG23") ASSI { 3261} (segid " " and resid "44 " and name "HG21") (segid " " and resid "44 " and name "HG11") 5.000 5.000 0.000 peak 3261 weight 0.10000E+01 volume -0.11000E+01 ppm1 0.690 ppm2 1.362 OR { 3261} (segid " " and resid "44 " and name "HG22") (segid " " and resid "44 " and name "HG11") OR { 3261} (segid " " and resid "44 " and name "HG23") (segid " " and resid "44 " and name "HG11") ASSI { 3270} (segid " " and resid "44 " and name "HG21") (segid " " and resid "49 " and name "HB2 ") 6.000 6.000 0.000 peak 3270 weight 0.10000E+01 volume -0.17900E+00 ppm1 0.690 ppm2 1.942 OR { 3270} (segid " " and resid "44 " and name "HG23") (segid " " and resid "49 " and name "HB2 ") OR { 3270} (segid " " and resid "44 " and name "HG22") (segid " " and resid "49 " and name "HB2 ") OR { 3270} (segid " " and resid "44 " and name "HG22") (segid " " and resid "49 " and name "HB1 ") OR { 3270} (segid " " and resid "44 " and name "HG21") (segid " " and resid "49 " and name "HB1 ") ASSI { 3272} (segid " " and resid "44 " and name "HG23") (segid " " and resid "49 " and name "HG1 ") 6.000 6.000 0.000 peak 3272 weight 0.10000E+01 volume -0.87000E-01 ppm1 0.690 ppm2 2.258 OR { 3272} (segid " " and resid "44 " and name "HG21") (segid " " and resid "49 " and name "HG1 ") OR { 3272} (segid " " and resid "44 " and name "HG23") (segid " " and resid "49 " and name "HG2 ") ASSI { 3269} (segid " " and resid "44 " and name "HG21") (segid " " and resid "48 " and name "HA ") 6.000 6.000 0.000 peak 3269 weight 0.10000E+01 volume -0.16800E+00 ppm1 0.690 ppm2 4.656 OR { 3269} (segid " " and resid "44 " and name "HG23") (segid " " and resid "48 " and name "HA ") OR { 3269} (segid " " and resid "44 " and name "HG22") (segid " " and resid "48 " and name "HA ") ASSI { 5674} (segid " " and resid "44 " and name "HG23") (segid " " and resid "44 " and name "HA ") 5.000 5.000 0.000 peak 5674 weight 0.10000E+01 volume -0.19940E+01 ppm1 0.682 ppm2 4.897 OR { 5674} (segid " " and resid "44 " and name "HG22") (segid " " and resid "44 " and name "HA ") OR { 5674} (segid " " and resid "44 " and name "HG21") (segid " " and resid "44 " and name "HA ") OR { 5674} (segid " " and resid "44 " and name "HG22") (segid " " and resid "49 " and name "HA ") ASSI { 3286} (segid " " and resid "45 " and name "HA ") (segid " " and resid "67 " and name "HA ") 5.000 5.000 0.000 peak 3286 weight 0.10000E+01 volume -0.56600E+00 ppm1 5.209 ppm2 4.709 ASSI { 3287} (segid " " and resid "45 " and name "HA ") (segid " " and resid "44 " and name "HG23") 5.000 5.000 0.000 peak 3287 weight 0.10000E+01 volume -0.42600E+00 ppm1 5.209 ppm2 0.697 OR { 3287} (segid " " and resid "45 " and name "HA ") (segid " " and resid "44 " and name "HG21") OR { 3287} (segid " " and resid "45 " and name "HA ") (segid " " and resid "44 " and name "HG22") OR { 3287} (segid " " and resid "45 " and name "HA ") (segid " " and resid "67 " and name "HD13") OR { 3287} (segid " " and resid "45 " and name "HA ") (segid " " and resid "67 " and name "HD11") ASSI { 3302} (segid " " and resid "45 " and name "HB1 ") (segid " " and resid "67 " and name "HG11") 6.000 6.000 0.000 peak 3302 weight 0.10000E+01 volume -0.21800E+00 ppm1 2.956 ppm2 1.494 ASSI { 3305} (segid " " and resid "45 " and name "HB1 ") (segid " " and resid "67 " and name "HA ") 6.000 6.000 0.000 peak 3305 weight 0.10000E+01 volume -0.14700E+00 ppm1 2.956 ppm2 4.709 ASSI { 3325} (segid " " and resid "45 " and name "HD1 ") (segid " " and resid "67 " and name "HA ") 6.000 6.000 0.000 peak 3325 weight 0.10000E+01 volume -0.19200E+00 ppm1 7.449 ppm2 4.709 ASSI { 3340} (segid " " and resid "46 " and name "HA ") (segid " " and resid "44 " and name "HG23") 6.000 6.000 0.000 peak 3340 weight 0.10000E+01 volume -0.11800E+00 ppm1 3.707 ppm2 0.677 OR { 3340} (segid " " and resid "46 " and name "HA ") (segid " " and resid "44 " and name "HG21") OR { 3340} (segid " " and resid "46 " and name "HA ") (segid " " and resid "44 " and name "HG22") ASSI { 3338} (segid " " and resid "46 " and name "HA ") (segid " " and resid "47 " and name "HA1 ") 6.000 6.000 0.000 peak 3338 weight 0.10000E+01 volume -0.89000E-01 ppm1 3.707 ppm2 4.129 OR { 3338} (segid " " and resid "46 " and name "HA ") (segid " " and resid "66 " and name "HB ") ASSI { 3347} (segid " " and resid "46 " and name "HB3 ") (segid " " and resid "48 " and name "HE2 ") 6.000 6.000 0.000 peak 3347 weight 0.10000E+01 volume -0.88000E-01 ppm1 0.809 ppm2 3.180 OR { 3347} (segid " " and resid "46 " and name "HB1 ") (segid " " and resid "48 " and name "HE2 ") OR { 3347} (segid " " and resid "46 " and name "HB2 ") (segid " " and resid "48 " and name "HE2 ") ASSI { 3348} (segid " " and resid "46 " and name "HB3 ") (segid " " and resid "48 " and name "HD2 ") 6.000 6.000 0.000 peak 3348 weight 0.10000E+01 volume -0.96000E-01 ppm1 0.809 ppm2 1.942 OR { 3348} (segid " " and resid "46 " and name "HB3 ") (segid " " and resid "48 " and name "HB2 ") OR { 3348} (segid " " and resid "46 " and name "HB2 ") (segid " " and resid "48 " and name "HB2 ") OR { 3348} (segid " " and resid "46 " and name "HB2 ") (segid " " and resid "48 " and name "HD2 ") OR { 3348} (segid " " and resid "46 " and name "HB3 ") (segid " " and resid "48 " and name "HD1 ") ASSI { 3361} (segid " " and resid "48 " and name "HD2 ") (segid " " and resid "48 " and name "HE1 ") 5.000 5.000 0.000 peak 3361 weight 0.10000E+01 volume -0.61200E+00 ppm1 1.902 ppm2 3.180 OR { 3361} (segid " " and resid "48 " and name "HD1 ") (segid " " and resid "48 " and name "HE2 ") OR { 3361} (segid " " and resid "48 " and name "HD1 ") (segid " " and resid "48 " and name "HE1 ") OR { 3361} (segid " " and resid "48 " and name "HD2 ") (segid " " and resid "48 " and name "HE2 ") ASSI { 3362} (segid " " and resid "48 " and name "HD1 ") (segid " " and resid "48 " and name "HA ") 6.000 6.000 0.000 peak 3362 weight 0.10000E+01 volume -0.27600E+00 ppm1 1.916 ppm2 4.656 OR { 3362} (segid " " and resid "48 " and name "HD2 ") (segid " " and resid "48 " and name "HA ") ASSI { 2345} (segid " " and resid "49 " and name "HB2 ") (segid " " and resid "49 " and name "HG1 ") 2.700 2.700 0.000 peak 2345 weight 0.10000E+01 volume -0.46610E+01 ppm1 1.968 ppm2 2.258 OR { 2345} (segid " " and resid "49 " and name "HB1 ") (segid " " and resid "49 " and name "HG2 ") OR { 2345} (segid " " and resid "49 " and name "HB1 ") (segid " " and resid "49 " and name "HG1 ") OR { 2345} (segid " " and resid "49 " and name "HB2 ") (segid " " and resid "49 " and name "HG2 ") ASSI { 3379} (segid " " and resid "49 " and name "HB1 ") (segid " " and resid "49 " and name "HA ") 3.300 3.300 0.000 peak 3379 weight 0.10000E+01 volume -0.20640E+01 ppm1 1.968 ppm2 4.893 OR { 3379} (segid " " and resid "49 " and name "HB2 ") (segid " " and resid "49 " and name "HA ") OR { 3379} (segid " " and resid "49 " and name "HB1 ") (segid " " and resid "44 " and name "HA ") ASSI { 3383} (segid " " and resid "49 " and name "HG1 ") (segid " " and resid "44 " and name "HD13") 5.000 5.000 0.000 peak 3383 weight 0.10000E+01 volume -0.43500E+00 ppm1 2.271 ppm2 0.677 OR { 3383} (segid " " and resid "49 " and name "HG1 ") (segid " " and resid "44 " and name "HD11") OR { 3383} (segid " " and resid "49 " and name "HG2 ") (segid " " and resid "44 " and name "HD13") OR { 3383} (segid " " and resid "49 " and name "HG2 ") (segid " " and resid "44 " and name "HD12") OR { 3383} (segid " " and resid "49 " and name "HG1 ") (segid " " and resid "44 " and name "HD12") OR { 3383} (segid " " and resid "49 " and name "HG2 ") (segid " " and resid "44 " and name "HD11") ASSI { 3384} (segid " " and resid "49 " and name "HG1 ") (segid " " and resid "42 " and name "HG1 ") 6.000 6.000 0.000 peak 3384 weight 0.10000E+01 volume -0.24200E+00 ppm1 2.258 ppm2 1.494 OR { 3384} (segid " " and resid "49 " and name "HG2 ") (segid " " and resid "42 " and name "HG1 ") OR { 3384} (segid " " and resid "49 " and name "HG2 ") (segid " " and resid "50 " and name "HB2 ") ASSI { 3382} (segid " " and resid "49 " and name "HG1 ") (segid " " and resid "49 " and name "HA ") 5.000 5.000 0.000 peak 3382 weight 0.10000E+01 volume -0.12160E+01 ppm1 2.271 ppm2 4.893 OR { 3382} (segid " " and resid "49 " and name "HG2 ") (segid " " and resid "49 " and name "HA ") OR { 3382} (segid " " and resid "49 " and name "HG1 ") (segid " " and resid "44 " and name "HA ") ASSI { 3396} (segid " " and resid "50 " and name "HA ") (segid " " and resid "48 " and name "HB2 ") 6.000 6.000 0.000 peak 3396 weight 0.10000E+01 volume -0.14700E+00 ppm1 3.839 ppm2 1.942 OR { 3396} (segid " " and resid "50 " and name "HA ") (segid " " and resid "51 " and name "HB2 ") OR { 3396} (segid " " and resid "50 " and name "HA ") (segid " " and resid "49 " and name "HB1 ") OR { 3396} (segid " " and resid "50 " and name "HA ") (segid " " and resid "54 " and name "HG1 ") OR { 3396} (segid " " and resid "50 " and name "HA ") (segid " " and resid "49 " and name "HB2 ") OR { 3396} (segid " " and resid "50 " and name "HA ") (segid " " and resid "48 " and name "HD2 ") ASSI { 3397} (segid " " and resid "50 " and name "HA ") (segid " " and resid "51 " and name "HG2 ") 6.000 6.000 0.000 peak 3397 weight 0.10000E+01 volume -0.13100E+00 ppm1 3.826 ppm2 2.311 OR { 3397} (segid " " and resid "50 " and name "HA ") (segid " " and resid "49 " and name "HG2 ") OR { 3397} (segid " " and resid "50 " and name "HA ") (segid " " and resid "49 " and name "HG1 ") ASSI { 3405} (segid " " and resid "50 " and name "HB2 ") (segid " " and resid "23 " and name "HG23") 5.000 5.000 0.000 peak 3405 weight 0.10000E+01 volume -0.67200E+00 ppm1 1.533 ppm2 1.046 OR { 3405} (segid " " and resid "50 " and name "HB2 ") (segid " " and resid "23 " and name "HG21") OR { 3405} (segid " " and resid "50 " and name "HB2 ") (segid " " and resid "23 " and name "HG22") OR { 3405} (segid " " and resid "50 " and name "HB2 ") (segid " " and resid "43 " and name "HB1 ") ASSI { 3424} (segid " " and resid "50 " and name "HD13") (segid " " and resid "43 " and name "HD11") 5.000 5.000 0.000 peak 3424 weight 0.10000E+01 volume -0.84600E+00 ppm1 0.572 ppm2 0.809 OR { 3424} (segid " " and resid "50 " and name "HD11") (segid " " and resid "43 " and name "HD12") OR { 3424} (segid " " and resid "50 " and name "HD11") (segid " " and resid "43 " and name "HD11") OR { 3424} (segid " " and resid "50 " and name "HD12") (segid " " and resid "43 " and name "HD12") OR { 3424} (segid " " and resid "50 " and name "HD12") (segid " " and resid "43 " and name "HD13") OR { 3424} (segid " " and resid "50 " and name "HD13") (segid " " and resid "43 " and name "HD12") OR { 3424} (segid " " and resid "50 " and name "HD11") (segid " " and resid "43 " and name "HD13") OR { 3424} (segid " " and resid "50 " and name "HD12") (segid " " and resid "43 " and name "HD11") OR { 3424} (segid " " and resid "50 " and name "HD12") (segid " " and resid "23 " and name "HG12") ASSI { 3423} (segid " " and resid "50 " and name "HD12") (segid " " and resid "50 " and name "HG ") 5.000 5.000 0.000 peak 3423 weight 0.10000E+01 volume -0.18590E+01 ppm1 0.572 ppm2 1.151 OR { 3423} (segid " " and resid "50 " and name "HD11") (segid " " and resid "50 " and name "HG ") OR { 3423} (segid " " and resid "50 " and name "HD13") (segid " " and resid "50 " and name "HG ") ASSI { 3436} (segid " " and resid "50 " and name "HD11") (segid " " and resid "43 " and name "HA ") 6.000 6.000 0.000 peak 3436 weight 0.10000E+01 volume -0.79000E-01 ppm1 0.572 ppm2 5.341 OR { 3436} (segid " " and resid "50 " and name "HD13") (segid " " and resid "43 " and name "HA ") OR { 3436} (segid " " and resid "50 " and name "HD12") (segid " " and resid "43 " and name "HA ") ASSI { 3456} (segid " " and resid "50 " and name "HD22") (segid " " and resid "48 " and name "HB2 ") 6.000 6.000 0.000 peak 3456 weight 0.10000E+01 volume -0.13900E+00 ppm1 0.150 ppm2 1.968 OR { 3456} (segid " " and resid "50 " and name "HD23") (segid " " and resid "48 " and name "HB2 ") OR { 3456} (segid " " and resid "50 " and name "HD21") (segid " " and resid "48 " and name "HB2 ") OR { 3456} (segid " " and resid "50 " and name "HD22") (segid " " and resid "49 " and name "HB1 ") OR { 3456} (segid " " and resid "50 " and name "HD23") (segid " " and resid "48 " and name "HD1 ") OR { 3456} (segid " " and resid "50 " and name "HD23") (segid " " and resid "49 " and name "HB1 ") OR { 3456} (segid " " and resid "50 " and name "HD22") (segid " " and resid "49 " and name "HB2 ") OR { 3456} (segid " " and resid "50 " and name "HD21") (segid " " and resid "49 " and name "HB1 ") OR { 3456} (segid " " and resid "50 " and name "HD23") (segid " " and resid "49 " and name "HB2 ") OR { 3456} (segid " " and resid "50 " and name "HD21") (segid " " and resid "49 " and name "HB2 ") OR { 3456} (segid " " and resid "50 " and name "HD21") (segid " " and resid "54 " and name "HG1 ") ASSI { 3449} (segid " " and resid "50 " and name "HD21") (segid " " and resid "59 " and name "HB2 ") 6.000 6.000 0.000 peak 3449 weight 0.10000E+01 volume -0.19100E+00 ppm1 0.150 ppm2 2.627 OR { 3449} (segid " " and resid "50 " and name "HD22") (segid " " and resid "59 " and name "HB2 ") OR { 3449} (segid " " and resid "50 " and name "HD23") (segid " " and resid "59 " and name "HB2 ") ASSI { 3444} (segid " " and resid "50 " and name "HD22") (segid " " and resid "59 " and name "HE1 ") 5.000 5.000 0.000 peak 3444 weight 0.10000E+01 volume -0.48300E+00 ppm1 0.150 ppm2 6.869 OR { 3444} (segid " " and resid "50 " and name "HD22") (segid " " and resid "59 " and name "HE2 ") OR { 3444} (segid " " and resid "50 " and name "HD23") (segid " " and resid "59 " and name "HE1 ") OR { 3444} (segid " " and resid "50 " and name "HD23") (segid " " and resid "59 " and name "HE2 ") OR { 3444} (segid " " and resid "50 " and name "HD21") (segid " " and resid "59 " and name "HE2 ") ASSI { 3460} (segid " " and resid "50 " and name "HD23") (segid " " and resid "26 " and name "HD2 ") 6.000 6.000 0.000 peak 3460 weight 0.10000E+01 volume -0.83000E-01 ppm1 0.150 ppm2 7.054 OR { 3460} (segid " " and resid "50 " and name "HD21") (segid " " and resid "26 " and name "HD2 ") OR { 3460} (segid " " and resid "50 " and name "HD22") (segid " " and resid "26 " and name "HD2 ") OR { 3460} (segid " " and resid "50 " and name "HD23") (segid " " and resid "26 " and name "HD1 ") ASSI { 3477} (segid " " and resid "51 " and name "HG2 ") (segid " " and resid "51 " and name "HB2 ") 5.000 5.000 0.000 peak 3477 weight 0.10000E+01 volume -0.95200E+00 ppm1 2.311 ppm2 1.942 OR { 3477} (segid " " and resid "51 " and name "HG2 ") (segid " " and resid "49 " and name "HB1 ") ASSI { 3476} (segid " " and resid "51 " and name "HG2 ") (segid " " and resid "51 " and name "HB1 ") 5.000 5.000 0.000 peak 3476 weight 0.10000E+01 volume -0.17440E+01 ppm1 2.311 ppm2 2.205 ASSI { 2334} (segid " " and resid "52 " and name "HB1 ") (segid " " and resid "52 " and name "HB2 ") 2.700 2.700 0.000 peak 2334 weight 0.10000E+01 volume -0.40660E+01 ppm1 2.680 ppm2 2.495 OR { 2334} (segid " " and resid "52 " and name "HB1 ") (segid " " and resid "24 " and name "HG1 ") ASSI { 3511} (segid " " and resid "54 " and name "HB2 ") (segid " " and resid "23 " and name "HG23") 5.000 5.000 0.000 peak 3511 weight 0.10000E+01 volume -0.72700E+00 ppm1 2.377 ppm2 1.046 OR { 3511} (segid " " and resid "54 " and name "HB2 ") (segid " " and resid "23 " and name "HG21") OR { 3511} (segid " " and resid "54 " and name "HB2 ") (segid " " and resid "23 " and name "HG22") OR { 3511} (segid " " and resid "54 " and name "HB1 ") (segid " " and resid "23 " and name "HG21") ASSI { 3494} (segid " " and resid "54 " and name "HG1 ") (segid " " and resid "54 " and name "HG2 ") 3.300 3.300 0.000 peak 3494 weight 0.10000E+01 volume -0.27870E+01 ppm1 1.942 ppm2 1.678 ASSI { 3526} (segid " " and resid "55 " and name "HA ") (segid " " and resid "56 " and name "HD12") 6.000 6.000 0.000 peak 3526 weight 0.10000E+01 volume -0.57000E-01 ppm1 5.249 ppm2 0.387 OR { 3526} (segid " " and resid "55 " and name "HA ") (segid " " and resid "56 " and name "HD13") OR { 3526} (segid " " and resid "55 " and name "HA ") (segid " " and resid "56 " and name "HD11") ASSI { 3528} (segid " " and resid "55 " and name "HA ") (segid " " and resid "20 " and name "HA ") 6.000 6.000 0.000 peak 3528 weight 0.10000E+01 volume -0.10600E+00 ppm1 5.236 ppm2 4.366 OR { 3528} (segid " " and resid "55 " and name "HA ") (segid " " and resid "52 " and name "HA ") ASSI { 3536} (segid " " and resid "55 " and name "HB ") (segid " " and resid "23 " and name "HG21") 6.000 6.000 0.000 peak 3536 weight 0.10000E+01 volume -0.13600E+00 ppm1 4.471 ppm2 1.046 OR { 3536} (segid " " and resid "55 " and name "HB ") (segid " " and resid "23 " and name "HG22") OR { 3536} (segid " " and resid "55 " and name "HB ") (segid " " and resid "56 " and name "HB1 ") OR { 3536} (segid " " and resid "55 " and name "HB ") (segid " " and resid "23 " and name "HG23") ASSI { 3533} (segid " " and resid "55 " and name "HB ") (segid " " and resid "57 " and name "HB1 ") 6.000 6.000 0.000 peak 3533 weight 0.10000E+01 volume -0.12400E+00 ppm1 4.471 ppm2 3.786 OR { 3533} (segid " " and resid "55 " and name "HB ") (segid " " and resid "20 " and name "HB1 ") ASSI { 3543} (segid " " and resid "55 " and name "HG23") (segid " " and resid "20 " and name "HB1 ") 6.000 6.000 0.000 peak 3543 weight 0.10000E+01 volume -0.13900E+00 ppm1 1.151 ppm2 3.760 OR { 3543} (segid " " and resid "55 " and name "HG23") (segid " " and resid "57 " and name "HB1 ") OR { 3543} (segid " " and resid "55 " and name "HG21") (segid " " and resid "20 " and name "HB1 ") OR { 3543} (segid " " and resid "55 " and name "HG21") (segid " " and resid "57 " and name "HB1 ") OR { 3543} (segid " " and resid "55 " and name "HG22") (segid " " and resid "20 " and name "HB1 ") ASSI { 3547} (segid " " and resid "56 " and name "HA ") (segid " " and resid "56 " and name "HG ") 5.000 5.000 0.000 peak 3547 weight 0.10000E+01 volume -0.39100E+00 ppm1 4.050 ppm2 1.652 ASSI { 3560} (segid " " and resid "56 " and name "HB1 ") (segid " " and resid "56 " and name "HG ") 5.000 5.000 0.000 peak 3560 weight 0.10000E+01 volume -0.57500E+00 ppm1 1.059 ppm2 1.652 ASSI { 3565} (segid " " and resid "56 " and name "HD13") (segid " " and resid "17 " and name "HG12") 5.000 5.000 0.000 peak 3565 weight 0.10000E+01 volume -0.10900E+01 ppm1 0.414 ppm2 0.651 OR { 3565} (segid " " and resid "56 " and name "HD12") (segid " " and resid "17 " and name "HG12") OR { 3565} (segid " " and resid "56 " and name "HD13") (segid " " and resid "17 " and name "HG11") OR { 3565} (segid " " and resid "56 " and name "HD11") (segid " " and resid "17 " and name "HG12") OR { 3565} (segid " " and resid "56 " and name "HD13") (segid " " and resid "17 " and name "HG13") OR { 3565} (segid " " and resid "56 " and name "HD11") (segid " " and resid "17 " and name "HG11") OR { 3565} (segid " " and resid "56 " and name "HD11") (segid " " and resid "17 " and name "HG13") OR { 3565} (segid " " and resid "56 " and name "HD12") (segid " " and resid "17 " and name "HG13") OR { 3565} (segid " " and resid "56 " and name "HD12") (segid " " and resid "17 " and name "HG11") OR { 3565} (segid " " and resid "56 " and name "HD12") (segid " " and resid "67 " and name "HD12") OR { 3565} (segid " " and resid "56 " and name "HD12") (segid " " and resid "67 " and name "HD13") ASSI { 3571} (segid " " and resid "56 " and name "HD11") (segid " " and resid "26 " and name "HB1 ") 5.000 5.000 0.000 peak 3571 weight 0.10000E+01 volume -0.44800E+00 ppm1 0.414 ppm2 3.574 OR { 3571} (segid " " and resid "56 " and name "HD13") (segid " " and resid "26 " and name "HB1 ") OR { 3571} (segid " " and resid "56 " and name "HD13") (segid " " and resid "23 " and name "HA ") OR { 3571} (segid " " and resid "56 " and name "HD11") (segid " " and resid "23 " and name "HA ") OR { 3571} (segid " " and resid "56 " and name "HD12") (segid " " and resid "23 " and name "HA ") OR { 3571} (segid " " and resid "56 " and name "HD12") (segid " " and resid "26 " and name "HB1 ") ASSI { 3572} (segid " " and resid "56 " and name "HD13") (segid " " and resid "19 " and name "HA ") 5.000 5.000 0.000 peak 3572 weight 0.10000E+01 volume -0.56800E+00 ppm1 0.414 ppm2 4.020 OR { 3572} (segid " " and resid "56 " and name "HD11") (segid " " and resid "19 " and name "HA ") OR { 3572} (segid " " and resid "56 " and name "HD12") (segid " " and resid "19 " and name "HA ") ASSI { 3588} (segid " " and resid "56 " and name "HD22") (segid " " and resid "67 " and name "HG11") 6.000 6.000 0.000 peak 3588 weight 0.10000E+01 volume -0.22300E+00 ppm1 0.308 ppm2 1.520 OR { 3588} (segid " " and resid "56 " and name "HD21") (segid " " and resid "67 " and name "HG11") OR { 3588} (segid " " and resid "56 " and name "HD23") (segid " " and resid "1 " and name "HE1 ") OR { 3588} (segid " " and resid "56 " and name "HD21") (segid " " and resid "1 " and name "HE2 ") OR { 3588} (segid " " and resid "56 " and name "HD22") (segid " " and resid "1 " and name "HE3 ") OR { 3588} (segid " " and resid "56 " and name "HD23") (segid " " and resid "67 " and name "HG11") OR { 3588} (segid " " and resid "56 " and name "HD22") (segid " " and resid "1 " and name "HE1 ") OR { 3588} (segid " " and resid "56 " and name "HD21") (segid " " and resid "1 " and name "HE1 ") OR { 3588} (segid " " and resid "56 " and name "HD22") (segid " " and resid "1 " and name "HE2 ") OR { 3588} (segid " " and resid "56 " and name "HD21") (segid " " and resid "1 " and name "HE3 ") ASSI { 3593} (segid " " and resid "56 " and name "HD22") (segid " " and resid "17 " and name "HB ") 6.000 6.000 0.000 peak 3593 weight 0.10000E+01 volume -0.95000E-01 ppm1 0.295 ppm2 2.100 OR { 3593} (segid " " and resid "56 " and name "HD23") (segid " " and resid "17 " and name "HB ") OR { 3593} (segid " " and resid "56 " and name "HD21") (segid " " and resid "17 " and name "HB ") ASSI { 3592} (segid " " and resid "56 " and name "HD21") (segid " " and resid "21 " and name "HB1 ") 6.000 6.000 0.000 peak 3592 weight 0.10000E+01 volume -0.12100E+00 ppm1 0.308 ppm2 2.601 OR { 3592} (segid " " and resid "56 " and name "HD22") (segid " " and resid "21 " and name "HB1 ") OR { 3592} (segid " " and resid "56 " and name "HD23") (segid " " and resid "21 " and name "HB1 ") OR { 3592} (segid " " and resid "56 " and name "HD21") (segid " " and resid "59 " and name "HB2 ") ASSI { 3591} (segid " " and resid "56 " and name "HD21") (segid " " and resid "21 " and name "HB2 ") 6.000 6.000 0.000 peak 3591 weight 0.10000E+01 volume -0.12700E+00 ppm1 0.308 ppm2 2.917 OR { 3591} (segid " " and resid "56 " and name "HD23") (segid " " and resid "21 " and name "HB2 ") OR { 3591} (segid " " and resid "56 " and name "HD22") (segid " " and resid "21 " and name "HB2 ") ASSI { 3590} (segid " " and resid "56 " and name "HD21") (segid " " and resid "26 " and name "HE2 ") 6.000 6.000 0.000 peak 3590 weight 0.10000E+01 volume -0.21400E+00 ppm1 0.305 ppm2 6.874 OR { 3590} (segid " " and resid "56 " and name "HD22") (segid " " and resid "26 " and name "HE1 ") OR { 3590} (segid " " and resid "56 " and name "HD22") (segid " " and resid "26 " and name "HE2 ") OR { 3590} (segid " " and resid "56 " and name "HD23") (segid " " and resid "26 " and name "HE2 ") OR { 3590} (segid " " and resid "56 " and name "HD23") (segid " " and resid "26 " and name "HE1 ") OR { 3590} (segid " " and resid "56 " and name "HD21") (segid " " and resid "26 " and name "HE1 ") ASSI { 3585} (segid " " and resid "56 " and name "HD22") (segid " " and resid "26 " and name "HD2 ") 5.000 5.000 0.000 peak 3585 weight 0.10000E+01 volume -0.38000E+00 ppm1 0.308 ppm2 7.080 OR { 3585} (segid " " and resid "56 " and name "HD21") (segid " " and resid "26 " and name "HD2 ") OR { 3585} (segid " " and resid "56 " and name "HD23") (segid " " and resid "26 " and name "HD2 ") OR { 3585} (segid " " and resid "56 " and name "HD22") (segid " " and resid "26 " and name "HD1 ") OR { 3585} (segid " " and resid "56 " and name "HD23") (segid " " and resid "26 " and name "HD1 ") ASSI { 3587} (segid " " and resid "56 " and name "HD22") (segid " " and resid "67 " and name "HD12") 5.000 5.000 0.000 peak 3587 weight 0.10000E+01 volume -0.42700E+00 ppm1 0.308 ppm2 0.651 OR { 3587} (segid " " and resid "56 " and name "HD22") (segid " " and resid "17 " and name "HG12") OR { 3587} (segid " " and resid "56 " and name "HD21") (segid " " and resid "67 " and name "HD13") OR { 3587} (segid " " and resid "56 " and name "HD22") (segid " " and resid "17 " and name "HG11") OR { 3587} (segid " " and resid "56 " and name "HD22") (segid " " and resid "67 " and name "HD13") OR { 3587} (segid " " and resid "56 " and name "HD22") (segid " " and resid "67 " and name "HD11") OR { 3587} (segid " " and resid "56 " and name "HD21") (segid " " and resid "17 " and name "HG11") OR { 3587} (segid " " and resid "56 " and name "HD23") (segid " " and resid "67 " and name "HD12") OR { 3587} (segid " " and resid "56 " and name "HD21") (segid " " and resid "67 " and name "HD12") OR { 3587} (segid " " and resid "56 " and name "HD23") (segid " " and resid "17 " and name "HG11") OR { 3587} (segid " " and resid "56 " and name "HD23") (segid " " and resid "67 " and name "HD11") OR { 3587} (segid " " and resid "56 " and name "HD21") (segid " " and resid "67 " and name "HD11") ASSI { 3586} (segid " " and resid "56 " and name "HD23") (segid " " and resid "23 " and name "HG12") 6.000 6.000 0.000 peak 3586 weight 0.10000E+01 volume -0.23600E+00 ppm1 0.308 ppm2 0.835 OR { 3586} (segid " " and resid "56 " and name "HD22") (segid " " and resid "23 " and name "HG13") OR { 3586} (segid " " and resid "56 " and name "HD21") (segid " " and resid "23 " and name "HG12") OR { 3586} (segid " " and resid "56 " and name "HD22") (segid " " and resid "23 " and name "HG11") OR { 3586} (segid " " and resid "56 " and name "HD21") (segid " " and resid "43 " and name "HD13") OR { 3586} (segid " " and resid "56 " and name "HD21") (segid " " and resid "23 " and name "HG11") OR { 3586} (segid " " and resid "56 " and name "HD22") (segid " " and resid "43 " and name "HD12") OR { 3586} (segid " " and resid "56 " and name "HD22") (segid " " and resid "43 " and name "HD13") OR { 3586} (segid " " and resid "56 " and name "HD22") (segid " " and resid "23 " and name "HG12") OR { 3586} (segid " " and resid "56 " and name "HD23") (segid " " and resid "43 " and name "HD11") OR { 3586} (segid " " and resid "56 " and name "HD23") (segid " " and resid "43 " and name "HD13") OR { 3586} (segid " " and resid "56 " and name "HD21") (segid " " and resid "43 " and name "HD12") OR { 3586} (segid " " and resid "56 " and name "HD22") (segid " " and resid "43 " and name "HD11") OR { 3586} (segid " " and resid "56 " and name "HD23") (segid " " and resid "43 " and name "HD12") OR { 3586} (segid " " and resid "56 " and name "HD21") (segid " " and resid "43 " and name "HD11") ASSI { 3596} (segid " " and resid "57 " and name "HA ") (segid " " and resid "19 " and name "HB1 ") 6.000 6.000 0.000 peak 3596 weight 0.10000E+01 volume -0.24700E+00 ppm1 4.287 ppm2 2.337 OR { 3596} (segid " " and resid "57 " and name "HA ") (segid " " and resid "62 " and name "HG2 ") ASSI { 3600} (segid " " and resid "57 " and name "HA ") (segid " " and resid "56 " and name "HB2 ") 6.000 6.000 0.000 peak 3600 weight 0.10000E+01 volume -0.10100E+00 ppm1 4.287 ppm2 1.863 ASSI { 3597} (segid " " and resid "57 " and name "HA ") (segid " " and resid "19 " and name "HA ") 6.000 6.000 0.000 peak 3597 weight 0.10000E+01 volume -0.16800E+00 ppm1 4.287 ppm2 4.024 OR { 3597} (segid " " and resid "57 " and name "HA ") (segid " " and resid "56 " and name "HA ") ASSI { 3617} (segid " " and resid "58 " and name "HB1 ") (segid " " and resid "54 " and name "HD2 ") 6.000 6.000 0.000 peak 3617 weight 0.10000E+01 volume -0.17800E+00 ppm1 2.298 ppm2 3.180 OR { 3617} (segid " " and resid "58 " and name "HB1 ") (segid " " and resid "54 " and name "HD1 ") ASSI { 3618} (segid " " and resid "59 " and name "HA ") (segid " " and resid "59 " and name "HB2 ") 5.000 5.000 0.000 peak 3618 weight 0.10000E+01 volume -0.82500E+00 ppm1 4.511 ppm2 2.627 ASSI { 3619} (segid " " and resid "59 " and name "HA ") (segid " " and resid "58 " and name "HA ") 6.000 6.000 0.000 peak 3619 weight 0.10000E+01 volume -0.15100E+00 ppm1 4.498 ppm2 4.340 OR { 3619} (segid " " and resid "59 " and name "HA ") (segid " " and resid "60 " and name "HA ") ASSI { 3620} (segid " " and resid "59 " and name "HA ") (segid " " and resid "45 " and name "HD2 ") 6.000 6.000 0.000 peak 3620 weight 0.10000E+01 volume -0.13200E+00 ppm1 4.511 ppm2 7.423 OR { 3620} (segid " " and resid "59 " and name "HA ") (segid " " and resid "45 " and name "HD1 ") ASSI { 3631} (segid " " and resid "59 " and name "HB1 ") (segid " " and resid "61 " and name "HG12") 6.000 6.000 0.000 peak 3631 weight 0.10000E+01 volume -0.99000E-01 ppm1 3.510 ppm2 -0.403 ASSI { 3649} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "50 " and name "HG ") 6.000 6.000 0.000 peak 3649 weight 0.10000E+01 volume -0.12300E+00 ppm1 7.265 ppm2 1.178 OR { 3649} (segid " " and resid "59 " and name "HD2 ") (segid " " and resid "50 " and name "HG ") ASSI { 3641} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "61 " and name "HD11") 5.000 5.000 0.000 peak 3641 weight 0.10000E+01 volume -0.30600E+00 ppm1 7.278 ppm2 0.387 OR { 3641} (segid " " and resid "59 " and name "HD2 ") (segid " " and resid "61 " and name "HD11") OR { 3641} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "61 " and name "HD13") OR { 3641} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "61 " and name "HD12") OR { 3641} (segid " " and resid "59 " and name "HD2 ") (segid " " and resid "61 " and name "HD13") ASSI { 3661} (segid " " and resid "59 " and name "HE2 ") (segid " " and resid "54 " and name "HD1 ") 6.000 6.000 0.000 peak 3661 weight 0.10000E+01 volume -0.27900E+00 ppm1 6.856 ppm2 3.180 OR { 3661} (segid " " and resid "59 " and name "HE2 ") (segid " " and resid "54 " and name "HD2 ") OR { 3661} (segid " " and resid "59 " and name "HE2 ") (segid " " and resid "48 " and name "HE1 ") OR { 3661} (segid " " and resid "59 " and name "HE2 ") (segid " " and resid "48 " and name "HE2 ") ASSI { 3670} (segid " " and resid "59 " and name "HE1 ") (segid " " and resid "54 " and name "HA ") 6.000 6.000 0.000 peak 3670 weight 0.10000E+01 volume -0.11400E+00 ppm1 6.856 ppm2 4.814 OR { 3670} (segid " " and resid "59 " and name "HE2 ") (segid " " and resid "54 " and name "HA ") ASSI { 3664} (segid " " and resid "60 " and name "HA ") (segid " " and resid "62 " and name "HG1 ") 6.000 6.000 0.000 peak 3664 weight 0.10000E+01 volume -0.10400E+00 ppm1 4.379 ppm2 2.311 OR { 3664} (segid " " and resid "60 " and name "HA ") (segid " " and resid "62 " and name "HG2 ") ASSI { 3692} (segid " " and resid "61 " and name "HA ") (segid " " and resid "3 " and name "HG12") 6.000 6.000 0.000 peak 3692 weight 0.10000E+01 volume -0.78000E-01 ppm1 3.194 ppm2 0.572 OR { 3692} (segid " " and resid "61 " and name "HA ") (segid " " and resid "3 " and name "HG11") OR { 3692} (segid " " and resid "61 " and name "HA ") (segid " " and resid "3 " and name "HG13") OR { 3692} (segid " " and resid "61 " and name "HA ") (segid " " and resid "50 " and name "HD11") OR { 3692} (segid " " and resid "61 " and name "HA ") (segid " " and resid "50 " and name "HD12") OR { 3692} (segid " " and resid "61 " and name "HA ") (segid " " and resid "50 " and name "HD13") ASSI { 3683} (segid " " and resid "61 " and name "HA ") (segid " " and resid "62 " and name "HG2 ") 6.000 6.000 0.000 peak 3683 weight 0.10000E+01 volume -0.22200E+00 ppm1 3.194 ppm2 2.311 OR { 3683} (segid " " and resid "61 " and name "HA ") (segid " " and resid "62 " and name "HG1 ") ASSI { 3685} (segid " " and resid "61 " and name "HA ") (segid " " and resid "65 " and name "HB1 ") 6.000 6.000 0.000 peak 3685 weight 0.10000E+01 volume -0.15400E+00 ppm1 3.194 ppm2 3.971 ASSI { 3687} (segid " " and resid "61 " and name "HA ") (segid " " and resid "62 " and name "HA ") 6.000 6.000 0.000 peak 3687 weight 0.10000E+01 volume -0.85000E-01 ppm1 3.194 ppm2 4.551 ASSI { 3745} (segid " " and resid "61 " and name "HD11") (segid " " and resid "43 " and name "HD13") 6.000 6.000 0.000 peak 3745 weight 0.10000E+01 volume -0.11600E+00 ppm1 0.400 ppm2 0.809 OR { 3745} (segid " " and resid "61 " and name "HD11") (segid " " and resid "43 " and name "HD12") OR { 3745} (segid " " and resid "61 " and name "HD13") (segid " " and resid "43 " and name "HD11") OR { 3745} (segid " " and resid "61 " and name "HD13") (segid " " and resid "43 " and name "HD12") OR { 3745} (segid " " and resid "61 " and name "HD13") (segid " " and resid "43 " and name "HD13") OR { 3745} (segid " " and resid "61 " and name "HD11") (segid " " and resid "23 " and name "HG13") OR { 3745} (segid " " and resid "61 " and name "HD12") (segid " " and resid "43 " and name "HD11") OR { 3745} (segid " " and resid "61 " and name "HD12") (segid " " and resid "23 " and name "HG12") OR { 3745} (segid " " and resid "61 " and name "HD12") (segid " " and resid "43 " and name "HD13") OR { 3745} (segid " " and resid "61 " and name "HD12") (segid " " and resid "43 " and name "HD12") OR { 3745} (segid " " and resid "61 " and name "HD11") (segid " " and resid "23 " and name "HG12") OR { 3745} (segid " " and resid "61 " and name "HD12") (segid " " and resid "23 " and name "HG13") OR { 3745} (segid " " and resid "61 " and name "HD11") (segid " " and resid "23 " and name "HG11") OR { 3745} (segid " " and resid "61 " and name "HD12") (segid " " and resid "23 " and name "HG11") OR { 3745} (segid " " and resid "61 " and name "HD11") (segid " " and resid "43 " and name "HD11") OR { 3745} (segid " " and resid "61 " and name "HD13") (segid " " and resid "23 " and name "HG12") OR { 3745} (segid " " and resid "61 " and name "HD11") (segid " " and resid "46 " and name "HB2 ") OR { 3745} (segid " " and resid "61 " and name "HD13") (segid " " and resid "46 " and name "HB3 ") OR { 3745} (segid " " and resid "61 " and name "HD13") (segid " " and resid "46 " and name "HB1 ") OR { 3745} (segid " " and resid "61 " and name "HD12") (segid " " and resid "46 " and name "HB3 ") OR { 3745} (segid " " and resid "61 " and name "HD13") (segid " " and resid "23 " and name "HG11") OR { 3745} (segid " " and resid "61 " and name "HD11") (segid " " and resid "46 " and name "HB3 ") ASSI { 6124} (segid " " and resid "61 " and name "HD12") (segid " " and resid "65 " and name "HB1 ") 5.000 5.000 0.000 peak 6124 weight 0.10000E+01 volume -0.47800E+00 ppm1 0.389 ppm2 3.984 OR { 6124} (segid " " and resid "61 " and name "HD13") (segid " " and resid "65 " and name "HB1 ") OR { 6124} (segid " " and resid "61 " and name "HD11") (segid " " and resid "65 " and name "HB1 ") ASSI { 3732} (segid " " and resid "61 " and name "HD13") (segid " " and resid "67 " and name "HD12") 5.000 5.000 0.000 peak 3732 weight 0.10000E+01 volume -0.10480E+01 ppm1 0.400 ppm2 0.703 OR { 3732} (segid " " and resid "61 " and name "HD12") (segid " " and resid "67 " and name "HD11") OR { 3732} (segid " " and resid "61 " and name "HD11") (segid " " and resid "67 " and name "HD13") OR { 3732} (segid " " and resid "61 " and name "HD12") (segid " " and resid "67 " and name "HD13") OR { 3732} (segid " " and resid "61 " and name "HD12") (segid " " and resid "67 " and name "HD12") OR { 3732} (segid " " and resid "61 " and name "HD13") (segid " " and resid "67 " and name "HD11") OR { 3732} (segid " " and resid "61 " and name "HD11") (segid " " and resid "67 " and name "HD11") ASSI { 3741} (segid " " and resid "61 " and name "HD13") (segid " " and resid "67 " and name "HG11") 5.000 5.000 0.000 peak 3741 weight 0.10000E+01 volume -0.32800E+00 ppm1 0.387 ppm2 1.494 OR { 3741} (segid " " and resid "61 " and name "HD11") (segid " " and resid "67 " and name "HG11") OR { 3741} (segid " " and resid "61 " and name "HD12") (segid " " and resid "67 " and name "HG11") OR { 3741} (segid " " and resid "61 " and name "HD13") (segid " " and resid "1 " and name "HE1 ") OR { 3741} (segid " " and resid "61 " and name "HD12") (segid " " and resid "1 " and name "HE3 ") OR { 3741} (segid " " and resid "61 " and name "HD13") (segid " " and resid "1 " and name "HE3 ") OR { 3741} (segid " " and resid "61 " and name "HD12") (segid " " and resid "1 " and name "HE2 ") ASSI { 3722} (segid " " and resid "61 " and name "HG21") (segid " " and resid "56 " and name "HG ") 6.000 6.000 0.000 peak 3722 weight 0.10000E+01 volume -0.89000E-01 ppm1 0.334 ppm2 1.678 OR { 3722} (segid " " and resid "61 " and name "HG22") (segid " " and resid "56 " and name "HG ") OR { 3722} (segid " " and resid "61 " and name "HG23") (segid " " and resid "56 " and name "HG ") ASSI { 3726} (segid " " and resid "61 " and name "HG22") (segid " " and resid "62 " and name "HG2 ") 6.000 6.000 0.000 peak 3726 weight 0.10000E+01 volume -0.79000E-01 ppm1 0.334 ppm2 2.311 OR { 3726} (segid " " and resid "61 " and name "HG23") (segid " " and resid "62 " and name "HG2 ") OR { 3726} (segid " " and resid "61 " and name "HG21") (segid " " and resid "62 " and name "HG2 ") OR { 3726} (segid " " and resid "61 " and name "HG21") (segid " " and resid "62 " and name "HG1 ") OR { 3726} (segid " " and resid "61 " and name "HG22") (segid " " and resid "62 " and name "HG1 ") OR { 3726} (segid " " and resid "61 " and name "HG23") (segid " " and resid "62 " and name "HG1 ") OR { 3726} (segid " " and resid "61 " and name "HG23") (segid " " and resid "19 " and name "HB1 ") OR { 3726} (segid " " and resid "61 " and name "HG21") (segid " " and resid "19 " and name "HB1 ") ASSI { 3720} (segid " " and resid "61 " and name "HG23") (segid " " and resid "3 " and name "HB ") 5.000 5.000 0.000 peak 3720 weight 0.10000E+01 volume -0.30600E+00 ppm1 0.334 ppm2 2.047 OR { 3720} (segid " " and resid "61 " and name "HG21") (segid " " and resid "3 " and name "HB ") OR { 3720} (segid " " and resid "61 " and name "HG22") (segid " " and resid "1 " and name "HG2 ") OR { 3720} (segid " " and resid "61 " and name "HG22") (segid " " and resid "3 " and name "HB ") OR { 3720} (segid " " and resid "61 " and name "HG21") (segid " " and resid "1 " and name "HG2 ") OR { 3720} (segid " " and resid "61 " and name "HG23") (segid " " and resid "1 " and name "HG2 ") OR { 3720} (segid " " and resid "61 " and name "HG22") (segid " " and resid "19 " and name "HG2 ") OR { 3720} (segid " " and resid "61 " and name "HG21") (segid " " and resid "19 " and name "HB2 ") OR { 3720} (segid " " and resid "61 " and name "HG23") (segid " " and resid "19 " and name "HB2 ") OR { 3720} (segid " " and resid "61 " and name "HG23") (segid " " and resid "19 " and name "HG2 ") ASSI { 3748} (segid " " and resid "62 " and name "HA ") (segid " " and resid "62 " and name "HG1 ") 5.000 5.000 0.000 peak 3748 weight 0.10000E+01 volume -0.70900E+00 ppm1 4.551 ppm2 2.311 OR { 3748} (segid " " and resid "62 " and name "HA ") (segid " " and resid "62 " and name "HG2 ") ASSI { 3752} (segid " " and resid "63 " and name "HA ") (segid " " and resid "63 " and name "HB1 ") 3.300 3.300 0.000 peak 3752 weight 0.10000E+01 volume -0.21630E+01 ppm1 3.931 ppm2 1.942 ASSI { 3761} (segid " " and resid "63 " and name "HA ") (segid " " and resid "1 " and name "HG1 ") 5.000 5.000 0.000 peak 3761 weight 0.10000E+01 volume -0.31800E+00 ppm1 3.931 ppm2 2.495 ASSI { 3765} (segid " " and resid "63 " and name "HA ") (segid " " and resid "64 " and name "HA ") 6.000 6.000 0.000 peak 3765 weight 0.10000E+01 volume -0.98000E-01 ppm1 3.931 ppm2 3.154 OR { 3765} (segid " " and resid "63 " and name "HA ") (segid " " and resid "61 " and name "HA ") ASSI { 3762} (segid " " and resid "63 " and name "HA ") (segid " " and resid "1 " and name "HA ") 6.000 6.000 0.000 peak 3762 weight 0.10000E+01 volume -0.29500E+00 ppm1 3.931 ppm2 4.182 OR { 3762} (segid " " and resid "63 " and name "HA ") (segid " " and resid "3 " and name "HA ") ASSI { 3786} (segid " " and resid "63 " and name "HD2 ") (segid " " and resid "63 " and name "HE1 ") 5.000 5.000 0.000 peak 3786 weight 0.10000E+01 volume -0.75600E+00 ppm1 1.718 ppm2 2.996 OR { 3786} (segid " " and resid "63 " and name "HD1 ") (segid " " and resid "63 " and name "HE2 ") OR { 3786} (segid " " and resid "63 " and name "HD2 ") (segid " " and resid "63 " and name "HE2 ") OR { 3786} (segid " " and resid "63 " and name "HD1 ") (segid " " and resid "63 " and name "HE1 ") ASSI { 1855} (segid " " and resid "63 " and name "HD2 ") (segid " " and resid "63 " and name "HG1 ") 3.300 3.300 0.000 peak 1855 weight 0.10000E+01 volume -0.28200E+01 ppm1 1.718 ppm2 1.547 OR { 1855} (segid " " and resid "63 " and name "HD1 ") (segid " " and resid "63 " and name "HG1 ") ASSI { 1854} (segid " " and resid "63 " and name "HE1 ") (segid " " and resid "63 " and name "HB1 ") 6.000 6.000 0.000 peak 1854 weight 0.10000E+01 volume -0.19500E+00 ppm1 3.009 ppm2 1.942 OR { 1854} (segid " " and resid "63 " and name "HE2 ") (segid " " and resid "63 " and name "HB1 ") ASSI { 1853} (segid " " and resid "63 " and name "HE1 ") (segid " " and resid "64 " and name "HG2 ") 6.000 6.000 0.000 peak 1853 weight 0.10000E+01 volume -0.18300E+00 ppm1 3.009 ppm2 2.153 OR { 1853} (segid " " and resid "63 " and name "HE1 ") (segid " " and resid "1 " and name "HB1 ") OR { 1853} (segid " " and resid "63 " and name "HE2 ") (segid " " and resid "64 " and name "HG1 ") OR { 1853} (segid " " and resid "63 " and name "HE2 ") (segid " " and resid "1 " and name "HB1 ") ASSI { 3795} (segid " " and resid "63 " and name "HE1 ") (segid " " and resid "63 " and name "HA ") 6.000 6.000 0.000 peak 3795 weight 0.10000E+01 volume -0.73000E-01 ppm1 3.022 ppm2 3.944 OR { 3795} (segid " " and resid "63 " and name "HE2 ") (segid " " and resid "63 " and name "HA ") ASSI { 3779} (segid " " and resid "63 " and name "HG1 ") (segid " " and resid "63 " and name "HB2 ") 5.000 5.000 0.000 peak 3779 weight 0.10000E+01 volume -0.15880E+01 ppm1 1.533 ppm2 1.784 ASSI { 3787} (segid " " and resid "63 " and name "HG2 ") (segid " " and resid "63 " and name "HB1 ") 5.000 5.000 0.000 peak 3787 weight 0.10000E+01 volume -0.41400E+00 ppm1 1.415 ppm2 1.942 ASSI { 3805} (segid " " and resid "64 " and name "HA ") (segid " " and resid "63 " and name "HA ") 6.000 6.000 0.000 peak 3805 weight 0.10000E+01 volume -0.10200E+00 ppm1 3.154 ppm2 3.944 OR { 3805} (segid " " and resid "64 " and name "HA ") (segid " " and resid "65 " and name "HB1 ") ASSI { 3823} (segid " " and resid "64 " and name "HG2 ") (segid " " and resid "63 " and name "HD1 ") 6.000 6.000 0.000 peak 3823 weight 0.10000E+01 volume -0.13000E+00 ppm1 2.139 ppm2 1.705 OR { 3823} (segid " " and resid "64 " and name "HG1 ") (segid " " and resid "63 " and name "HD2 ") OR { 3823} (segid " " and resid "64 " and name "HG1 ") (segid " " and resid "63 " and name "HD1 ") ASSI { 3834} (segid " " and resid "65 " and name "HB2 ") (segid " " and resid "3 " and name "HG12") 5.000 5.000 0.000 peak 3834 weight 0.10000E+01 volume -0.51900E+00 ppm1 3.694 ppm2 0.572 OR { 3834} (segid " " and resid "65 " and name "HB2 ") (segid " " and resid "3 " and name "HG11") OR { 3834} (segid " " and resid "65 " and name "HB2 ") (segid " " and resid "3 " and name "HG13") ASSI { 3838} (segid " " and resid "65 " and name "HB2 ") (segid " " and resid "3 " and name "HB ") 6.000 6.000 0.000 peak 3838 weight 0.10000E+01 volume -0.13300E+00 ppm1 3.707 ppm2 2.047 ASSI { 3836} (segid " " and resid "65 " and name "HB2 ") (segid " " and resid "45 " and name "HZ ") 6.000 6.000 0.000 peak 3836 weight 0.10000E+01 volume -0.19900E+00 ppm1 3.694 ppm2 7.449 OR { 3836} (segid " " and resid "65 " and name "HB2 ") (segid " " and resid "45 " and name "HD1 ") OR { 3836} (segid " " and resid "65 " and name "HB2 ") (segid " " and resid "45 " and name "HD2 ") ASSI { 3848} (segid " " and resid "66 " and name "HA ") (segid " " and resid "3 " and name "HG12") 6.000 6.000 0.000 peak 3848 weight 0.10000E+01 volume -0.96000E-01 ppm1 5.328 ppm2 0.572 OR { 3848} (segid " " and resid "66 " and name "HA ") (segid " " and resid "3 " and name "HG22") OR { 3848} (segid " " and resid "66 " and name "HA ") (segid " " and resid "3 " and name "HG23") OR { 3848} (segid " " and resid "66 " and name "HA ") (segid " " and resid "3 " and name "HG13") OR { 3848} (segid " " and resid "66 " and name "HA ") (segid " " and resid "3 " and name "HG21") ASSI { 3839} (segid " " and resid "66 " and name "HA ") (segid " " and resid "66 " and name "HG23") 3.300 3.300 0.000 peak 3839 weight 0.10000E+01 volume -0.22240E+01 ppm1 5.328 ppm2 0.941 OR { 3839} (segid " " and resid "66 " and name "HA ") (segid " " and resid "66 " and name "HG22") OR { 3839} (segid " " and resid "66 " and name "HA ") (segid " " and resid "66 " and name "HG21") ASSI { 3847} (segid " " and resid "66 " and name "HA ") (segid " " and resid "12 " and name "HG22") 6.000 6.000 0.000 peak 3847 weight 0.10000E+01 volume -0.18200E+00 ppm1 5.328 ppm2 1.046 OR { 3847} (segid " " and resid "66 " and name "HA ") (segid " " and resid "12 " and name "HG21") OR { 3847} (segid " " and resid "66 " and name "HA ") (segid " " and resid "12 " and name "HG23") ASSI { 3849} (segid " " and resid "66 " and name "HA ") (segid " " and resid "67 " and name "HG11") 6.000 6.000 0.000 peak 3849 weight 0.10000E+01 volume -0.80000E-01 ppm1 5.328 ppm2 1.494 OR { 3849} (segid " " and resid "66 " and name "HA ") (segid " " and resid "6 " and name "HD1 ") OR { 3849} (segid " " and resid "66 " and name "HA ") (segid " " and resid "6 " and name "HD2 ") ASSI { 3850} (segid " " and resid "66 " and name "HA ") (segid " " and resid "67 " and name "HA ") 6.000 6.000 0.000 peak 3850 weight 0.10000E+01 volume -0.75000E-01 ppm1 5.328 ppm2 4.709 ASSI { 3853} (segid " " and resid "66 " and name "HB ") (segid " " and resid "4 " and name "HB2 ") 6.000 6.000 0.000 peak 3853 weight 0.10000E+01 volume -0.12500E+00 ppm1 4.116 ppm2 3.128 OR { 3853} (segid " " and resid "66 " and name "HB ") (segid " " and resid "68 " and name "HB2 ") ASSI { 3865} (segid " " and resid "67 " and name "HB ") (segid " " and resid "50 " and name "HD11") 6.000 6.000 0.000 peak 3865 weight 0.10000E+01 volume -0.18100E+00 ppm1 1.863 ppm2 0.572 OR { 3865} (segid " " and resid "67 " and name "HB ") (segid " " and resid "50 " and name "HD13") OR { 3865} (segid " " and resid "67 " and name "HB ") (segid " " and resid "50 " and name "HD12") OR { 3865} (segid " " and resid "67 " and name "HB ") (segid " " and resid "3 " and name "HG23") OR { 3865} (segid " " and resid "67 " and name "HB ") (segid " " and resid "3 " and name "HG21") OR { 3865} (segid " " and resid "67 " and name "HB ") (segid " " and resid "3 " and name "HG22") ASSI { 3857} (segid " " and resid "67 " and name "HB ") (segid " " and resid "67 " and name "HD11") 5.000 5.000 0.000 peak 3857 weight 0.10000E+01 volume -0.11490E+01 ppm1 1.863 ppm2 0.703 OR { 3857} (segid " " and resid "67 " and name "HB ") (segid " " and resid "67 " and name "HD13") OR { 3857} (segid " " and resid "67 " and name "HB ") (segid " " and resid "67 " and name "HD12") ASSI { 3862} (segid " " and resid "67 " and name "HB ") (segid " " and resid "67 " and name "HA ") 5.000 5.000 0.000 peak 3862 weight 0.10000E+01 volume -0.37900E+00 ppm1 1.850 ppm2 4.709 ASSI { 3901} (segid " " and resid "67 " and name "HD12") (segid " " and resid "61 " and name "HD13") 5.000 5.000 0.000 peak 3901 weight 0.10000E+01 volume -0.19860E+01 ppm1 0.703 ppm2 0.387 OR { 3901} (segid " " and resid "67 " and name "HD11") (segid " " and resid "61 " and name "HD12") OR { 3901} (segid " " and resid "67 " and name "HD13") (segid " " and resid "61 " and name "HD11") OR { 3901} (segid " " and resid "67 " and name "HD13") (segid " " and resid "61 " and name "HD12") OR { 3901} (segid " " and resid "67 " and name "HD12") (segid " " and resid "61 " and name "HG21") OR { 3901} (segid " " and resid "67 " and name "HD12") (segid " " and resid "61 " and name "HD12") OR { 3901} (segid " " and resid "67 " and name "HD11") (segid " " and resid "61 " and name "HD13") OR { 3901} (segid " " and resid "67 " and name "HD11") (segid " " and resid "61 " and name "HD11") OR { 3901} (segid " " and resid "67 " and name "HD13") (segid " " and resid "61 " and name "HG21") OR { 3901} (segid " " and resid "67 " and name "HD11") (segid " " and resid "61 " and name "HG21") OR { 3901} (segid " " and resid "67 " and name "HD12") (segid " " and resid "61 " and name "HD11") OR { 3901} (segid " " and resid "67 " and name "HD13") (segid " " and resid "61 " and name "HG23") OR { 3901} (segid " " and resid "67 " and name "HD11") (segid " " and resid "61 " and name "HG23") OR { 3901} (segid " " and resid "67 " and name "HD13") (segid " " and resid "61 " and name "HG22") OR { 3901} (segid " " and resid "67 " and name "HD12") (segid " " and resid "61 " and name "HG22") ASSI { 3887} (segid " " and resid "67 " and name "HD13") (segid " " and resid "3 " and name "HG21") 3.300 3.300 0.000 peak 3887 weight 0.10000E+01 volume -0.29250E+01 ppm1 0.703 ppm2 0.572 OR { 3887} (segid " " and resid "67 " and name "HD12") (segid " " and resid "3 " and name "HG21") OR { 3887} (segid " " and resid "67 " and name "HD13") (segid " " and resid "3 " and name "HG23") OR { 3887} (segid " " and resid "67 " and name "HD11") (segid " " and resid "3 " and name "HG21") OR { 3887} (segid " " and resid "67 " and name "HD12") (segid " " and resid "3 " and name "HG22") OR { 3887} (segid " " and resid "67 " and name "HD12") (segid " " and resid "3 " and name "HG12") OR { 3887} (segid " " and resid "67 " and name "HD13") (segid " " and resid "3 " and name "HG22") OR { 3887} (segid " " and resid "67 " and name "HD11") (segid " " and resid "3 " and name "HG23") OR { 3887} (segid " " and resid "67 " and name "HD12") (segid " " and resid "3 " and name "HG23") OR { 3887} (segid " " and resid "67 " and name "HD11") (segid " " and resid "3 " and name "HG22") OR { 3887} (segid " " and resid "67 " and name "HD12") (segid " " and resid "3 " and name "HG13") ASSI { 3923} (segid " " and resid "67 " and name "HD12") (segid " " and resid "45 " and name "HB2 ") 6.000 6.000 0.000 peak 3923 weight 0.10000E+01 volume -0.13800E+00 ppm1 0.703 ppm2 2.811 OR { 3923} (segid " " and resid "67 " and name "HD11") (segid " " and resid "45 " and name "HB2 ") OR { 3923} (segid " " and resid "67 " and name "HD13") (segid " " and resid "45 " and name "HB2 ") ASSI { 3912} (segid " " and resid "67 " and name "HD13") (segid " " and resid "67 " and name "HA ") 5.000 5.000 0.000 peak 3912 weight 0.10000E+01 volume -0.44600E+00 ppm1 0.690 ppm2 4.709 OR { 3912} (segid " " and resid "67 " and name "HD11") (segid " " and resid "67 " and name "HA ") OR { 3912} (segid " " and resid "67 " and name "HD12") (segid " " and resid "67 " and name "HA ") ASSI { 3927} (segid " " and resid "67 " and name "HD12") (segid " " and resid "45 " and name "HE2 ") 6.000 6.000 0.000 peak 3927 weight 0.10000E+01 volume -0.12900E+00 ppm1 0.703 ppm2 7.528 OR { 3927} (segid " " and resid "67 " and name "HD12") (segid " " and resid "45 " and name "HE1 ") OR { 3927} (segid " " and resid "67 " and name "HD11") (segid " " and resid "45 " and name "HE2 ") OR { 3927} (segid " " and resid "67 " and name "HD11") (segid " " and resid "45 " and name "HE1 ") ASSI { 3854} (segid " " and resid "67 " and name "HG11") (segid " " and resid "67 " and name "HA ") 5.000 5.000 0.000 peak 3854 weight 0.10000E+01 volume -0.63300E+00 ppm1 1.494 ppm2 4.709 ASSI { 3879} (segid " " and resid "67 " and name "HG12") (segid " " and resid "67 " and name "HA ") 5.000 5.000 0.000 peak 3879 weight 0.10000E+01 volume -0.35400E+00 ppm1 1.178 ppm2 4.709 ASSI { 3894} (segid " " and resid "67 " and name "HG21") (segid " " and resid "43 " and name "HB2 ") 5.000 5.000 0.000 peak 3894 weight 0.10000E+01 volume -0.50900E+00 ppm1 0.980 ppm2 1.731 OR { 3894} (segid " " and resid "67 " and name "HG23") (segid " " and resid "43 " and name "HB2 ") OR { 3894} (segid " " and resid "67 " and name "HG22") (segid " " and resid "43 " and name "HB2 ") ASSI { 3886} (segid " " and resid "67 " and name "HG21") (segid " " and resid "67 " and name "HA ") 5.000 5.000 0.000 peak 3886 weight 0.10000E+01 volume -0.13400E+01 ppm1 0.980 ppm2 4.709 OR { 3886} (segid " " and resid "67 " and name "HG22") (segid " " and resid "67 " and name "HA ") OR { 3886} (segid " " and resid "67 " and name "HG23") (segid " " and resid "67 " and name "HA ") ASSI { 3904} (segid " " and resid "67 " and name "HG22") (segid " " and resid "68 " and name "HD2 ") 6.000 6.000 0.000 peak 3904 weight 0.10000E+01 volume -0.10000E+00 ppm1 0.980 ppm2 7.054 OR { 3904} (segid " " and resid "67 " and name "HG23") (segid " " and resid "68 " and name "HD2 ") OR { 3904} (segid " " and resid "67 " and name "HG22") (segid " " and resid "26 " and name "HD2 ") OR { 3904} (segid " " and resid "67 " and name "HG23") (segid " " and resid "26 " and name "HD2 ") OR { 3904} (segid " " and resid "67 " and name "HG21") (segid " " and resid "26 " and name "HD2 ") OR { 3904} (segid " " and resid "67 " and name "HG21") (segid " " and resid "26 " and name "HD1 ") OR { 3904} (segid " " and resid "67 " and name "HG22") (segid " " and resid "26 " and name "HD1 ") OR { 3904} (segid " " and resid "67 " and name "HG23") (segid " " and resid "26 " and name "HD1 ") ASSI { 3893} (segid " " and resid "67 " and name "HG22") (segid " " and resid "50 " and name "HD21") 6.000 6.000 0.000 peak 3893 weight 0.10000E+01 volume -0.22000E+00 ppm1 0.980 ppm2 0.150 OR { 3893} (segid " " and resid "67 " and name "HG22") (segid " " and resid "50 " and name "HD23") OR { 3893} (segid " " and resid "67 " and name "HG22") (segid " " and resid "50 " and name "HD22") OR { 3893} (segid " " and resid "67 " and name "HG23") (segid " " and resid "50 " and name "HD21") OR { 3893} (segid " " and resid "67 " and name "HG23") (segid " " and resid "50 " and name "HD23") OR { 3893} (segid " " and resid "67 " and name "HG21") (segid " " and resid "50 " and name "HD23") ASSI { 3889} (segid " " and resid "67 " and name "HG21") (segid " " and resid "50 " and name "HD11") 5.000 5.000 0.000 peak 3889 weight 0.10000E+01 volume -0.97900E+00 ppm1 0.980 ppm2 0.572 OR { 3889} (segid " " and resid "67 " and name "HG23") (segid " " and resid "50 " and name "HD13") OR { 3889} (segid " " and resid "67 " and name "HG21") (segid " " and resid "50 " and name "HD13") OR { 3889} (segid " " and resid "67 " and name "HG22") (segid " " and resid "50 " and name "HD11") OR { 3889} (segid " " and resid "67 " and name "HG23") (segid " " and resid "50 " and name "HD11") OR { 3889} (segid " " and resid "67 " and name "HG22") (segid " " and resid "50 " and name "HD13") OR { 3889} (segid " " and resid "67 " and name "HG22") (segid " " and resid "50 " and name "HD12") ASSI { 3874} (segid " " and resid "67 " and name "HG22") (segid " " and resid "5 " and name "HD13") 3.300 3.300 0.000 peak 3874 weight 0.10000E+01 volume -0.30400E+01 ppm1 0.980 ppm2 0.756 OR { 3874} (segid " " and resid "67 " and name "HG22") (segid " " and resid "5 " and name "HD12") OR { 3874} (segid " " and resid "67 " and name "HG21") (segid " " and resid "5 " and name "HD11") OR { 3874} (segid " " and resid "67 " and name "HG21") (segid " " and resid "43 " and name "HD22") OR { 3874} (segid " " and resid "67 " and name "HG22") (segid " " and resid "5 " and name "HD11") OR { 3874} (segid " " and resid "67 " and name "HG22") (segid " " and resid "43 " and name "HD12") OR { 3874} (segid " " and resid "67 " and name "HG21") (segid " " and resid "43 " and name "HD23") OR { 3874} (segid " " and resid "67 " and name "HG21") (segid " " and resid "5 " and name "HD12") OR { 3874} (segid " " and resid "67 " and name "HG22") (segid " " and resid "43 " and name "HD23") OR { 3874} (segid " " and resid "67 " and name "HG21") (segid " " and resid "5 " and name "HD13") OR { 3874} (segid " " and resid "67 " and name "HG23") (segid " " and resid "5 " and name "HD12") OR { 3874} (segid " " and resid "67 " and name "HG23") (segid " " and resid "5 " and name "HD13") OR { 3874} (segid " " and resid "67 " and name "HG23") (segid " " and resid "43 " and name "HD21") OR { 3874} (segid " " and resid "67 " and name "HG23") (segid " " and resid "5 " and name "HD11") ASSI { 3933} (segid " " and resid "68 " and name "HA ") (segid " " and resid "5 " and name "HD12") 6.000 6.000 0.000 peak 3933 weight 0.10000E+01 volume -0.21300E+00 ppm1 4.999 ppm2 0.782 OR { 3933} (segid " " and resid "68 " and name "HA ") (segid " " and resid "5 " and name "HD11") OR { 3933} (segid " " and resid "68 " and name "HA ") (segid " " and resid "5 " and name "HD13") OR { 3933} (segid " " and resid "68 " and name "HA ") (segid " " and resid "70 " and name "HG22") ASSI { 3939} (segid " " and resid "68 " and name "HA ") (segid " " and resid "6 " and name "HD2 ") 6.000 6.000 0.000 peak 3939 weight 0.10000E+01 volume -0.10000E+00 ppm1 4.999 ppm2 1.520 OR { 3939} (segid " " and resid "68 " and name "HA ") (segid " " and resid "6 " and name "HD1 ") ASSI { 3936} (segid " " and resid "68 " and name "HA ") (segid " " and resid "69 " and name "HB1 ") 6.000 6.000 0.000 peak 3936 weight 0.10000E+01 volume -0.21700E+00 ppm1 4.999 ppm2 1.810 OR { 3936} (segid " " and resid "68 " and name "HA ") (segid " " and resid "67 " and name "HB ") OR { 3936} (segid " " and resid "68 " and name "HA ") (segid " " and resid "44 " and name "HB ") ASSI { 3938} (segid " " and resid "68 " and name "HA ") (segid " " and resid "5 " and name "HD22") 6.000 6.000 0.000 peak 3938 weight 0.10000E+01 volume -0.17100E+00 ppm1 4.999 ppm2 0.703 OR { 3938} (segid " " and resid "68 " and name "HA ") (segid " " and resid "5 " and name "HD21") OR { 3938} (segid " " and resid "68 " and name "HA ") (segid " " and resid "5 " and name "HD23") OR { 3938} (segid " " and resid "68 " and name "HA ") (segid " " and resid "44 " and name "HD11") OR { 3938} (segid " " and resid "68 " and name "HA ") (segid " " and resid "44 " and name "HD12") OR { 3938} (segid " " and resid "68 " and name "HA ") (segid " " and resid "44 " and name "HD13") OR { 3938} (segid " " and resid "68 " and name "HA ") (segid " " and resid "44 " and name "HG23") OR { 3938} (segid " " and resid "68 " and name "HA ") (segid " " and resid "67 " and name "HD11") OR { 3938} (segid " " and resid "68 " and name "HA ") (segid " " and resid "67 " and name "HD12") OR { 3938} (segid " " and resid "68 " and name "HA ") (segid " " and resid "67 " and name "HD13") ASSI { 3932} (segid " " and resid "68 " and name "HA ") (segid " " and resid "67 " and name "HG23") 5.000 5.000 0.000 peak 3932 weight 0.10000E+01 volume -0.35900E+00 ppm1 4.999 ppm2 0.941 OR { 3932} (segid " " and resid "68 " and name "HA ") (segid " " and resid "67 " and name "HG21") OR { 3932} (segid " " and resid "68 " and name "HA ") (segid " " and resid "67 " and name "HG22") OR { 3932} (segid " " and resid "68 " and name "HA ") (segid " " and resid "66 " and name "HG23") OR { 3932} (segid " " and resid "68 " and name "HA ") (segid " " and resid "66 " and name "HG22") OR { 3932} (segid " " and resid "68 " and name "HA ") (segid " " and resid "66 " and name "HG21") ASSI { 3934} (segid " " and resid "68 " and name "HA ") (segid " " and resid "67 " and name "HA ") 6.000 6.000 0.000 peak 3934 weight 0.10000E+01 volume -0.13000E+00 ppm1 4.999 ppm2 4.709 OR { 3934} (segid " " and resid "68 " and name "HA ") (segid " " and resid "7 " and name "HA ") ASSI { 3953} (segid " " and resid "68 " and name "HB1 ") (segid " " and resid "70 " and name "HG12") 6.000 6.000 0.000 peak 3953 weight 0.10000E+01 volume -0.28300E+00 ppm1 3.088 ppm2 0.941 OR { 3953} (segid " " and resid "68 " and name "HB2 ") (segid " " and resid "67 " and name "HG23") OR { 3953} (segid " " and resid "68 " and name "HB2 ") (segid " " and resid "67 " and name "HG22") OR { 3953} (segid " " and resid "68 " and name "HB2 ") (segid " " and resid "67 " and name "HG21") OR { 3953} (segid " " and resid "68 " and name "HB2 ") (segid " " and resid "70 " and name "HG12") OR { 3953} (segid " " and resid "68 " and name "HB1 ") (segid " " and resid "70 " and name "HG11") OR { 3953} (segid " " and resid "68 " and name "HB2 ") (segid " " and resid "70 " and name "HG11") OR { 3953} (segid " " and resid "68 " and name "HB1 ") (segid " " and resid "67 " and name "HG23") OR { 3953} (segid " " and resid "68 " and name "HB1 ") (segid " " and resid "70 " and name "HG13") OR { 3953} (segid " " and resid "68 " and name "HB2 ") (segid " " and resid "70 " and name "HG13") OR { 3953} (segid " " and resid "68 " and name "HB1 ") (segid " " and resid "67 " and name "HG21") OR { 3953} (segid " " and resid "68 " and name "HB1 ") (segid " " and resid "8 " and name "HD23") OR { 3953} (segid " " and resid "68 " and name "HB1 ") (segid " " and resid "8 " and name "HD22") ASSI { 3957} (segid " " and resid "68 " and name "HB1 ") (segid " " and resid "6 " and name "HB2 ") 6.000 6.000 0.000 peak 3957 weight 0.10000E+01 volume -0.19600E+00 ppm1 3.075 ppm2 1.362 OR { 3957} (segid " " and resid "68 " and name "HB2 ") (segid " " and resid "44 " and name "HG11") OR { 3957} (segid " " and resid "68 " and name "HB1 ") (segid " " and resid "44 " and name "HG11") ASSI { 3950} (segid " " and resid "68 " and name "HD2 ") (segid " " and resid "44 " and name "HB ") 6.000 6.000 0.000 peak 3950 weight 0.10000E+01 volume -0.11400E+00 ppm1 7.067 ppm2 1.784 ASSI { 3949} (segid " " and resid "68 " and name "HD2 ") (segid " " and resid "6 " and name "HB2 ") 6.000 6.000 0.000 peak 3949 weight 0.10000E+01 volume -0.13200E+00 ppm1 7.067 ppm2 1.362 OR { 3949} (segid " " and resid "68 " and name "HD2 ") (segid " " and resid "6 " and name "HG1 ") ASSI { 3948} (segid " " and resid "68 " and name "HD2 ") (segid " " and resid "67 " and name "HA ") 6.000 6.000 0.000 peak 3948 weight 0.10000E+01 volume -0.14400E+00 ppm1 7.054 ppm2 4.709 ASSI { 3951} (segid " " and resid "68 " and name "HD2 ") (segid " " and resid "45 " and name "HA ") 6.000 6.000 0.000 peak 3951 weight 0.10000E+01 volume -0.81000E-01 ppm1 7.067 ppm2 5.209 ASSI { 3955} (segid " " and resid "69 " and name "HA ") (segid " " and resid "43 " and name "HD21") 3.300 3.300 0.000 peak 3955 weight 0.10000E+01 volume -0.21060E+01 ppm1 5.078 ppm2 0.756 OR { 3955} (segid " " and resid "69 " and name "HA ") (segid " " and resid "43 " and name "HD22") OR { 3955} (segid " " and resid "69 " and name "HA ") (segid " " and resid "43 " and name "HD23") OR { 3955} (segid " " and resid "69 " and name "HA ") (segid " " and resid "5 " and name "HD12") ASSI { 3963} (segid " " and resid "69 " and name "HA ") (segid " " and resid "67 " and name "HG23") 5.000 5.000 0.000 peak 3963 weight 0.10000E+01 volume -0.32000E+00 ppm1 5.078 ppm2 0.993 OR { 3963} (segid " " and resid "69 " and name "HA ") (segid " " and resid "67 " and name "HG22") OR { 3963} (segid " " and resid "69 " and name "HA ") (segid " " and resid "67 " and name "HG21") OR { 3963} (segid " " and resid "69 " and name "HA ") (segid " " and resid "43 " and name "HB1 ") OR { 3963} (segid " " and resid "69 " and name "HA ") (segid " " and resid "8 " and name "HD23") OR { 3963} (segid " " and resid "69 " and name "HA ") (segid " " and resid "8 " and name "HD22") OR { 3963} (segid " " and resid "69 " and name "HA ") (segid " " and resid "8 " and name "HD21") ASSI { 3969} (segid " " and resid "69 " and name "HB1 ") (segid " " and resid "7 " and name "HA ") 5.000 5.000 0.000 peak 3969 weight 0.10000E+01 volume -0.57600E+00 ppm1 1.836 ppm2 4.709 ASSI { 3974} (segid " " and resid "69 " and name "HB2 ") (segid " " and resid "7 " and name "HA ") 6.000 6.000 0.000 peak 3974 weight 0.10000E+01 volume -0.23500E+00 ppm1 1.244 ppm2 4.709 ASSI { 3990} (segid " " and resid "69 " and name "HD11") (segid " " and resid "41 " and name "HB2 ") 5.000 5.000 0.000 peak 3990 weight 0.10000E+01 volume -0.59100E+00 ppm1 0.848 ppm2 1.916 OR { 3990} (segid " " and resid "69 " and name "HD13") (segid " " and resid "41 " and name "HB2 ") OR { 3990} (segid " " and resid "69 " and name "HD12") (segid " " and resid "41 " and name "HB2 ") OR { 3990} (segid " " and resid "69 " and name "HD12") (segid " " and resid "5 " and name "HB1 ") OR { 3990} (segid " " and resid "69 " and name "HD13") (segid " " and resid "5 " and name "HB1 ") OR { 3990} (segid " " and resid "69 " and name "HD11") (segid " " and resid "5 " and name "HB1 ") OR { 3990} (segid " " and resid "69 " and name "HD12") (segid " " and resid "31 " and name "HB2 ") OR { 3990} (segid " " and resid "69 " and name "HD12") (segid " " and resid "8 " and name "HB2 ") ASSI { 3994} (segid " " and resid "69 " and name "HD12") (segid " " and resid "70 " and name "HA ") 6.000 6.000 0.000 peak 3994 weight 0.10000E+01 volume -0.16900E+00 ppm1 0.861 ppm2 4.392 OR { 3994} (segid " " and resid "69 " and name "HD13") (segid " " and resid "42 " and name "HA ") OR { 3994} (segid " " and resid "69 " and name "HD13") (segid " " and resid "70 " and name "HA ") OR { 3994} (segid " " and resid "69 " and name "HD12") (segid " " and resid "42 " and name "HA ") OR { 3994} (segid " " and resid "69 " and name "HD11") (segid " " and resid "70 " and name "HA ") OR { 3994} (segid " " and resid "69 " and name "HD11") (segid " " and resid "42 " and name "HA ") OR { 3994} (segid " " and resid "69 " and name "HD11") (segid " " and resid "27 " and name "HA ") ASSI { 3993} (segid " " and resid "69 " and name "HD13") (segid " " and resid "7 " and name "HA ") 6.000 6.000 0.000 peak 3993 weight 0.10000E+01 volume -0.23900E+00 ppm1 0.848 ppm2 4.709 OR { 3993} (segid " " and resid "69 " and name "HD12") (segid " " and resid "7 " and name "HA ") OR { 3993} (segid " " and resid "69 " and name "HD11") (segid " " and resid "7 " and name "HA ") ASSI { 4009} (segid " " and resid "69 " and name "HD23") (segid " " and resid "41 " and name "HG1 ") 6.000 6.000 0.000 peak 4009 weight 0.10000E+01 volume -0.65000E-01 ppm1 0.782 ppm2 2.495 OR { 4009} (segid " " and resid "69 " and name "HD21") (segid " " and resid "41 " and name "HG1 ") ASSI { 4005} (segid " " and resid "69 " and name "HD22") (segid " " and resid "30 " and name "HD13") 6.000 6.000 0.000 peak 4005 weight 0.10000E+01 volume -0.26900E+00 ppm1 0.796 ppm2 0.045 OR { 4005} (segid " " and resid "69 " and name "HD22") (segid " " and resid "30 " and name "HD12") OR { 4005} (segid " " and resid "69 " and name "HD23") (segid " " and resid "30 " and name "HD13") OR { 4005} (segid " " and resid "69 " and name "HD22") (segid " " and resid "30 " and name "HD11") OR { 4005} (segid " " and resid "69 " and name "HD21") (segid " " and resid "30 " and name "HD13") OR { 4005} (segid " " and resid "69 " and name "HD23") (segid " " and resid "30 " and name "HD11") ASSI { 4006} (segid " " and resid "69 " and name "HD23") (segid " " and resid "41 " and name "HG2 ") 5.000 5.000 0.000 peak 4006 weight 0.10000E+01 volume -0.40100E+00 ppm1 0.796 ppm2 1.626 OR { 4006} (segid " " and resid "69 " and name "HD22") (segid " " and resid "41 " and name "HG2 ") OR { 4006} (segid " " and resid "69 " and name "HD22") (segid " " and resid "34 " and name "HB2 ") OR { 4006} (segid " " and resid "69 " and name "HD21") (segid " " and resid "34 " and name "HB2 ") OR { 4006} (segid " " and resid "69 " and name "HD23") (segid " " and resid "34 " and name "HB2 ") OR { 4006} (segid " " and resid "69 " and name "HD21") (segid " " and resid "41 " and name "HG2 ") OR { 4006} (segid " " and resid "69 " and name "HD21") (segid " " and resid "71 " and name "HG ") OR { 4006} (segid " " and resid "69 " and name "HD22") (segid " " and resid "71 " and name "HG ") OR { 4006} (segid " " and resid "69 " and name "HD21") (segid " " and resid "71 " and name "HB2 ") OR { 4006} (segid " " and resid "69 " and name "HD23") (segid " " and resid "71 " and name "HG ") OR { 4006} (segid " " and resid "69 " and name "HD23") (segid " " and resid "71 " and name "HB2 ") ASSI { 4010} (segid " " and resid "69 " and name "HD21") (segid " " and resid "34 " and name "HB1 ") 6.000 6.000 0.000 peak 4010 weight 0.10000E+01 volume -0.97000E-01 ppm1 0.796 ppm2 2.284 OR { 4010} (segid " " and resid "69 " and name "HD23") (segid " " and resid "34 " and name "HB1 ") OR { 4010} (segid " " and resid "69 " and name "HD22") (segid " " and resid "34 " and name "HB1 ") ASSI { 4008} (segid " " and resid "69 " and name "HD23") (segid " " and resid "41 " and name "HA ") 6.000 6.000 0.000 peak 4008 weight 0.10000E+01 volume -0.13600E+00 ppm1 0.796 ppm2 4.103 OR { 4008} (segid " " and resid "69 " and name "HD22") (segid " " and resid "41 " and name "HA ") OR { 4008} (segid " " and resid "69 " and name "HD21") (segid " " and resid "41 " and name "HA ") ASSI { 4002} (segid " " and resid "69 " and name "HD22") (segid " " and resid "7 " and name "HA ") 5.000 5.000 0.000 peak 4002 weight 0.10000E+01 volume -0.49900E+00 ppm1 0.796 ppm2 4.709 OR { 4002} (segid " " and resid "69 " and name "HD21") (segid " " and resid "7 " and name "HA ") ASSI { 3873} (segid " " and resid "69 " and name "HG ") (segid " " and resid "69 " and name "HD21") 5.000 5.000 0.000 peak 3873 weight 0.10000E+01 volume -0.15950E+01 ppm1 1.428 ppm2 0.782 OR { 3873} (segid " " and resid "69 " and name "HG ") (segid " " and resid "69 " and name "HD22") OR { 3873} (segid " " and resid "69 " and name "HG ") (segid " " and resid "69 " and name "HD23") OR { 3873} (segid " " and resid "69 " and name "HG ") (segid " " and resid "36 " and name "HD12") ASSI { 4013} (segid " " and resid "70 " and name "HA ") (segid " " and resid "70 " and name "HB ") 5.000 5.000 0.000 peak 4013 weight 0.10000E+01 volume -0.15650E+01 ppm1 4.379 ppm2 2.074 ASSI { 4007} (segid " " and resid "70 " and name "HA ") (segid " " and resid "8 " and name "HD23") 3.300 3.300 0.000 peak 4007 weight 0.10000E+01 volume -0.22360E+01 ppm1 4.392 ppm2 0.941 OR { 4007} (segid " " and resid "70 " and name "HA ") (segid " " and resid "8 " and name "HD21") OR { 4007} (segid " " and resid "70 " and name "HA ") (segid " " and resid "70 " and name "HG12") OR { 4007} (segid " " and resid "70 " and name "HA ") (segid " " and resid "70 " and name "HG11") OR { 4007} (segid " " and resid "70 " and name "HA ") (segid " " and resid "70 " and name "HG13") ASSI { 4018} (segid " " and resid "70 " and name "HA ") (segid " " and resid "71 " and name "HG ") 6.000 6.000 0.000 peak 4018 weight 0.10000E+01 volume -0.18100E+00 ppm1 4.379 ppm2 1.652 OR { 4018} (segid " " and resid "70 " and name "HA ") (segid " " and resid "73 " and name "HB1 ") OR { 4018} (segid " " and resid "70 " and name "HA ") (segid " " and resid "73 " and name "HG ") OR { 4018} (segid " " and resid "70 " and name "HA ") (segid " " and resid "74 " and name "HG1 ") ASSI { 4019} (segid " " and resid "70 " and name "HA ") (segid " " and resid "69 " and name "HA ") 6.000 6.000 0.000 peak 4019 weight 0.10000E+01 volume -0.93000E-01 ppm1 4.392 ppm2 5.051 ASSI { 4029} (segid " " and resid "70 " and name "HB ") (segid " " and resid "42 " and name "HG2 ") 6.000 6.000 0.000 peak 4029 weight 0.10000E+01 volume -0.12200E+00 ppm1 2.087 ppm2 1.283 ASSI { 4023} (segid " " and resid "70 " and name "HB ") (segid " " and resid "42 " and name "HB2 ") 5.000 5.000 0.000 peak 4023 weight 0.10000E+01 volume -0.47100E+00 ppm1 2.074 ppm2 1.494 ASSI { 4031} (segid " " and resid "70 " and name "HG21") (segid " " and resid "70 " and name "HG13") 3.300 3.300 0.000 peak 4031 weight 0.10000E+01 volume -0.27090E+01 ppm1 0.809 ppm2 0.941 OR { 4031} (segid " " and resid "70 " and name "HG22") (segid " " and resid "70 " and name "HG11") OR { 4031} (segid " " and resid "70 " and name "HG23") (segid " " and resid "70 " and name "HG11") OR { 4031} (segid " " and resid "70 " and name "HG21") (segid " " and resid "70 " and name "HG11") OR { 4031} (segid " " and resid "70 " and name "HG23") (segid " " and resid "70 " and name "HG13") OR { 4031} (segid " " and resid "70 " and name "HG23") (segid " " and resid "70 " and name "HG12") OR { 4031} (segid " " and resid "70 " and name "HG22") (segid " " and resid "70 " and name "HG12") OR { 4031} (segid " " and resid "70 " and name "HG22") (segid " " and resid "70 " and name "HG13") OR { 4031} (segid " " and resid "70 " and name "HG21") (segid " " and resid "70 " and name "HG12") ASSI { 4041} (segid " " and resid "70 " and name "HG22") (segid " " and resid "44 " and name "HG12") 5.000 5.000 0.000 peak 4041 weight 0.10000E+01 volume -0.60400E+00 ppm1 0.809 ppm2 1.072 OR { 4041} (segid " " and resid "70 " and name "HG21") (segid " " and resid "44 " and name "HG12") OR { 4041} (segid " " and resid "70 " and name "HG23") (segid " " and resid "44 " and name "HG12") ASSI { 4045} (segid " " and resid "70 " and name "HG22") (segid " " and resid "42 " and name "HG2 ") 5.000 5.000 0.000 peak 4045 weight 0.10000E+01 volume -0.45000E+00 ppm1 0.809 ppm2 1.283 OR { 4045} (segid " " and resid "70 " and name "HG23") (segid " " and resid "42 " and name "HG2 ") ASSI { 4049} (segid " " and resid "70 " and name "HG21") (segid " " and resid "44 " and name "HG11") 5.000 5.000 0.000 peak 4049 weight 0.10000E+01 volume -0.52900E+00 ppm1 0.809 ppm2 1.362 OR { 4049} (segid " " and resid "70 " and name "HG23") (segid " " and resid "44 " and name "HG11") OR { 4049} (segid " " and resid "70 " and name "HG22") (segid " " and resid "44 " and name "HG11") ASSI { 4039} (segid " " and resid "70 " and name "HG21") (segid " " and resid "42 " and name "HB2 ") 5.000 5.000 0.000 peak 4039 weight 0.10000E+01 volume -0.69100E+00 ppm1 0.809 ppm2 1.494 OR { 4039} (segid " " and resid "70 " and name "HG22") (segid " " and resid "42 " and name "HB2 ") OR { 4039} (segid " " and resid "70 " and name "HG23") (segid " " and resid "42 " and name "HB2 ") OR { 4039} (segid " " and resid "70 " and name "HG21") (segid " " and resid "42 " and name "HG1 ") OR { 4039} (segid " " and resid "70 " and name "HG22") (segid " " and resid "42 " and name "HG1 ") ASSI { 4040} (segid " " and resid "70 " and name "HG23") (segid " " and resid "42 " and name "HB1 ") 5.000 5.000 0.000 peak 4040 weight 0.10000E+01 volume -0.70200E+00 ppm1 0.809 ppm2 1.705 OR { 4040} (segid " " and resid "70 " and name "HG22") (segid " " and resid "42 " and name "HB1 ") ASSI { 4050} (segid " " and resid "70 " and name "HG21") (segid " " and resid "44 " and name "HB ") 6.000 6.000 0.000 peak 4050 weight 0.10000E+01 volume -0.28700E+00 ppm1 0.809 ppm2 1.784 OR { 4050} (segid " " and resid "70 " and name "HG23") (segid " " and resid "44 " and name "HB ") OR { 4050} (segid " " and resid "70 " and name "HG22") (segid " " and resid "44 " and name "HB ") OR { 4050} (segid " " and resid "70 " and name "HG22") (segid " " and resid "69 " and name "HB1 ") OR { 4050} (segid " " and resid "70 " and name "HG23") (segid " " and resid "69 " and name "HB1 ") OR { 4050} (segid " " and resid "70 " and name "HG21") (segid " " and resid "69 " and name "HB1 ") OR { 4050} (segid " " and resid "70 " and name "HG22") (segid " " and resid "74 " and name "HB2 ") ASSI { 4072} (segid " " and resid "71 " and name "HB1 ") (segid " " and resid "71 " and name "HD23") 5.000 5.000 0.000 peak 4072 weight 0.10000E+01 volume -0.12110E+01 ppm1 1.586 ppm2 0.888 OR { 4072} (segid " " and resid "71 " and name "HB1 ") (segid " " and resid "71 " and name "HD22") OR { 4072} (segid " " and resid "71 " and name "HB2 ") (segid " " and resid "71 " and name "HD21") OR { 4072} (segid " " and resid "71 " and name "HB2 ") (segid " " and resid "71 " and name "HD22") OR { 4072} (segid " " and resid "71 " and name "HB2 ") (segid " " and resid "71 " and name "HD23") OR { 4072} (segid " " and resid "71 " and name "HB1 ") (segid " " and resid "71 " and name "HD21") OR { 4072} (segid " " and resid "71 " and name "HB1 ") (segid " " and resid "73 " and name "HD23") OR { 4072} (segid " " and resid "71 " and name "HB1 ") (segid " " and resid "73 " and name "HD12") ASSI { 4071} (segid " " and resid "71 " and name "HB2 ") (segid " " and resid "71 " and name "HD13") 5.000 5.000 0.000 peak 4071 weight 0.10000E+01 volume -0.14020E+01 ppm1 1.599 ppm2 0.993 OR { 4071} (segid " " and resid "71 " and name "HB2 ") (segid " " and resid "8 " and name "HD11") OR { 4071} (segid " " and resid "71 " and name "HB2 ") (segid " " and resid "8 " and name "HD12") OR { 4071} (segid " " and resid "71 " and name "HB1 ") (segid " " and resid "71 " and name "HD11") OR { 4071} (segid " " and resid "71 " and name "HB1 ") (segid " " and resid "71 " and name "HD12") OR { 4071} (segid " " and resid "71 " and name "HB1 ") (segid " " and resid "71 " and name "HD13") OR { 4071} (segid " " and resid "71 " and name "HB2 ") (segid " " and resid "71 " and name "HD11") OR { 4071} (segid " " and resid "71 " and name "HB2 ") (segid " " and resid "71 " and name "HD12") ASSI { 4060} (segid " " and resid "71 " and name "HD11") (segid " " and resid "40 " and name "HG2 ") 6.000 6.000 0.000 peak 4060 weight 0.10000E+01 volume -0.14700E+00 ppm1 0.980 ppm2 2.363 OR { 4060} (segid " " and resid "71 " and name "HD12") (segid " " and resid "40 " and name "HG2 ") OR { 4060} (segid " " and resid "71 " and name "HD13") (segid " " and resid "40 " and name "HG2 ") OR { 4060} (segid " " and resid "71 " and name "HD13") (segid " " and resid "40 " and name "HG1 ") ASSI { 4059} (segid " " and resid "71 " and name "HD13") (segid " " and resid "69 " and name "HG ") 6.000 6.000 0.000 peak 4059 weight 0.10000E+01 volume -0.15900E+00 ppm1 0.980 ppm2 1.441 OR { 4059} (segid " " and resid "71 " and name "HD11") (segid " " and resid "69 " and name "HG ") OR { 4059} (segid " " and resid "71 " and name "HD11") (segid " " and resid "36 " and name "HB ") OR { 4059} (segid " " and resid "71 " and name "HD12") (segid " " and resid "69 " and name "HG ") OR { 4059} (segid " " and resid "71 " and name "HD13") (segid " " and resid "36 " and name "HB ") ASSI { 4052} (segid " " and resid "71 " and name "HD11") (segid " " and resid "71 " and name "HB1 ") 3.300 3.300 0.000 peak 4052 weight 0.10000E+01 volume -0.27420E+01 ppm1 0.980 ppm2 1.626 OR { 4052} (segid " " and resid "71 " and name "HD12") (segid " " and resid "71 " and name "HB1 ") OR { 4052} (segid " " and resid "71 " and name "HD13") (segid " " and resid "71 " and name "HB1 ") OR { 4052} (segid " " and resid "71 " and name "HD11") (segid " " and resid "71 " and name "HB2 ") OR { 4052} (segid " " and resid "71 " and name "HD13") (segid " " and resid "71 " and name "HG ") OR { 4052} (segid " " and resid "71 " and name "HD12") (segid " " and resid "71 " and name "HG ") OR { 4052} (segid " " and resid "71 " and name "HD11") (segid " " and resid "71 " and name "HG ") OR { 4052} (segid " " and resid "71 " and name "HD12") (segid " " and resid "71 " and name "HB2 ") ASSI { 4053} (segid " " and resid "71 " and name "HD23") (segid " " and resid "71 " and name "HD12") 2.700 2.700 0.000 peak 4053 weight 0.10000E+01 volume -0.44120E+01 ppm1 0.901 ppm2 0.993 OR { 4053} (segid " " and resid "71 " and name "HD21") (segid " " and resid "71 " and name "HD12") OR { 4053} (segid " " and resid "71 " and name "HD22") (segid " " and resid "71 " and name "HD13") OR { 4053} (segid " " and resid "71 " and name "HD21") (segid " " and resid "71 " and name "HD11") OR { 4053} (segid " " and resid "71 " and name "HD23") (segid " " and resid "71 " and name "HD11") OR { 4053} (segid " " and resid "71 " and name "HD23") (segid " " and resid "71 " and name "HD13") OR { 4053} (segid " " and resid "71 " and name "HD21") (segid " " and resid "71 " and name "HD13") OR { 4053} (segid " " and resid "71 " and name "HD21") (segid " " and resid "8 " and name "HD12") ASSI { 4067} (segid " " and resid "71 " and name "HD21") (segid " " and resid "36 " and name "HG12") 6.000 6.000 0.000 peak 4067 weight 0.10000E+01 volume -0.25400E+00 ppm1 0.901 ppm2 1.125 OR { 4067} (segid " " and resid "71 " and name "HD22") (segid " " and resid "36 " and name "HG12") ASSI { 4054} (segid " " and resid "71 " and name "HD23") (segid " " and resid "71 " and name "HB1 ") 3.300 3.300 0.000 peak 4054 weight 0.10000E+01 volume -0.26030E+01 ppm1 0.901 ppm2 1.626 OR { 4054} (segid " " and resid "71 " and name "HD22") (segid " " and resid "71 " and name "HB1 ") OR { 4054} (segid " " and resid "71 " and name "HD21") (segid " " and resid "71 " and name "HB2 ") OR { 4054} (segid " " and resid "71 " and name "HD22") (segid " " and resid "71 " and name "HG ") OR { 4054} (segid " " and resid "71 " and name "HD23") (segid " " and resid "71 " and name "HG ") OR { 4054} (segid " " and resid "71 " and name "HD22") (segid " " and resid "71 " and name "HB2 ") OR { 4054} (segid " " and resid "71 " and name "HD23") (segid " " and resid "71 " and name "HB2 ") OR { 4054} (segid " " and resid "71 " and name "HD21") (segid " " and resid "71 " and name "HB1 ") ASSI { 4065} (segid " " and resid "71 " and name "HD22") (segid " " and resid "40 " and name "HB2 ") 5.000 5.000 0.000 peak 4065 weight 0.10000E+01 volume -0.45000E+00 ppm1 0.901 ppm2 1.784 OR { 4065} (segid " " and resid "71 " and name "HD23") (segid " " and resid "40 " and name "HB2 ") OR { 4065} (segid " " and resid "71 " and name "HD21") (segid " " and resid "40 " and name "HB2 ") ASSI { 4069} (segid " " and resid "71 " and name "HD22") (segid " " and resid "40 " and name "HG2 ") 6.000 6.000 0.000 peak 4069 weight 0.10000E+01 volume -0.16600E+00 ppm1 0.901 ppm2 2.390 OR { 4069} (segid " " and resid "71 " and name "HD23") (segid " " and resid "40 " and name "HG2 ") OR { 4069} (segid " " and resid "71 " and name "HD21") (segid " " and resid "40 " and name "HG1 ") ASSI { 4064} (segid " " and resid "71 " and name "HD22") (segid " " and resid "40 " and name "HB1 ") 5.000 5.000 0.000 peak 4064 weight 0.10000E+01 volume -0.33500E+00 ppm1 0.901 ppm2 2.469 OR { 4064} (segid " " and resid "71 " and name "HD23") (segid " " and resid "40 " and name "HB1 ") OR { 4064} (segid " " and resid "71 " and name "HD21") (segid " " and resid "40 " and name "HB1 ") ASSI { 4063} (segid " " and resid "71 " and name "HD21") (segid " " and resid "41 " and name "HA ") 5.000 5.000 0.000 peak 4063 weight 0.10000E+01 volume -0.39300E+00 ppm1 0.901 ppm2 4.103 OR { 4063} (segid " " and resid "71 " and name "HD22") (segid " " and resid "41 " and name "HA ") OR { 4063} (segid " " and resid "71 " and name "HD21") (segid " " and resid "37 " and name "HD1 ") OR { 4063} (segid " " and resid "71 " and name "HD23") (segid " " and resid "37 " and name "HD1 ") OR { 4063} (segid " " and resid "71 " and name "HD22") (segid " " and resid "37 " and name "HD1 ") ASSI { 4078} (segid " " and resid "72 " and name "HA ") (segid " " and resid "42 " and name "HG2 ") 6.000 6.000 0.000 peak 4078 weight 0.10000E+01 volume -0.10800E+00 ppm1 4.221 ppm2 1.283 ASSI { 4066} (segid " " and resid "72 " and name "HA ") (segid " " and resid "72 " and name "HG2 ") 3.300 3.300 0.000 peak 4066 weight 0.10000E+01 volume -0.27980E+01 ppm1 4.221 ppm2 1.520 OR { 4066} (segid " " and resid "72 " and name "HA ") (segid " " and resid "72 " and name "HG1 ") OR { 4066} (segid " " and resid "72 " and name "HA ") (segid " " and resid "72 " and name "HB2 ") ASSI { 4079} (segid " " and resid "72 " and name "HA ") (segid " " and resid "73 " and name "HD13") 6.000 6.000 0.000 peak 4079 weight 0.10000E+01 volume -0.88000E-01 ppm1 4.221 ppm2 0.914 OR { 4079} (segid " " and resid "72 " and name "HA ") (segid " " and resid "70 " and name "HG12") OR { 4079} (segid " " and resid "72 " and name "HA ") (segid " " and resid "70 " and name "HG13") OR { 4079} (segid " " and resid "72 " and name "HA ") (segid " " and resid "73 " and name "HD22") OR { 4079} (segid " " and resid "72 " and name "HA ") (segid " " and resid "73 " and name "HD11") OR { 4079} (segid " " and resid "72 " and name "HA ") (segid " " and resid "70 " and name "HG11") ASSI { 4083} (segid " " and resid "72 " and name "HB1 ") (segid " " and resid "72 " and name "HD2 ") 5.000 5.000 0.000 peak 4083 weight 0.10000E+01 volume -0.74200E+00 ppm1 1.744 ppm2 3.128 OR { 4083} (segid " " and resid "72 " and name "HB1 ") (segid " " and resid "72 " and name "HD1 ") OR { 4083} (segid " " and resid "72 " and name "HB1 ") (segid " " and resid "42 " and name "HD2 ") ASSI { 4090} (segid " " and resid "72 " and name "HB1 ") (segid " " and resid "40 " and name "HA ") 5.000 5.000 0.000 peak 4090 weight 0.10000E+01 volume -0.54100E+00 ppm1 1.744 ppm2 4.471 ASSI { 3181} (segid " " and resid "72 " and name "HB2 ") (segid " " and resid "42 " and name "HD2 ") 5.000 5.000 0.000 peak 3181 weight 0.10000E+01 volume -0.11030E+01 ppm1 1.507 ppm2 3.128 OR { 3181} (segid " " and resid "72 " and name "HB2 ") (segid " " and resid "72 " and name "HD1 ") OR { 3181} (segid " " and resid "72 " and name "HB2 ") (segid " " and resid "72 " and name "HD2 ") ASSI { 4082} (segid " " and resid "72 " and name "HD1 ") (segid " " and resid "72 " and name "HB2 ") 3.300 3.300 0.000 peak 4082 weight 0.10000E+01 volume -0.38870E+01 ppm1 3.128 ppm2 1.520 OR { 4082} (segid " " and resid "72 " and name "HD2 ") (segid " " and resid "72 " and name "HB2 ") OR { 4082} (segid " " and resid "72 " and name "HD1 ") (segid " " and resid "72 " and name "HG2 ") OR { 4082} (segid " " and resid "72 " and name "HD2 ") (segid " " and resid "72 " and name "HG1 ") OR { 4082} (segid " " and resid "72 " and name "HD1 ") (segid " " and resid "72 " and name "HG1 ") OR { 4082} (segid " " and resid "72 " and name "HD2 ") (segid " " and resid "72 " and name "HG2 ") ASSI { 4088} (segid " " and resid "72 " and name "HD2 ") (segid " " and resid "72 " and name "HB1 ") 5.000 5.000 0.000 peak 4088 weight 0.10000E+01 volume -0.12940E+01 ppm1 3.128 ppm2 1.731 OR { 4088} (segid " " and resid "72 " and name "HD1 ") (segid " " and resid "72 " and name "HB1 ") ASSI { 4099} (segid " " and resid "73 " and name "HA ") (segid " " and resid "72 " and name "HA ") 6.000 6.000 0.000 peak 4099 weight 0.10000E+01 volume -0.14700E+00 ppm1 4.379 ppm2 4.234 ASSI { 4102} (segid " " and resid "73 " and name "HB1 ") (segid " " and resid "73 " and name "HD12") 5.000 5.000 0.000 peak 4102 weight 0.10000E+01 volume -0.70900E+00 ppm1 1.652 ppm2 0.914 OR { 4102} (segid " " and resid "73 " and name "HB1 ") (segid " " and resid "73 " and name "HD21") OR { 4102} (segid " " and resid "73 " and name "HB1 ") (segid " " and resid "73 " and name "HD22") OR { 4102} (segid " " and resid "73 " and name "HB1 ") (segid " " and resid "73 " and name "HD23") OR { 4102} (segid " " and resid "73 " and name "HB1 ") (segid " " and resid "73 " and name "HD11") ASSI { 4105} (segid " " and resid "73 " and name "HB2 ") (segid " " and resid "73 " and name "HD21") 5.000 5.000 0.000 peak 4105 weight 0.10000E+01 volume -0.84300E+00 ppm1 1.560 ppm2 0.914 OR { 4105} (segid " " and resid "73 " and name "HB2 ") (segid " " and resid "73 " and name "HD23") OR { 4105} (segid " " and resid "73 " and name "HB2 ") (segid " " and resid "73 " and name "HD11") OR { 4105} (segid " " and resid "73 " and name "HB2 ") (segid " " and resid "73 " and name "HD12") OR { 4105} (segid " " and resid "73 " and name "HB2 ") (segid " " and resid "73 " and name "HD13") OR { 4105} (segid " " and resid "73 " and name "HB2 ") (segid " " and resid "73 " and name "HD22") ASSI { 4113} (segid " " and resid "73 " and name "HD11") (segid " " and resid "73 " and name "HA ") 6.000 6.000 0.000 peak 4113 weight 0.10000E+01 volume -0.11100E+00 ppm1 0.927 ppm2 4.392 OR { 4113} (segid " " and resid "73 " and name "HD13") (segid " " and resid "73 " and name "HA ") ASSI { 4108} (segid " " and resid "73 " and name "HD12") (segid " " and resid "73 " and name "HB1 ") 5.000 5.000 0.000 peak 4108 weight 0.10000E+01 volume -0.17940E+01 ppm1 0.927 ppm2 1.599 OR { 4108} (segid " " and resid "73 " and name "HD11") (segid " " and resid "73 " and name "HB2 ") OR { 4108} (segid " " and resid "73 " and name "HD12") (segid " " and resid "73 " and name "HB2 ") OR { 4108} (segid " " and resid "73 " and name "HD13") (segid " " and resid "73 " and name "HB2 ") OR { 4108} (segid " " and resid "73 " and name "HD11") (segid " " and resid "73 " and name "HG ") OR { 4108} (segid " " and resid "73 " and name "HD13") (segid " " and resid "73 " and name "HG ") OR { 4108} (segid " " and resid "73 " and name "HD12") (segid " " and resid "73 " and name "HG ") OR { 4108} (segid " " and resid "73 " and name "HD11") (segid " " and resid "73 " and name "HB1 ") OR { 4108} (segid " " and resid "73 " and name "HD12") (segid " " and resid "71 " and name "HB1 ") ASSI { 4111} (segid " " and resid "73 " and name "HD21") (segid " " and resid "73 " and name "HB2 ") 5.000 5.000 0.000 peak 4111 weight 0.10000E+01 volume -0.17520E+01 ppm1 0.875 ppm2 1.599 OR { 4111} (segid " " and resid "73 " and name "HD23") (segid " " and resid "73 " and name "HB2 ") OR { 4111} (segid " " and resid "73 " and name "HD21") (segid " " and resid "73 " and name "HB1 ") OR { 4111} (segid " " and resid "73 " and name "HD22") (segid " " and resid "73 " and name "HB1 ") OR { 4111} (segid " " and resid "73 " and name "HD23") (segid " " and resid "73 " and name "HG ") OR { 4111} (segid " " and resid "73 " and name "HD22") (segid " " and resid "73 " and name "HG ") OR { 4111} (segid " " and resid "73 " and name "HD21") (segid " " and resid "73 " and name "HG ") OR { 4111} (segid " " and resid "73 " and name "HD23") (segid " " and resid "73 " and name "HB1 ") OR { 4111} (segid " " and resid "73 " and name "HD22") (segid " " and resid "73 " and name "HB2 ") ASSI { 4116} (segid " " and resid "74 " and name "HA ") (segid " " and resid "74 " and name "HG2 ") 5.000 5.000 0.000 peak 4116 weight 0.10000E+01 volume -0.53600E+00 ppm1 4.300 ppm2 1.652 OR { 4116} (segid " " and resid "74 " and name "HA ") (segid " " and resid "74 " and name "HG1 ") ASSI { 4117} (segid " " and resid "74 " and name "HB1 ") (segid " " and resid "74 " and name "HG1 ") 2.700 2.700 0.000 peak 4117 weight 0.10000E+01 volume -0.44150E+01 ppm1 1.876 ppm2 1.652 OR { 4117} (segid " " and resid "74 " and name "HB1 ") (segid " " and resid "74 " and name "HG2 ") ASSI { 4119} (segid " " and resid "74 " and name "HB1 ") (segid " " and resid "74 " and name "HD2 ") 6.000 6.000 0.000 peak 4119 weight 0.10000E+01 volume -0.98000E-01 ppm1 1.876 ppm2 3.207 OR { 4119} (segid " " and resid "74 " and name "HB1 ") (segid " " and resid "74 " and name "HD1 ") ASSI { 4122} (segid " " and resid "74 " and name "HD2 ") (segid " " and resid "74 " and name "HB2 ") 6.000 6.000 0.000 peak 4122 weight 0.10000E+01 volume -0.16600E+00 ppm1 3.207 ppm2 1.784 OR { 4122} (segid " " and resid "74 " and name "HD1 ") (segid " " and resid "74 " and name "HB2 ") ASSI { 4530} (segid " " and resid "4 " and name "HD1 ") (segid " " and resid "3 " and name "HG21") 6.000 6.000 0.000 peak 4530 weight 0.10000E+01 volume 0.29000E+00 ppm1 7.071 ppm2 0.577 OR { 4530} (segid " " and resid "4 " and name "HD1 ") (segid " " and resid "3 " and name "HG23") OR { 4530} (segid " " and resid "4 " and name "HD2 ") (segid " " and resid "3 " and name "HG21") OR { 4530} (segid " " and resid "4 " and name "HD2 ") (segid " " and resid "3 " and name "HG23") OR { 4530} (segid " " and resid "4 " and name "HD2 ") (segid " " and resid "3 " and name "HG22") ASSI { 5118} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "23 " and name "HG11") 5.000 5.000 0.000 peak 5118 weight 0.10000E+01 volume 0.65000E+00 ppm1 7.065 ppm2 0.834 OR { 5118} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "23 " and name "HG12") OR { 5118} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "23 " and name "HG13") OR { 5118} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "23 " and name "HG12") OR { 5118} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "23 " and name "HG13") ASSI { 5342} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "30 " and name "HD13") 5.000 5.000 0.000 peak 5342 weight 0.10000E+01 volume 0.30600E+00 ppm1 7.069 ppm2 0.044 OR { 5342} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "30 " and name "HD11") OR { 5342} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "30 " and name "HD12") OR { 5342} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "30 " and name "HD12") OR { 5342} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "30 " and name "HD11") ASSI { 5947} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "56 " and name "HD13") 5.000 5.000 0.000 peak 5947 weight 0.10000E+01 volume 0.48400E+00 ppm1 7.070 ppm2 0.411 OR { 5947} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "56 " and name "HD12") OR { 5947} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "56 " and name "HD11") OR { 5947} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "56 " and name "HD12") OR { 5947} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "56 " and name "HD11") ASSI { 4846} (segid " " and resid "4 " and name "HE1 ") (segid " " and resid "14 " and name "HG23") 5.000 5.000 0.000 peak 4846 weight 0.10000E+01 volume 0.57500E+00 ppm1 7.266 ppm2 1.086 OR { 4846} (segid " " and resid "4 " and name "HE2 ") (segid " " and resid "14 " and name "HG22") OR { 4846} (segid " " and resid "4 " and name "HE2 ") (segid " " and resid "14 " and name "HG23") OR { 4846} (segid " " and resid "4 " and name "HE1 ") (segid " " and resid "14 " and name "HG22") OR { 4846} (segid " " and resid "4 " and name "HE2 ") (segid " " and resid "14 " and name "HG21") ASSI { 4874} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "15 " and name "HG11") 5.000 5.000 0.000 peak 4874 weight 0.10000E+01 volume 0.38100E+00 ppm1 6.886 ppm2 1.371 ASSI { 6106} (segid " " and resid "45 " and name "HD1 ") (segid " " and resid "61 " and name "HG23") 6.000 6.000 0.000 peak 6106 weight 0.10000E+01 volume 0.86000E-01 ppm1 7.444 ppm2 0.338 OR { 6106} (segid " " and resid "45 " and name "HD1 ") (segid " " and resid "61 " and name "HG22") OR { 6106} (segid " " and resid "45 " and name "HD2 ") (segid " " and resid "61 " and name "HG22") OR { 6106} (segid " " and resid "45 " and name "HD2 ") (segid " " and resid "61 " and name "HG21") ASSI { 4523} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "48 " and name "HB1 ") 5.000 5.000 0.000 peak 4523 weight 0.10000E+01 volume -0.68500E+00 ppm1 7.270 ppm2 2.050 OR { 4523} (segid " " and resid "59 " and name "HD2 ") (segid " " and resid "48 " and name "HB1 ") ASSI { 4524} (segid " " and resid "59 " and name "HE1 ") (segid " " and resid "48 " and name "HB1 ") 5.000 5.000 0.000 peak 4524 weight 0.10000E+01 volume -0.58300E+00 ppm1 6.865 ppm2 2.050 OR { 4524} (segid " " and resid "59 " and name "HE2 ") (segid " " and resid "48 " and name "HB1 ") ASSI { 4505} (segid " " and resid "15 " and name "HD12") (segid " " and resid "29 " and name "HD1 ") 5.000 5.000 0.000 peak 4505 weight 0.10000E+01 volume 0.39800E+00 ppm1 0.653 ppm2 1.885 OR { 4505} (segid " " and resid "15 " and name "HD13") (segid " " and resid "29 " and name "HD1 ") OR { 4505} (segid " " and resid "15 " and name "HD11") (segid " " and resid "29 " and name "HD1 ") ASSI { 4823} (segid " " and resid "15 " and name "HD12") (segid " " and resid "13 " and name "HG13") 5.000 5.000 0.000 peak 4823 weight 0.10000E+01 volume 0.19890E+01 ppm1 0.657 ppm2 0.956 OR { 4823} (segid " " and resid "15 " and name "HD13") (segid " " and resid "13 " and name "HG11") OR { 4823} (segid " " and resid "15 " and name "HD11") (segid " " and resid "13 " and name "HG12") OR { 4823} (segid " " and resid "15 " and name "HD13") (segid " " and resid "13 " and name "HG13") OR { 4823} (segid " " and resid "15 " and name "HD12") (segid " " and resid "13 " and name "HG11") OR { 4823} (segid " " and resid "15 " and name "HD13") (segid " " and resid "13 " and name "HG12") OR { 4823} (segid " " and resid "15 " and name "HD12") (segid " " and resid "13 " and name "HG12") OR { 4823} (segid " " and resid "44 " and name "HD11") (segid " " and resid "70 " and name "HG12") ASSI { 4883} (segid " " and resid "15 " and name "HD13") (segid " " and resid "15 " and name "HG12") 3.300 3.300 0.000 peak 4883 weight 0.10000E+01 volume 0.26600E+01 ppm1 0.658 ppm2 1.239 OR { 4883} (segid " " and resid "15 " and name "HD11") (segid " " and resid "15 " and name "HG12") OR { 4883} (segid " " and resid "15 " and name "HD12") (segid " " and resid "15 " and name "HG12") OR { 4883} (segid " " and resid "44 " and name "HD11") (segid " " and resid "42 " and name "HG2 ") ASSI { 4878} (segid " " and resid "15 " and name "HD11") (segid " " and resid "15 " and name "HG11") 3.300 3.300 0.000 peak 4878 weight 0.10000E+01 volume 0.35030E+01 ppm1 0.654 ppm2 1.371 OR { 4878} (segid " " and resid "44 " and name "HD11") (segid " " and resid "44 " and name "HG11") OR { 4878} (segid " " and resid "44 " and name "HD12") (segid " " and resid "44 " and name "HG11") OR { 4878} (segid " " and resid "15 " and name "HD13") (segid " " and resid "15 " and name "HG11") OR { 4878} (segid " " and resid "15 " and name "HD12") (segid " " and resid "15 " and name "HG11") OR { 4878} (segid " " and resid "44 " and name "HD13") (segid " " and resid "44 " and name "HG11") ASSI { 2276} (segid " " and resid "3 " and name "HG21") (segid " " and resid "1 " and name "HG2 ") 6.000 6.000 0.000 peak 2276 weight 0.10000E+01 volume 0.12700E+00 ppm1 0.579 ppm2 2.019 OR { 2276} (segid " " and resid "3 " and name "HG23") (segid " " and resid "1 " and name "HG2 ") OR { 2276} (segid " " and resid "3 " and name "HG22") (segid " " and resid "1 " and name "HG2 ") ASSI { 4121} (segid " " and resid "17 " and name "HG23") (segid " " and resid "29 " and name "HE1 ") 6.000 6.000 0.000 peak 4121 weight 0.10000E+01 volume -0.12300E+00 ppm1 0.371 ppm2 3.146 OR { 4121} (segid " " and resid "17 " and name "HG22") (segid " " and resid "29 " and name "HE1 ") OR { 4121} (segid " " and resid "17 " and name "HG21") (segid " " and resid "29 " and name "HE1 ") ASSI { 4022} (segid " " and resid "48 " and name "HG1 ") (segid " " and resid "48 " and name "HB1 ") 3.300 3.300 0.000 peak 4022 weight 0.10000E+01 volume -0.32210E+01 ppm1 1.575 ppm2 2.050 OR { 4022} (segid " " and resid "48 " and name "HG2 ") (segid " " and resid "48 " and name "HB1 ") ASSI { 6385} (segid " " and resid "74 " and name "HG1 ") (segid " " and resid "74 " and name "HB2 ") 3.300 3.300 0.000 peak 6385 weight 0.10000E+01 volume 0.30170E+01 ppm1 1.634 ppm2 1.788 OR { 6385} (segid " " and resid "74 " and name "HG2 ") (segid " " and resid "74 " and name "HB2 ") ASSI { 5595} (segid " " and resid "72 " and name "HG2 ") (segid " " and resid "40 " and name "HA ") 5.000 5.000 0.000 peak 5595 weight 0.10000E+01 volume -0.12020E+01 ppm1 1.483 ppm2 4.428 OR { 5595} (segid " " and resid "42 " and name "HG1 ") (segid " " and resid "42 " and name "HA ") ASSI { 6349} (segid " " and resid "72 " and name "HB2 ") (segid " " and resid "70 " and name "HB ") 5.000 5.000 0.000 peak 6349 weight 0.10000E+01 volume -0.43800E+00 ppm1 1.502 ppm2 2.079 ASSI { 5596} (segid " " and resid "42 " and name "HB2 ") (segid " " and resid "42 " and name "HA ") 5.000 5.000 0.000 peak 5596 weight 0.10000E+01 volume -0.15600E+01 ppm1 1.502 ppm2 4.428 OR { 5596} (segid " " and resid "72 " and name "HB2 ") (segid " " and resid "40 " and name "HA ") ASSI { 6149} (segid " " and resid "62 " and name "HB1 ") (segid " " and resid "62 " and name "HB2 ") 2.700 2.700 0.000 peak 6149 weight 0.10000E+01 volume 0.89600E+01 ppm1 2.195 ppm2 1.835 OR { 6149} (segid " " and resid "29 " and name "HB2 ") (segid " " and resid "29 " and name "HB1 ") ASSI { 5855} (segid " " and resid "54 " and name "HD2 ") (segid " " and resid "51 " and name "HB2 ") 6.000 6.000 0.000 peak 5855 weight 0.10000E+01 volume -0.27100E+00 ppm1 3.181 ppm2 1.916 OR { 5855} (segid " " and resid "54 " and name "HD1 ") (segid " " and resid "51 " and name "HB2 ") ASSI { 5604} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "72 " and name "HB2 ") 3.300 3.300 0.000 peak 5604 weight 0.10000E+01 volume -0.20150E+01 ppm1 3.100 ppm2 1.515 OR { 5604} (segid " " and resid "72 " and name "HD1 ") (segid " " and resid "72 " and name "HB2 ") OR { 5604} (segid " " and resid "42 " and name "HD1 ") (segid " " and resid "42 " and name "HB2 ") OR { 5604} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "42 " and name "HB2 ") OR { 5604} (segid " " and resid "72 " and name "HD2 ") (segid " " and resid "72 " and name "HB2 ") ASSI { 4298} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "72 " and name "HG1 ") 3.300 3.300 0.000 peak 4298 weight 0.10000E+01 volume -0.30060E+01 ppm1 3.111 ppm2 1.501 OR { 4298} (segid " " and resid "72 " and name "HD1 ") (segid " " and resid "72 " and name "HG2 ") OR { 4298} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "42 " and name "HG1 ") OR { 4298} (segid " " and resid "42 " and name "HD1 ") (segid " " and resid "42 " and name "HG1 ") OR { 4298} (segid " " and resid "72 " and name "HD2 ") (segid " " and resid "72 " and name "HG1 ") OR { 4298} (segid " " and resid "72 " and name "HD1 ") (segid " " and resid "72 " and name "HG1 ") OR { 4298} (segid " " and resid "72 " and name "HD2 ") (segid " " and resid "72 " and name "HG2 ") ASSI { 5684} (segid " " and resid "44 " and name "HA ") (segid " " and resid "44 " and name "HD11") 5.000 5.000 0.000 peak 5684 weight 0.10000E+01 volume -0.45200E+00 ppm1 4.910 ppm2 0.664 OR { 5684} (segid " " and resid "44 " and name "HA ") (segid " " and resid "44 " and name "HD13") OR { 5684} (segid " " and resid "44 " and name "HA ") (segid " " and resid "44 " and name "HD12") ASSI { 2981} (segid " " and resid "19 " and name "HD2 ") (segid " " and resid "1 " and name "HG1 ") 5.000 5.000 0.000 peak 2981 weight 0.10000E+01 volume -0.52000E+00 ppm1 3.724 ppm2 2.491 ASSI { 4494} (segid " " and resid "16 " and name "HA ") (segid " " and resid "2 " and name "HA ") 3.300 3.300 0.000 peak 4494 weight 0.10000E+01 volume 0.33190E+01 ppm1 4.911 ppm2 4.776 ASSI { 4554} (segid " " and resid "2 " and name "HB1 ") (segid " " and resid "3 " and name "HG13") 6.000 6.000 0.000 peak 4554 weight 0.10000E+01 volume 0.22200E+00 ppm1 1.877 ppm2 0.568 OR { 4554} (segid " " and resid "2 " and name "HB1 ") (segid " " and resid "3 " and name "HG11") OR { 4554} (segid " " and resid "2 " and name "HB1 ") (segid " " and resid "3 " and name "HG12") OR { 4554} (segid " " and resid "16 " and name "HB2 ") (segid " " and resid "3 " and name "HG11") OR { 4554} (segid " " and resid "16 " and name "HB2 ") (segid " " and resid "3 " and name "HG13") OR { 4554} (segid " " and resid "16 " and name "HB2 ") (segid " " and resid "3 " and name "HG12") ASSI { 4551} (segid " " and resid "3 " and name "HB ") (segid " " and resid "3 " and name "HG12") 3.300 3.300 0.000 peak 4551 weight 0.10000E+01 volume -0.20790E+01 ppm1 2.054 ppm2 0.568 OR { 4551} (segid " " and resid "3 " and name "HB ") (segid " " and resid "3 " and name "HG11") OR { 4551} (segid " " and resid "3 " and name "HB ") (segid " " and resid "3 " and name "HG13") ASSI { 4540} (segid " " and resid "15 " and name "HG12") (segid " " and resid "3 " and name "HG21") 6.000 6.000 0.000 peak 4540 weight 0.10000E+01 volume 0.13000E+00 ppm1 1.230 ppm2 0.581 OR { 4540} (segid " " and resid "15 " and name "HG12") (segid " " and resid "3 " and name "HG22") OR { 4540} (segid " " and resid "15 " and name "HG12") (segid " " and resid "3 " and name "HG23") ASSI { 4582} (segid " " and resid "14 " and name "HG22") (segid " " and resid "4 " and name "HD2 ") 5.000 5.000 0.000 peak 4582 weight 0.10000E+01 volume 0.51700E+00 ppm1 1.064 ppm2 7.047 OR { 4582} (segid " " and resid "14 " and name "HG21") (segid " " and resid "4 " and name "HD2 ") OR { 4582} (segid " " and resid "14 " and name "HG23") (segid " " and resid "4 " and name "HD2 ") OR { 4582} (segid " " and resid "12 " and name "HG22") (segid " " and resid "4 " and name "HD2 ") OR { 4582} (segid " " and resid "14 " and name "HG22") (segid " " and resid "4 " and name "HD1 ") OR { 4582} (segid " " and resid "12 " and name "HG21") (segid " " and resid "4 " and name "HD2 ") OR { 4582} (segid " " and resid "12 " and name "HG22") (segid " " and resid "4 " and name "HD1 ") ASSI { 4597} (segid " " and resid "67 " and name "HG22") (segid " " and resid "5 " and name "HA ") 5.000 5.000 0.000 peak 4597 weight 0.10000E+01 volume -0.54700E+00 ppm1 0.959 ppm2 5.444 OR { 4597} (segid " " and resid "67 " and name "HG21") (segid " " and resid "5 " and name "HA ") OR { 4597} (segid " " and resid "67 " and name "HG23") (segid " " and resid "5 " and name "HA ") ASSI { 4663} (segid " " and resid "6 " and name "HE1 ") (segid " " and resid "6 " and name "HG2 ") 5.000 5.000 0.000 peak 4663 weight 0.10000E+01 volume -0.74800E+00 ppm1 2.900 ppm2 1.211 OR { 4663} (segid " " and resid "6 " and name "HE2 ") (segid " " and resid "6 " and name "HG2 ") ASSI { 4691} (segid " " and resid "11 " and name "HE1 ") (segid " " and resid "7 " and name "HG23") 5.000 5.000 0.000 peak 4691 weight 0.10000E+01 volume -0.38000E+00 ppm1 2.919 ppm2 1.165 OR { 4691} (segid " " and resid "11 " and name "HE2 ") (segid " " and resid "7 " and name "HG21") OR { 4691} (segid " " and resid "11 " and name "HE1 ") (segid " " and resid "7 " and name "HG21") ASSI { 4779} (segid " " and resid "11 " and name "HB2 ") (segid " " and resid "12 " and name "HA ") 6.000 6.000 0.000 peak 4779 weight 0.10000E+01 volume -0.58000E-01 ppm1 1.656 ppm2 5.305 OR { 4779} (segid " " and resid "6 " and name "HB1 ") (segid " " and resid "12 " and name "HA ") ASSI { 4797} (segid " " and resid "13 " and name "HG13") (segid " " and resid "13 " and name "HA ") 3.300 3.300 0.000 peak 4797 weight 0.10000E+01 volume 0.26690E+01 ppm1 0.965 ppm2 4.658 OR { 4797} (segid " " and resid "13 " and name "HG11") (segid " " and resid "13 " and name "HA ") OR { 4797} (segid " " and resid "13 " and name "HG12") (segid " " and resid "13 " and name "HA ") ASSI { 4829} (segid " " and resid "33 " and name "HG2 ") (segid " " and resid "13 " and name "HG23") 6.000 6.000 0.000 peak 4829 weight 0.10000E+01 volume 0.27300E+00 ppm1 1.599 ppm2 0.884 OR { 4829} (segid " " and resid "33 " and name "HG1 ") (segid " " and resid "13 " and name "HG22") OR { 4829} (segid " " and resid "33 " and name "HG1 ") (segid " " and resid "13 " and name "HG21") OR { 4829} (segid " " and resid "33 " and name "HG2 ") (segid " " and resid "13 " and name "HG21") ASSI { 4826} (segid " " and resid "11 " and name "HE2 ") (segid " " and resid "13 " and name "HG22") 5.000 5.000 0.000 peak 4826 weight 0.10000E+01 volume -0.40700E+00 ppm1 2.924 ppm2 0.884 OR { 4826} (segid " " and resid "11 " and name "HE2 ") (segid " " and resid "13 " and name "HG21") OR { 4826} (segid " " and resid "11 " and name "HE1 ") (segid " " and resid "13 " and name "HG21") OR { 4826} (segid " " and resid "11 " and name "HE1 ") (segid " " and resid "13 " and name "HG23") ASSI { 4858} (segid " " and resid "16 " and name "HB2 ") (segid " " and resid "15 " and name "HA ") 6.000 6.000 0.000 peak 4858 weight 0.10000E+01 volume -0.21000E+00 ppm1 1.895 ppm2 4.412 OR { 4858} (segid " " and resid "29 " and name "HD1 ") (segid " " and resid "15 " and name "HA ") OR { 4858} (segid " " and resid "2 " and name "HB1 ") (segid " " and resid "15 " and name "HA ") ASSI { 4871} (segid " " and resid "15 " and name "HD13") (segid " " and resid "15 " and name "HB ") 5.000 5.000 0.000 peak 4871 weight 0.10000E+01 volume -0.13350E+01 ppm1 0.665 ppm2 1.696 OR { 4871} (segid " " and resid "15 " and name "HD12") (segid " " and resid "15 " and name "HB ") OR { 4871} (segid " " and resid "15 " and name "HD11") (segid " " and resid "15 " and name "HB ") ASSI { 4896} (segid " " and resid "29 " and name "HD2 ") (segid " " and resid "15 " and name "HG21") 5.000 5.000 0.000 peak 4896 weight 0.10000E+01 volume 0.51800E+00 ppm1 1.683 ppm2 0.938 OR { 4896} (segid " " and resid "29 " and name "HD2 ") (segid " " and resid "15 " and name "HG22") ASSI { 4942} (segid " " and resid "29 " and name "HD2 ") (segid " " and resid "17 " and name "HG13") 5.000 5.000 0.000 peak 4942 weight 0.10000E+01 volume 0.35300E+00 ppm1 1.680 ppm2 0.641 OR { 4942} (segid " " and resid "29 " and name "HD2 ") (segid " " and resid "17 " and name "HG12") OR { 4942} (segid " " and resid "29 " and name "HD2 ") (segid " " and resid "17 " and name "HG11") ASSI { 4963} (segid " " and resid "29 " and name "HD2 ") (segid " " and resid "17 " and name "HG21") 6.000 6.000 0.000 peak 4963 weight 0.10000E+01 volume 0.94000E-01 ppm1 1.674 ppm2 0.383 OR { 4963} (segid " " and resid "2 " and name "HB2 ") (segid " " and resid "17 " and name "HG21") OR { 4963} (segid " " and resid "29 " and name "HD2 ") (segid " " and resid "17 " and name "HG23") OR { 4963} (segid " " and resid "29 " and name "HD2 ") (segid " " and resid "17 " and name "HG22") OR { 4963} (segid " " and resid "2 " and name "HB2 ") (segid " " and resid "17 " and name "HG22") ASSI { 4981} (segid " " and resid "19 " and name "HD2 ") (segid " " and resid "18 " and name "HB1 ") 5.000 5.000 0.000 peak 4981 weight 0.10000E+01 volume -0.42700E+00 ppm1 3.732 ppm2 2.099 ASSI { 5017} (segid " " and resid "19 " and name "HD2 ") (segid " " and resid "19 " and name "HB2 ") 5.000 5.000 0.000 peak 5017 weight 0.10000E+01 volume -0.66600E+00 ppm1 3.729 ppm2 2.018 ASSI { 5220} (segid " " and resid "5 " and name "HD12") (segid " " and resid "26 " and name "HE2 ") 5.000 5.000 0.000 peak 5220 weight 0.10000E+01 volume 0.38200E+00 ppm1 0.751 ppm2 6.891 OR { 5220} (segid " " and resid "5 " and name "HD11") (segid " " and resid "26 " and name "HE2 ") OR { 5220} (segid " " and resid "5 " and name "HD13") (segid " " and resid "26 " and name "HE2 ") OR { 5220} (segid " " and resid "5 " and name "HD12") (segid " " and resid "26 " and name "HE1 ") OR { 5220} (segid " " and resid "5 " and name "HD13") (segid " " and resid "26 " and name "HE1 ") OR { 5220} (segid " " and resid "43 " and name "HD23") (segid " " and resid "26 " and name "HE1 ") ASSI { 5188} (segid " " and resid "15 " and name "HD13") (segid " " and resid "26 " and name "HZ ") 6.000 6.000 0.000 peak 5188 weight 0.10000E+01 volume 0.11800E+00 ppm1 0.657 ppm2 6.813 OR { 5188} (segid " " and resid "15 " and name "HD11") (segid " " and resid "26 " and name "HZ ") OR { 5188} (segid " " and resid "15 " and name "HD12") (segid " " and resid "26 " and name "HZ ") ASSI { 5280} (segid " " and resid "38 " and name "HG1 ") (segid " " and resid "28 " and name "HB3 ") 6.000 6.000 0.000 peak 5280 weight 0.10000E+01 volume 0.18400E+00 ppm1 2.196 ppm2 1.630 OR { 5280} (segid " " and resid "38 " and name "HG1 ") (segid " " and resid "28 " and name "HB1 ") OR { 5280} (segid " " and resid "38 " and name "HG1 ") (segid " " and resid "28 " and name "HB2 ") ASSI { 5349} (segid " " and resid "67 " and name "HG22") (segid " " and resid "30 " and name "HD11") 6.000 6.000 0.000 peak 5349 weight 0.10000E+01 volume 0.17100E+00 ppm1 0.968 ppm2 0.044 OR { 5349} (segid " " and resid "67 " and name "HG21") (segid " " and resid "30 " and name "HD13") OR { 5349} (segid " " and resid "67 " and name "HG21") (segid " " and resid "30 " and name "HD12") OR { 5349} (segid " " and resid "67 " and name "HG22") (segid " " and resid "30 " and name "HD12") OR { 5349} (segid " " and resid "67 " and name "HG21") (segid " " and resid "30 " and name "HD11") OR { 5349} (segid " " and resid "67 " and name "HG23") (segid " " and resid "30 " and name "HD12") OR { 5349} (segid " " and resid "67 " and name "HG22") (segid " " and resid "30 " and name "HD13") OR { 5349} (segid " " and resid "67 " and name "HG23") (segid " " and resid "30 " and name "HD13") ASSI { 5352} (segid " " and resid "43 " and name "HD21") (segid " " and resid "30 " and name "HD11") 3.300 3.300 0.000 peak 5352 weight 0.10000E+01 volume 0.33910E+01 ppm1 0.750 ppm2 0.044 OR { 5352} (segid " " and resid "43 " and name "HD23") (segid " " and resid "30 " and name "HD12") OR { 5352} (segid " " and resid "43 " and name "HD21") (segid " " and resid "30 " and name "HD13") OR { 5352} (segid " " and resid "43 " and name "HD22") (segid " " and resid "30 " and name "HD11") OR { 5352} (segid " " and resid "43 " and name "HD22") (segid " " and resid "30 " and name "HD12") OR { 5352} (segid " " and resid "43 " and name "HD21") (segid " " and resid "30 " and name "HD12") OR { 5352} (segid " " and resid "43 " and name "HD22") (segid " " and resid "30 " and name "HD13") ASSI { 5333} (segid " " and resid "34 " and name "HB1 ") (segid " " and resid "30 " and name "HG23") 5.000 5.000 0.000 peak 5333 weight 0.10000E+01 volume 0.31900E+00 ppm1 2.281 ppm2 0.519 OR { 5333} (segid " " and resid "34 " and name "HB1 ") (segid " " and resid "30 " and name "HG21") OR { 5333} (segid " " and resid "34 " and name "HB1 ") (segid " " and resid "30 " and name "HG22") ASSI { 5328} (segid " " and resid "34 " and name "HA ") (segid " " and resid "30 " and name "HG23") 6.000 6.000 0.000 peak 5328 weight 0.10000E+01 volume -0.65000E-01 ppm1 4.488 ppm2 0.519 OR { 5328} (segid " " and resid "34 " and name "HA ") (segid " " and resid "30 " and name "HG22") OR { 5328} (segid " " and resid "34 " and name "HA ") (segid " " and resid "30 " and name "HG21") ASSI { 5383} (segid " " and resid "33 " and name "HG1 ") (segid " " and resid "32 " and name "HB1 ") 6.000 6.000 0.000 peak 5383 weight 0.10000E+01 volume -0.94000E-01 ppm1 1.599 ppm2 2.821 OR { 5383} (segid " " and resid "33 " and name "HG2 ") (segid " " and resid "32 " and name "HB1 ") ASSI { 5384} (segid " " and resid "33 " and name "HG1 ") (segid " " and resid "32 " and name "HB2 ") 6.000 6.000 0.000 peak 5384 weight 0.10000E+01 volume -0.11500E+00 ppm1 1.600 ppm2 2.741 OR { 5384} (segid " " and resid "33 " and name "HG2 ") (segid " " and resid "32 " and name "HB2 ") ASSI { 5392} (segid " " and resid "33 " and name "HG2 ") (segid " " and resid "33 " and name "HB1 ") 2.700 2.700 0.000 peak 5392 weight 0.10000E+01 volume -0.45770E+01 ppm1 1.593 ppm2 1.925 OR { 5392} (segid " " and resid "33 " and name "HG1 ") (segid " " and resid "33 " and name "HB1 ") ASSI { 5394} (segid " " and resid "33 " and name "HG1 ") (segid " " and resid "33 " and name "HB2 ") 2.700 2.700 0.000 peak 5394 weight 0.10000E+01 volume -0.41370E+01 ppm1 1.599 ppm2 1.857 OR { 5394} (segid " " and resid "33 " and name "HG2 ") (segid " " and resid "33 " and name "HB2 ") ASSI { 5406} (segid " " and resid "13 " and name "HG12") (segid " " and resid "33 " and name "HD1 ") 5.000 5.000 0.000 peak 5406 weight 0.10000E+01 volume 0.72000E+00 ppm1 0.957 ppm2 1.710 OR { 5406} (segid " " and resid "13 " and name "HG11") (segid " " and resid "33 " and name "HD1 ") OR { 5406} (segid " " and resid "13 " and name "HG11") (segid " " and resid "33 " and name "HD2 ") OR { 5406} (segid " " and resid "13 " and name "HG12") (segid " " and resid "33 " and name "HD2 ") ASSI { 5528} (segid " " and resid "38 " and name "HG2 ") (segid " " and resid "38 " and name "HA ") 5.000 5.000 0.000 peak 5528 weight 0.10000E+01 volume 0.42900E+00 ppm1 1.616 ppm2 4.056 ASSI { 5559} (segid " " and resid "36 " and name "HG23") (segid " " and resid "40 " and name "HB1 ") 5.000 5.000 0.000 peak 5559 weight 0.10000E+01 volume 0.58200E+00 ppm1 0.896 ppm2 2.468 OR { 5559} (segid " " and resid "36 " and name "HG22") (segid " " and resid "40 " and name "HB1 ") OR { 5559} (segid " " and resid "36 " and name "HG21") (segid " " and resid "40 " and name "HB1 ") ASSI { 5571} (segid " " and resid "69 " and name "HD13") (segid " " and resid "41 " and name "HA ") 5.000 5.000 0.000 peak 5571 weight 0.10000E+01 volume -0.10080E+01 ppm1 0.860 ppm2 4.090 OR { 5571} (segid " " and resid "69 " and name "HD12") (segid " " and resid "41 " and name "HA ") ASSI { 5668} (segid " " and resid "44 " and name "HD13") (segid " " and resid "44 " and name "HG12") 5.000 5.000 0.000 peak 5668 weight 0.10000E+01 volume 0.16640E+01 ppm1 0.653 ppm2 1.079 OR { 5668} (segid " " and resid "44 " and name "HD11") (segid " " and resid "44 " and name "HG12") OR { 5668} (segid " " and resid "44 " and name "HD12") (segid " " and resid "44 " and name "HG12") ASSI { 5663} (segid " " and resid "49 " and name "HA ") (segid " " and resid "44 " and name "HG12") 6.000 6.000 0.000 peak 5663 weight 0.10000E+01 volume -0.11700E+00 ppm1 4.898 ppm2 1.079 ASSI { 5678} (segid " " and resid "49 " and name "HB2 ") (segid " " and resid "44 " and name "HG21") 6.000 6.000 0.000 peak 5678 weight 0.10000E+01 volume 0.90000E-01 ppm1 1.954 ppm2 0.682 OR { 5678} (segid " " and resid "49 " and name "HB2 ") (segid " " and resid "44 " and name "HG23") OR { 5678} (segid " " and resid "49 " and name "HB2 ") (segid " " and resid "44 " and name "HG22") OR { 5678} (segid " " and resid "49 " and name "HB1 ") (segid " " and resid "44 " and name "HG21") ASSI { 5763} (segid " " and resid "49 " and name "HB1 ") (segid " " and resid "49 " and name "HA ") 3.300 3.300 0.000 peak 5763 weight 0.10000E+01 volume -0.28540E+01 ppm1 1.962 ppm2 4.894 OR { 5763} (segid " " and resid "49 " and name "HB2 ") (segid " " and resid "49 " and name "HA ") ASSI { 5767} (segid " " and resid "44 " and name "HD13") (segid " " and resid "49 " and name "HG1 ") 5.000 5.000 0.000 peak 5767 weight 0.10000E+01 volume -0.77000E+00 ppm1 0.664 ppm2 2.259 OR { 5767} (segid " " and resid "44 " and name "HD13") (segid " " and resid "49 " and name "HG2 ") OR { 5767} (segid " " and resid "44 " and name "HD12") (segid " " and resid "49 " and name "HG2 ") OR { 5767} (segid " " and resid "44 " and name "HD12") (segid " " and resid "49 " and name "HG1 ") OR { 5767} (segid " " and resid "44 " and name "HD11") (segid " " and resid "49 " and name "HG2 ") ASSI { 5770} (segid " " and resid "49 " and name "HA ") (segid " " and resid "49 " and name "HG1 ") 5.000 5.000 0.000 peak 5770 weight 0.10000E+01 volume 0.92200E+00 ppm1 4.901 ppm2 2.259 OR { 5770} (segid " " and resid "49 " and name "HA ") (segid " " and resid "49 " and name "HG2 ") ASSI { 5867} (segid " " and resid "52 " and name "HA ") (segid " " and resid "52 " and name "HB1 ") 3.300 3.300 0.000 peak 5867 weight 0.10000E+01 volume 0.35550E+01 ppm1 4.371 ppm2 2.661 ASSI { 6057} (segid " " and resid "54 " and name "HD1 ") (segid " " and resid "59 " and name "HE2 ") 6.000 6.000 0.000 peak 6057 weight 0.10000E+01 volume -0.21100E+00 ppm1 3.182 ppm2 6.864 OR { 6057} (segid " " and resid "54 " and name "HD2 ") (segid " " and resid "59 " and name "HE2 ") ASSI { 6132} (segid " " and resid "67 " and name "HG11") (segid " " and resid "61 " and name "HD11") 6.000 6.000 0.000 peak 6132 weight 0.10000E+01 volume 0.15000E+00 ppm1 1.487 ppm2 0.389 OR { 6132} (segid " " and resid "67 " and name "HG11") (segid " " and resid "61 " and name "HD12") ASSI { 6123} (segid " " and resid "19 " and name "HA ") (segid " " and resid "61 " and name "HD13") 6.000 6.000 0.000 peak 6123 weight 0.10000E+01 volume 0.13200E+00 ppm1 3.983 ppm2 0.389 OR { 6123} (segid " " and resid "19 " and name "HA ") (segid " " and resid "61 " and name "HD12") OR { 6123} (segid " " and resid "19 " and name "HA ") (segid " " and resid "61 " and name "HD11") ASSI { 6112} (segid " " and resid "3 " and name "HB ") (segid " " and resid "61 " and name "HG23") 6.000 6.000 0.000 peak 6112 weight 0.10000E+01 volume -0.13500E+00 ppm1 2.056 ppm2 0.338 OR { 6112} (segid " " and resid "3 " and name "HB ") (segid " " and resid "61 " and name "HG21") OR { 6112} (segid " " and resid "3 " and name "HB ") (segid " " and resid "61 " and name "HG22") ASSI { 6304} (segid " " and resid "44 " and name "HG11") (segid " " and resid "68 " and name "HB2 ") 6.000 6.000 0.000 peak 6304 weight 0.10000E+01 volume 0.17700E+00 ppm1 1.358 ppm2 3.092 OR { 6304} (segid " " and resid "44 " and name "HG11") (segid " " and resid "68 " and name "HB1 ") ASSI { 6311} (segid " " and resid "43 " and name "HD21") (segid " " and resid "69 " and name "HA ") 5.000 5.000 0.000 peak 6311 weight 0.10000E+01 volume -0.14380E+01 ppm1 0.752 ppm2 5.074 OR { 6311} (segid " " and resid "43 " and name "HD22") (segid " " and resid "69 " and name "HA ") OR { 6311} (segid " " and resid "43 " and name "HD23") (segid " " and resid "69 " and name "HA ") ASSI { 6358} (segid " " and resid "44 " and name "HD11") (segid " " and resid "70 " and name "HG21") 5.000 5.000 0.000 peak 6358 weight 0.10000E+01 volume 0.88100E+00 ppm1 0.661 ppm2 0.808 OR { 6358} (segid " " and resid "44 " and name "HD13") (segid " " and resid "70 " and name "HG21") OR { 6358} (segid " " and resid "44 " and name "HD13") (segid " " and resid "70 " and name "HG22") OR { 6358} (segid " " and resid "44 " and name "HD11") (segid " " and resid "70 " and name "HG22") OR { 6358} (segid " " and resid "44 " and name "HD12") (segid " " and resid "70 " and name "HG22") OR { 6358} (segid " " and resid "44 " and name "HD13") (segid " " and resid "70 " and name "HG23") ASSI { 6360} (segid " " and resid "70 " and name "HG12") (segid " " and resid "72 " and name "HA ") 6.000 6.000 0.000 peak 6360 weight 0.10000E+01 volume -0.11900E+00 ppm1 0.914 ppm2 4.216 OR { 6360} (segid " " and resid "70 " and name "HG13") (segid " " and resid "72 " and name "HA ") OR { 6360} (segid " " and resid "70 " and name "HG11") (segid " " and resid "72 " and name "HA ") ASSI { 6361} (segid " " and resid "72 " and name "HB2 ") (segid " " and resid "72 " and name "HA ") 5.000 5.000 0.000 peak 6361 weight 0.10000E+01 volume -0.12360E+01 ppm1 1.513 ppm2 4.216 ASSI { 6369} (segid " " and resid "72 " and name "HG2 ") (segid " " and resid "72 " and name "HB1 ") 2.700 2.700 0.000 peak 6369 weight 0.10000E+01 volume 0.45900E+01 ppm1 1.488 ppm2 1.739 OR { 6369} (segid " " and resid "72 " and name "HG1 ") (segid " " and resid "72 " and name "HB1 ") ASSI { 4945} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "3 " and name "HG11") 5.000 5.000 0.000 peak 4945 weight 0.10000E+01 volume 0.17110E+01 ppm1 1.518 ppm2 0.605 OR { 4945} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "3 " and name "HG12") OR { 4945} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "3 " and name "HG13") OR { 4945} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "3 " and name "HG13") OR { 4945} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "3 " and name "HG11") OR { 4945} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "3 " and name "HG12") ASSI { 4794} (segid " " and resid "4 " and name "HB1 ") (segid " " and resid "12 " and name "HG22") 5.000 5.000 0.000 peak 4794 weight 0.10000E+01 volume -0.15260E+01 ppm1 2.813 ppm2 1.048 OR { 4794} (segid " " and resid "4 " and name "HB1 ") (segid " " and resid "12 " and name "HG21") OR { 4794} (segid " " and resid "4 " and name "HB1 ") (segid " " and resid "12 " and name "HG23") ASSI { 4793} (segid " " and resid "4 " and name "HB2 ") (segid " " and resid "12 " and name "HG21") 5.000 5.000 0.000 peak 4793 weight 0.10000E+01 volume -0.72100E+00 ppm1 3.107 ppm2 1.048 OR { 4793} (segid " " and resid "4 " and name "HB2 ") (segid " " and resid "12 " and name "HG22") OR { 4793} (segid " " and resid "4 " and name "HB2 ") (segid " " and resid "12 " and name "HG23") ASSI { 4806} (segid " " and resid "5 " and name "HA ") (segid " " and resid "66 " and name "HG23") 5.000 5.000 0.000 peak 4806 weight 0.10000E+01 volume -0.43800E+00 ppm1 5.440 ppm2 0.956 OR { 4806} (segid " " and resid "5 " and name "HA ") (segid " " and resid "66 " and name "HG22") OR { 4806} (segid " " and resid "5 " and name "HA ") (segid " " and resid "66 " and name "HG21") OR { 4806} (segid " " and resid "5 " and name "HA ") (segid " " and resid "13 " and name "HG13") ASSI { 5425} (segid " " and resid "5 " and name "HD23") (segid " " and resid "34 " and name "HG1 ") 5.000 5.000 0.000 peak 5425 weight 0.10000E+01 volume -0.49900E+00 ppm1 0.684 ppm2 2.001 OR { 5425} (segid " " and resid "5 " and name "HD22") (segid " " and resid "34 " and name "HG1 ") OR { 5425} (segid " " and resid "5 " and name "HD23") (segid " " and resid "34 " and name "HG2 ") OR { 5425} (segid " " and resid "5 " and name "HD21") (segid " " and resid "34 " and name "HG1 ") ASSI { 4808} (segid " " and resid "6 " and name "HA ") (segid " " and resid "13 " and name "HG12") 5.000 5.000 0.000 peak 4808 weight 0.10000E+01 volume -0.39100E+00 ppm1 5.201 ppm2 0.956 OR { 4808} (segid " " and resid "6 " and name "HA ") (segid " " and resid "13 " and name "HG13") OR { 4808} (segid " " and resid "6 " and name "HA ") (segid " " and resid "13 " and name "HG11") ASSI { 4795} (segid " " and resid "6 " and name "HD1 ") (segid " " and resid "12 " and name "HG21") 5.000 5.000 0.000 peak 4795 weight 0.10000E+01 volume 0.48900E+00 ppm1 1.537 ppm2 1.048 OR { 4795} (segid " " and resid "6 " and name "HD2 ") (segid " " and resid "12 " and name "HG21") OR { 4795} (segid " " and resid "6 " and name "HD2 ") (segid " " and resid "12 " and name "HG23") OR { 4795} (segid " " and resid "6 " and name "HD1 ") (segid " " and resid "12 " and name "HG22") ASSI { 4753} (segid " " and resid "10 " and name "HA2 ") (segid " " and resid "11 " and name "HA ") 6.000 6.000 0.000 peak 4753 weight 0.10000E+01 volume 0.50000E-01 ppm1 3.605 ppm2 4.364 ASSI { 4790} (segid " " and resid "12 " and name "HA ") (segid " " and resid "12 " and name "HG21") 3.300 3.300 0.000 peak 4790 weight 0.10000E+01 volume 0.30660E+01 ppm1 5.303 ppm2 1.048 OR { 4790} (segid " " and resid "12 " and name "HA ") (segid " " and resid "12 " and name "HG22") OR { 4790} (segid " " and resid "12 " and name "HA ") (segid " " and resid "12 " and name "HG23") ASSI { 4792} (segid " " and resid "12 " and name "HB ") (segid " " and resid "12 " and name "HG23") 3.300 3.300 0.000 peak 4792 weight 0.10000E+01 volume 0.33920E+01 ppm1 3.924 ppm2 1.048 OR { 4792} (segid " " and resid "12 " and name "HB ") (segid " " and resid "12 " and name "HG22") OR { 4792} (segid " " and resid "12 " and name "HB ") (segid " " and resid "12 " and name "HG21") ASSI { 5300} (segid " " and resid "15 " and name "HG22") (segid " " and resid "30 " and name "HA ") 6.000 6.000 0.000 peak 5300 weight 0.10000E+01 volume 0.82000E-01 ppm1 0.935 ppm2 3.323 OR { 5300} (segid " " and resid "15 " and name "HG21") (segid " " and resid "30 " and name "HA ") OR { 5300} (segid " " and resid "15 " and name "HG23") (segid " " and resid "30 " and name "HA ") ASSI { 4502} (segid " " and resid "16 " and name "HG1 ") (segid " " and resid "16 " and name "HB2 ") 3.300 3.300 0.000 peak 4502 weight 0.10000E+01 volume -0.32200E+01 ppm1 2.208 ppm2 1.885 ASSI { 5589} (segid " " and resid "27 " and name "HE1 ") (segid " " and resid "41 " and name "HB1 ") 5.000 5.000 0.000 peak 5589 weight 0.10000E+01 volume -0.77500E+00 ppm1 2.750 ppm2 1.798 ASSI { 5254} (segid " " and resid "27 " and name "HE2 ") (segid " " and resid "27 " and name "HG2 ") 5.000 5.000 0.000 peak 5254 weight 0.10000E+01 volume -0.56500E+00 ppm1 2.611 ppm2 1.540 ASSI { 5023} (segid " " and resid "28 " and name "HA ") (segid " " and resid "38 " and name "HG1 ") 5.000 5.000 0.000 peak 5023 weight 0.10000E+01 volume -0.40000E+00 ppm1 4.161 ppm2 2.195 ASSI { 4499} (segid " " and resid "29 " and name "HA ") (segid " " and resid "29 " and name "HD1 ") 5.000 5.000 0.000 peak 4499 weight 0.10000E+01 volume 0.35700E+00 ppm1 4.175 ppm2 1.885 ASSI { 5340} (segid " " and resid "30 " and name "HG12") (segid " " and resid "30 " and name "HG21") 5.000 5.000 0.000 peak 5340 weight 0.10000E+01 volume 0.65000E+00 ppm1 0.331 ppm2 0.519 OR { 5340} (segid " " and resid "30 " and name "HG12") (segid " " and resid "30 " and name "HG22") OR { 5340} (segid " " and resid "30 " and name "HG12") (segid " " and resid "30 " and name "HG23") ASSI { 5424} (segid " " and resid "36 " and name "HD11") (segid " " and resid "34 " and name "HG1 ") 5.000 5.000 0.000 peak 5424 weight 0.10000E+01 volume -0.42300E+00 ppm1 0.789 ppm2 2.001 OR { 5424} (segid " " and resid "36 " and name "HD13") (segid " " and resid "34 " and name "HG1 ") OR { 5424} (segid " " and resid "36 " and name "HD12") (segid " " and resid "34 " and name "HG1 ") ASSI { 4437} (segid " " and resid "63 " and name "HA ") (segid " " and resid "1 " and name "HB1 ") 5.000 5.000 0.000 peak 4437 weight 0.10000E+01 volume 0.73000E+00 ppm1 3.931 ppm2 2.122 ASSI { 5685} (segid " " and resid "68 " and name "HB1 ") (segid " " and resid "44 " and name "HD13") 6.000 6.000 0.000 peak 5685 weight 0.10000E+01 volume 0.16300E+00 ppm1 3.090 ppm2 0.658 OR { 5685} (segid " " and resid "68 " and name "HB2 ") (segid " " and resid "44 " and name "HD12") OR { 5685} (segid " " and resid "68 " and name "HB2 ") (segid " " and resid "44 " and name "HD13") OR { 5685} (segid " " and resid "68 " and name "HB1 ") (segid " " and resid "44 " and name "HD12") ASSI { 6328} (segid " " and resid "69 " and name "HA ") (segid " " and resid "69 " and name "HD12") 3.300 3.300 0.000 peak 6328 weight 0.10000E+01 volume -0.28210E+01 ppm1 5.074 ppm2 0.801 OR { 6328} (segid " " and resid "69 " and name "HA ") (segid " " and resid "69 " and name "HD13") OR { 6328} (segid " " and resid "69 " and name "HA ") (segid " " and resid "69 " and name "HD11") OR { 6328} (segid " " and resid "69 " and name "HA ") (segid " " and resid "43 " and name "HD21") OR { 6328} (segid " " and resid "69 " and name "HA ") (segid " " and resid "43 " and name "HD23") ASSI { 5422} (segid " " and resid "69 " and name "HD21") (segid " " and resid "34 " and name "HG1 ") 5.000 5.000 0.000 peak 5422 weight 0.10000E+01 volume -0.35800E+00 ppm1 0.788 ppm2 2.001 OR { 5422} (segid " " and resid "69 " and name "HD23") (segid " " and resid "34 " and name "HG1 ") OR { 5422} (segid " " and resid "69 " and name "HD22") (segid " " and resid "34 " and name "HG1 ") OR { 5422} (segid " " and resid "69 " and name "HD22") (segid " " and resid "34 " and name "HG2 ") ASSI { 1801} (segid " " and resid "1 " and name "HA ") (segid " " and resid "1 " and name "HB1 ") 5.000 5.000 0.000 peak 1801 weight 0.10000E+01 volume -0.19640E+01 ppm1 4.182 ppm2 2.126 ASSI { 1809} (segid " " and resid "1 " and name "HB1 ") (segid " " and resid "1 " and name "HG2 ") 2.700 2.700 0.000 peak 1809 weight 0.10000E+01 volume -0.44100E+01 ppm1 2.126 ppm2 2.021 ASSI { 4481} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "1 " and name "HB1 ") 5.000 5.000 0.000 peak 4481 weight 0.10000E+01 volume -0.12920E+01 ppm1 1.519 ppm2 2.123 OR { 4481} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "1 " and name "HB1 ") OR { 4481} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "1 " and name "HB1 ") ASSI { 4470} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "3 " and name "HA ") 6.000 6.000 0.000 peak 4470 weight 0.10000E+01 volume -0.15400E+00 ppm1 1.519 ppm2 4.172 OR { 4470} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "3 " and name "HA ") OR { 4470} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "3 " and name "HA ") ASSI { 1967} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "3 " and name "HG11") 3.300 3.300 0.000 peak 1967 weight 0.10000E+01 volume -0.23800E+01 ppm1 1.520 ppm2 0.572 OR { 1967} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "3 " and name "HG13") OR { 1967} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "3 " and name "HG11") OR { 1967} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "3 " and name "HG12") OR { 1967} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "3 " and name "HG13") OR { 1967} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "3 " and name "HG13") OR { 1967} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "3 " and name "HG11") OR { 1967} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "3 " and name "HG12") OR { 1967} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "3 " and name "HG12") ASSI { 1979} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "18 " and name "HA ") 6.000 6.000 0.000 peak 1979 weight 0.10000E+01 volume -0.22700E+00 ppm1 1.520 ppm2 5.025 OR { 1979} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "18 " and name "HA ") OR { 1979} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "18 " and name "HA ") ASSI { 1970} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "19 " and name "HA ") 5.000 5.000 0.000 peak 1970 weight 0.10000E+01 volume -0.14160E+01 ppm1 1.520 ppm2 3.997 OR { 1970} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "19 " and name "HA ") OR { 1970} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "19 " and name "HA ") ASSI { 1972} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "19 " and name "HB1 ") 5.000 5.000 0.000 peak 1972 weight 0.10000E+01 volume -0.57300E+00 ppm1 1.520 ppm2 2.337 OR { 1972} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "19 " and name "HB1 ") OR { 1972} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "19 " and name "HB1 ") ASSI { 4473} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "19 " and name "HD1 ") 5.000 5.000 0.000 peak 4473 weight 0.10000E+01 volume -0.14990E+01 ppm1 1.519 ppm2 4.016 OR { 4473} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "19 " and name "HD1 ") OR { 4473} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "19 " and name "HD1 ") ASSI { 1973} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "19 " and name "HD2 ") 5.000 5.000 0.000 peak 1973 weight 0.10000E+01 volume -0.59700E+00 ppm1 1.520 ppm2 3.734 OR { 1973} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "19 " and name "HD2 ") OR { 1973} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "19 " and name "HD2 ") ASSI { 1978} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "56 " and name "HB1 ") 6.000 6.000 0.000 peak 1978 weight 0.10000E+01 volume -0.22100E+00 ppm1 1.520 ppm2 1.046 OR { 1978} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "56 " and name "HB1 ") OR { 1978} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "56 " and name "HB1 ") ASSI { 1983} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "61 " and name "HA ") 6.000 6.000 0.000 peak 1983 weight 0.10000E+01 volume -0.95000E-01 ppm1 1.520 ppm2 3.180 OR { 1983} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "61 " and name "HA ") OR { 1983} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "61 " and name "HA ") ASSI { 1976} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "61 " and name "HB ") 6.000 6.000 0.000 peak 1976 weight 0.10000E+01 volume -0.27100E+00 ppm1 1.520 ppm2 1.125 OR { 1976} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "61 " and name "HB ") OR { 1976} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "61 " and name "HB ") ASSI { 1969} (segid " " and resid "1 " and name "HE2 ") (segid " " and resid "62 " and name "HA ") 5.000 5.000 0.000 peak 1969 weight 0.10000E+01 volume -0.11160E+01 ppm1 1.520 ppm2 4.551 OR { 1969} (segid " " and resid "1 " and name "HE3 ") (segid " " and resid "62 " and name "HA ") OR { 1969} (segid " " and resid "1 " and name "HE1 ") (segid " " and resid "62 " and name "HA ") ASSI { 1831} (segid " " and resid "1 " and name "HG2 ") (segid " " and resid "1 " and name "HA ") 5.000 5.000 0.000 peak 1831 weight 0.10000E+01 volume -0.45100E+00 ppm1 2.021 ppm2 4.182 ASSI { 1819} (segid " " and resid "1 " and name "HG1 ") (segid " " and resid "1 " and name "HB2 ") 2.700 2.700 0.000 peak 1819 weight 0.10000E+01 volume -0.44450E+01 ppm1 2.495 ppm2 2.021 ASSI { 1829} (segid " " and resid "1 " and name "HG2 ") (segid " " and resid "1 " and name "HE1 ") 5.000 5.000 0.000 peak 1829 weight 0.10000E+01 volume -0.66100E+00 ppm1 2.021 ppm2 1.520 OR { 1829} (segid " " and resid "1 " and name "HG2 ") (segid " " and resid "1 " and name "HE3 ") OR { 1829} (segid " " and resid "1 " and name "HG2 ") (segid " " and resid "1 " and name "HE2 ") ASSI { 4455} (segid " " and resid "1 " and name "HG1 ") (segid " " and resid "1 " and name "HG2 ") 2.700 2.700 0.000 peak 4455 weight 0.10000E+01 volume -0.46550E+01 ppm1 2.493 ppm2 2.014 ASSI { 1822} (segid " " and resid "1 " and name "HG1 ") (segid " " and resid "17 " and name "HG23") 5.000 5.000 0.000 peak 1822 weight 0.10000E+01 volume -0.65600E+00 ppm1 2.495 ppm2 0.387 OR { 1822} (segid " " and resid "1 " and name "HG1 ") (segid " " and resid "17 " and name "HG21") OR { 1822} (segid " " and resid "1 " and name "HG1 ") (segid " " and resid "17 " and name "HG22") ASSI { 1830} (segid " " and resid "1 " and name "HG2 ") (segid " " and resid "17 " and name "HG22") 5.000 5.000 0.000 peak 1830 weight 0.10000E+01 volume -0.47700E+00 ppm1 2.021 ppm2 0.387 OR { 1830} (segid " " and resid "1 " and name "HG2 ") (segid " " and resid "17 " and name "HG21") OR { 1830} (segid " " and resid "1 " and name "HG2 ") (segid " " and resid "17 " and name "HG23") ASSI { 4133} (segid " " and resid "2 " and name "HG1 ") (segid " " and resid "14 " and name "HB ") 6.000 6.000 0.000 peak 4133 weight 0.10000E+01 volume -0.10400E+00 ppm1 2.311 ppm2 4.024 ASSI { 1858} (segid " " and resid "3 " and name "HA ") (segid " " and resid "3 " and name "HG13") 3.300 3.300 0.000 peak 1858 weight 0.10000E+01 volume -0.30540E+01 ppm1 4.182 ppm2 0.572 OR { 1858} (segid " " and resid "3 " and name "HA ") (segid " " and resid "3 " and name "HG11") OR { 1858} (segid " " and resid "3 " and name "HA ") (segid " " and resid "3 " and name "HG12") ASSI { 4519} (segid " " and resid "3 " and name "HA ") (segid " " and resid "3 " and name "HG23") 3.300 3.300 0.000 peak 4519 weight 0.10000E+01 volume -0.31390E+01 ppm1 4.174 ppm2 0.578 OR { 4519} (segid " " and resid "3 " and name "HA ") (segid " " and resid "3 " and name "HG21") OR { 4519} (segid " " and resid "3 " and name "HA ") (segid " " and resid "3 " and name "HG22") ASSI { 1864} (segid " " and resid "3 " and name "HA ") (segid " " and resid "61 " and name "HG21") 6.000 6.000 0.000 peak 1864 weight 0.10000E+01 volume -0.16500E+00 ppm1 4.182 ppm2 0.361 OR { 1864} (segid " " and resid "3 " and name "HA ") (segid " " and resid "61 " and name "HG23") OR { 1864} (segid " " and resid "3 " and name "HA ") (segid " " and resid "61 " and name "HG22") ASSI { 1860} (segid " " and resid "3 " and name "HA ") (segid " " and resid "64 " and name "HA ") 5.000 5.000 0.000 peak 1860 weight 0.10000E+01 volume -0.11430E+01 ppm1 4.182 ppm2 3.154 ASSI { 1861} (segid " " and resid "3 " and name "HA ") (segid " " and resid "67 " and name "HD13") 6.000 6.000 0.000 peak 1861 weight 0.10000E+01 volume -0.22300E+00 ppm1 4.182 ppm2 0.703 OR { 1861} (segid " " and resid "3 " and name "HA ") (segid " " and resid "67 " and name "HD12") OR { 1861} (segid " " and resid "3 " and name "HA ") (segid " " and resid "67 " and name "HD11") ASSI { 4553} (segid " " and resid "3 " and name "HG13") (segid " " and resid "1 " and name "HG2 ") 3.300 3.300 0.000 peak 4553 weight 0.10000E+01 volume -0.22960E+01 ppm1 0.568 ppm2 2.021 OR { 4553} (segid " " and resid "3 " and name "HG11") (segid " " and resid "1 " and name "HG2 ") OR { 4553} (segid " " and resid "3 " and name "HG12") (segid " " and resid "1 " and name "HG2 ") ASSI { 1899} (segid " " and resid "3 " and name "HG13") (segid " " and resid "15 " and name "HB ") 6.000 6.000 0.000 peak 1899 weight 0.10000E+01 volume -0.12200E+00 ppm1 0.572 ppm2 1.678 OR { 1899} (segid " " and resid "3 " and name "HG12") (segid " " and resid "15 " and name "HB ") OR { 1899} (segid " " and resid "3 " and name "HG11") (segid " " and resid "15 " and name "HB ") ASSI { 1900} (segid " " and resid "3 " and name "HG12") (segid " " and resid "26 " and name "HZ ") 6.000 6.000 0.000 peak 1900 weight 0.10000E+01 volume -0.91000E-01 ppm1 0.572 ppm2 6.817 OR { 1900} (segid " " and resid "3 " and name "HG11") (segid " " and resid "26 " and name "HZ ") OR { 1900} (segid " " and resid "3 " and name "HG13") (segid " " and resid "26 " and name "HZ ") ASSI { 1889} (segid " " and resid "3 " and name "HG11") (segid " " and resid "61 " and name "HG21") 3.300 3.300 0.000 peak 1889 weight 0.10000E+01 volume -0.28160E+01 ppm1 0.572 ppm2 0.361 OR { 1889} (segid " " and resid "3 " and name "HG11") (segid " " and resid "61 " and name "HG23") OR { 1889} (segid " " and resid "3 " and name "HG12") (segid " " and resid "61 " and name "HG22") OR { 1889} (segid " " and resid "3 " and name "HG12") (segid " " and resid "61 " and name "HG21") OR { 1889} (segid " " and resid "3 " and name "HG12") (segid " " and resid "61 " and name "HG23") OR { 1889} (segid " " and resid "3 " and name "HG13") (segid " " and resid "61 " and name "HG21") OR { 1889} (segid " " and resid "3 " and name "HG11") (segid " " and resid "61 " and name "HG22") OR { 1889} (segid " " and resid "3 " and name "HG13") (segid " " and resid "61 " and name "HG22") OR { 1889} (segid " " and resid "3 " and name "HG13") (segid " " and resid "61 " and name "HG23") ASSI { 1896} (segid " " and resid "3 " and name "HG11") (segid " " and resid "64 " and name "HA ") 6.000 6.000 0.000 peak 1896 weight 0.10000E+01 volume -0.14700E+00 ppm1 0.572 ppm2 3.154 OR { 1896} (segid " " and resid "3 " and name "HG13") (segid " " and resid "64 " and name "HA ") OR { 1896} (segid " " and resid "3 " and name "HG12") (segid " " and resid "64 " and name "HA ") ASSI { 4547} (segid " " and resid "3 " and name "HG12") (segid " " and resid "65 " and name "HB1 ") 5.000 5.000 0.000 peak 4547 weight 0.10000E+01 volume -0.45100E+00 ppm1 0.568 ppm2 3.971 OR { 4547} (segid " " and resid "3 " and name "HG11") (segid " " and resid "65 " and name "HB1 ") OR { 4547} (segid " " and resid "3 " and name "HG13") (segid " " and resid "65 " and name "HB1 ") ASSI { 1880} (segid " " and resid "3 " and name "HG23") (segid " " and resid "4 " and name "HA ") 6.000 6.000 0.000 peak 1880 weight 0.10000E+01 volume -0.10000E+00 ppm1 0.585 ppm2 5.446 OR { 1880} (segid " " and resid "3 " and name "HG22") (segid " " and resid "4 " and name "HA ") OR { 1880} (segid " " and resid "3 " and name "HG21") (segid " " and resid "4 " and name "HA ") ASSI { 1870} (segid " " and resid "3 " and name "HG21") (segid " " and resid "15 " and name "HB ") 5.000 5.000 0.000 peak 1870 weight 0.10000E+01 volume -0.11480E+01 ppm1 0.585 ppm2 1.705 OR { 1870} (segid " " and resid "3 " and name "HG22") (segid " " and resid "15 " and name "HB ") OR { 1870} (segid " " and resid "3 " and name "HG23") (segid " " and resid "15 " and name "HB ") ASSI { 1876} (segid " " and resid "3 " and name "HG21") (segid " " and resid "26 " and name "HE1 ") 5.000 5.000 0.000 peak 1876 weight 0.10000E+01 volume -0.60900E+00 ppm1 0.585 ppm2 6.896 OR { 1876} (segid " " and resid "3 " and name "HG22") (segid " " and resid "26 " and name "HE1 ") OR { 1876} (segid " " and resid "3 " and name "HG23") (segid " " and resid "26 " and name "HE1 ") OR { 1876} (segid " " and resid "3 " and name "HG21") (segid " " and resid "26 " and name "HE2 ") OR { 1876} (segid " " and resid "3 " and name "HG22") (segid " " and resid "26 " and name "HE2 ") OR { 1876} (segid " " and resid "3 " and name "HG23") (segid " " and resid "26 " and name "HE2 ") ASSI { 1873} (segid " " and resid "3 " and name "HG21") (segid " " and resid "26 " and name "HZ ") 5.000 5.000 0.000 peak 1873 weight 0.10000E+01 volume -0.76300E+00 ppm1 0.585 ppm2 6.817 OR { 1873} (segid " " and resid "3 " and name "HG22") (segid " " and resid "26 " and name "HZ ") OR { 1873} (segid " " and resid "3 " and name "HG23") (segid " " and resid "26 " and name "HZ ") ASSI { 4542} (segid " " and resid "3 " and name "HG21") (segid " " and resid "67 " and name "HG12") 6.000 6.000 0.000 peak 4542 weight 0.10000E+01 volume -0.11400E+00 ppm1 0.581 ppm2 1.179 OR { 4542} (segid " " and resid "3 " and name "HG22") (segid " " and resid "67 " and name "HG12") OR { 4542} (segid " " and resid "3 " and name "HG23") (segid " " and resid "67 " and name "HG12") ASSI { 1902} (segid " " and resid "4 " and name "HA ") (segid " " and resid "4 " and name "HB1 ") 5.000 5.000 0.000 peak 1902 weight 0.10000E+01 volume -0.13280E+01 ppm1 5.446 ppm2 2.811 ASSI { 1904} (segid " " and resid "4 " and name "HA ") (segid " " and resid "4 " and name "HB2 ") 5.000 5.000 0.000 peak 1904 weight 0.10000E+01 volume -0.83100E+00 ppm1 5.446 ppm2 3.128 ASSI { 1903} (segid " " and resid "4 " and name "HA ") (segid " " and resid "4 " and name "HD1 ") 5.000 5.000 0.000 peak 1903 weight 0.10000E+01 volume -0.10620E+01 ppm1 5.446 ppm2 7.054 OR { 1903} (segid " " and resid "4 " and name "HA ") (segid " " and resid "4 " and name "HD2 ") ASSI { 1909} (segid " " and resid "4 " and name "HA ") (segid " " and resid "4 " and name "HE1 ") 6.000 6.000 0.000 peak 1909 weight 0.10000E+01 volume -0.98000E-01 ppm1 5.433 ppm2 7.265 OR { 1909} (segid " " and resid "4 " and name "HA ") (segid " " and resid "4 " and name "HE2 ") ASSI { 1906} (segid " " and resid "4 " and name "HA ") (segid " " and resid "12 " and name "HG23") 5.000 5.000 0.000 peak 1906 weight 0.10000E+01 volume -0.42500E+00 ppm1 5.446 ppm2 1.046 OR { 1906} (segid " " and resid "4 " and name "HA ") (segid " " and resid "12 " and name "HG22") OR { 1906} (segid " " and resid "4 " and name "HA ") (segid " " and resid "12 " and name "HG21") ASSI { 1901} (segid " " and resid "4 " and name "HA ") (segid " " and resid "14 " and name "HA ") 5.000 5.000 0.000 peak 1901 weight 0.10000E+01 volume -0.15510E+01 ppm1 5.446 ppm2 5.104 ASSI { 1911} (segid " " and resid "4 " and name "HA ") (segid " " and resid "14 " and name "HB ") 6.000 6.000 0.000 peak 1911 weight 0.10000E+01 volume -0.80000E-01 ppm1 5.433 ppm2 4.024 ASSI { 1905} (segid " " and resid "4 " and name "HA ") (segid " " and resid "14 " and name "HG22") 5.000 5.000 0.000 peak 1905 weight 0.10000E+01 volume -0.50600E+00 ppm1 5.446 ppm2 1.099 OR { 1905} (segid " " and resid "4 " and name "HA ") (segid " " and resid "14 " and name "HG21") OR { 1905} (segid " " and resid "4 " and name "HA ") (segid " " and resid "14 " and name "HG23") ASSI { 1917} (segid " " and resid "4 " and name "HB2 ") (segid " " and resid "4 " and name "HB1 ") 3.300 3.300 0.000 peak 1917 weight 0.10000E+01 volume -0.26820E+01 ppm1 3.114 ppm2 2.811 ASSI { 1924} (segid " " and resid "4 " and name "HB1 ") (segid " " and resid "4 " and name "HD2 ") 5.000 5.000 0.000 peak 1924 weight 0.10000E+01 volume -0.45900E+00 ppm1 2.825 ppm2 7.054 OR { 1924} (segid " " and resid "4 " and name "HB1 ") (segid " " and resid "4 " and name "HD1 ") ASSI { 1921} (segid " " and resid "4 " and name "HB2 ") (segid " " and resid "4 " and name "HD2 ") 5.000 5.000 0.000 peak 1921 weight 0.10000E+01 volume -0.52500E+00 ppm1 3.114 ppm2 7.054 OR { 1921} (segid " " and resid "4 " and name "HB2 ") (segid " " and resid "4 " and name "HD1 ") ASSI { 1923} (segid " " and resid "4 " and name "HB1 ") (segid " " and resid "66 " and name "HA ") 5.000 5.000 0.000 peak 1923 weight 0.10000E+01 volume -0.52500E+00 ppm1 2.811 ppm2 5.315 ASSI { 1918} (segid " " and resid "4 " and name "HB2 ") (segid " " and resid "66 " and name "HA ") 5.000 5.000 0.000 peak 1918 weight 0.10000E+01 volume -0.92600E+00 ppm1 3.114 ppm2 5.341 ASSI { 4585} (segid " " and resid "4 " and name "HD1 ") (segid " " and resid "64 " and name "HA ") 5.000 5.000 0.000 peak 4585 weight 0.10000E+01 volume -0.55700E+00 ppm1 7.047 ppm2 3.153 OR { 4585} (segid " " and resid "4 " and name "HD2 ") (segid " " and resid "64 " and name "HA ") ASSI { 1986} (segid " " and resid "4 " and name "HZ ") (segid " " and resid "4 " and name "HD2 ") 5.000 5.000 0.000 peak 1986 weight 0.10000E+01 volume -0.65600E+00 ppm1 7.238 ppm2 7.054 OR { 1986} (segid " " and resid "4 " and name "HZ ") (segid " " and resid "4 " and name "HD1 ") ASSI { 1988} (segid " " and resid "4 " and name "HZ ") (segid " " and resid "64 " and name "HB1 ") 6.000 6.000 0.000 peak 1988 weight 0.10000E+01 volume -0.13900E+00 ppm1 7.238 ppm2 2.469 ASSI { 1929} (segid " " and resid "5 " and name "HA ") (segid " " and resid "5 " and name "HB1 ") 5.000 5.000 0.000 peak 1929 weight 0.10000E+01 volume -0.12630E+01 ppm1 5.446 ppm2 1.889 ASSI { 1928} (segid " " and resid "5 " and name "HA ") (segid " " and resid "5 " and name "HB2 ") 5.000 5.000 0.000 peak 1928 weight 0.10000E+01 volume -0.13420E+01 ppm1 5.446 ppm2 1.125 ASSI { 4594} (segid " " and resid "5 " and name "HA ") (segid " " and resid "5 " and name "HD21") 5.000 5.000 0.000 peak 4594 weight 0.10000E+01 volume -0.11120E+01 ppm1 5.444 ppm2 0.686 OR { 4594} (segid " " and resid "5 " and name "HA ") (segid " " and resid "5 " and name "HD22") OR { 4594} (segid " " and resid "5 " and name "HA ") (segid " " and resid "5 " and name "HD23") ASSI { 1930} (segid " " and resid "5 " and name "HA ") (segid " " and resid "5 " and name "HG ") 5.000 5.000 0.000 peak 1930 weight 0.10000E+01 volume -0.68800E+00 ppm1 5.446 ppm2 1.309 ASSI { 2369} (segid " " and resid "5 " and name "HA ") (segid " " and resid "67 " and name "HB ") 5.000 5.000 0.000 peak 2369 weight 0.10000E+01 volume -0.11500E+01 ppm1 5.442 ppm2 1.851 ASSI { 1932} (segid " " and resid "5 " and name "HB2 ") (segid " " and resid "5 " and name "HB1 ") 3.300 3.300 0.000 peak 1932 weight 0.10000E+01 volume -0.29900E+01 ppm1 1.125 ppm2 1.916 ASSI { 4605} (segid " " and resid "5 " and name "HB1 ") (segid " " and resid "5 " and name "HD11") 5.000 5.000 0.000 peak 4605 weight 0.10000E+01 volume -0.83500E+00 ppm1 1.899 ppm2 0.753 OR { 4605} (segid " " and resid "5 " and name "HB1 ") (segid " " and resid "5 " and name "HD13") OR { 4605} (segid " " and resid "5 " and name "HB1 ") (segid " " and resid "5 " and name "HD12") ASSI { 1943} (segid " " and resid "5 " and name "HB2 ") (segid " " and resid "5 " and name "HD21") 5.000 5.000 0.000 peak 1943 weight 0.10000E+01 volume -0.93400E+00 ppm1 1.125 ppm2 0.677 OR { 1943} (segid " " and resid "5 " and name "HB2 ") (segid " " and resid "5 " and name "HD23") OR { 1943} (segid " " and resid "5 " and name "HB2 ") (segid " " and resid "5 " and name "HD22") ASSI { 1934} (segid " " and resid "5 " and name "HB1 ") (segid " " and resid "5 " and name "HG ") 5.000 5.000 0.000 peak 1934 weight 0.10000E+01 volume -0.98000E+00 ppm1 1.902 ppm2 1.309 ASSI { 1940} (segid " " and resid "5 " and name "HB2 ") (segid " " and resid "5 " and name "HG ") 5.000 5.000 0.000 peak 1940 weight 0.10000E+01 volume -0.14090E+01 ppm1 1.125 ppm2 1.309 ASSI { 1938} (segid " " and resid "5 " and name "HB1 ") (segid " " and resid "13 " and name "HB ") 5.000 5.000 0.000 peak 1938 weight 0.10000E+01 volume -0.38800E+00 ppm1 1.902 ppm2 2.153 ASSI { 2009} (segid " " and resid "5 " and name "HD12") (segid " " and resid "26 " and name "HE2 ") 5.000 5.000 0.000 peak 2009 weight 0.10000E+01 volume -0.33100E+00 ppm1 0.756 ppm2 6.896 OR { 2009} (segid " " and resid "5 " and name "HD11") (segid " " and resid "26 " and name "HE2 ") OR { 2009} (segid " " and resid "5 " and name "HD13") (segid " " and resid "26 " and name "HE2 ") OR { 2009} (segid " " and resid "5 " and name "HD12") (segid " " and resid "26 " and name "HE1 ") OR { 2009} (segid " " and resid "5 " and name "HD13") (segid " " and resid "26 " and name "HE1 ") OR { 2009} (segid " " and resid "5 " and name "HD11") (segid " " and resid "26 " and name "HE1 ") ASSI { 2007} (segid " " and resid "5 " and name "HD11") (segid " " and resid "26 " and name "HZ ") 5.000 5.000 0.000 peak 2007 weight 0.10000E+01 volume -0.46700E+00 ppm1 0.756 ppm2 6.817 OR { 2007} (segid " " and resid "5 " and name "HD12") (segid " " and resid "26 " and name "HZ ") OR { 2007} (segid " " and resid "5 " and name "HD13") (segid " " and resid "26 " and name "HZ ") ASSI { 2006} (segid " " and resid "5 " and name "HD12") (segid " " and resid "67 " and name "HB ") 5.000 5.000 0.000 peak 2006 weight 0.10000E+01 volume -0.17310E+01 ppm1 0.756 ppm2 1.836 OR { 2006} (segid " " and resid "5 " and name "HD11") (segid " " and resid "67 " and name "HB ") OR { 2006} (segid " " and resid "5 " and name "HD13") (segid " " and resid "67 " and name "HB ") ASSI { 2019} (segid " " and resid "5 " and name "HD22") (segid " " and resid "13 " and name "HB ") 6.000 6.000 0.000 peak 2019 weight 0.10000E+01 volume -0.18800E+00 ppm1 0.690 ppm2 2.153 OR { 2019} (segid " " and resid "5 " and name "HD21") (segid " " and resid "13 " and name "HB ") OR { 2019} (segid " " and resid "5 " and name "HD23") (segid " " and resid "13 " and name "HB ") ASSI { 2020} (segid " " and resid "5 " and name "HD21") (segid " " and resid "30 " and name "HA ") 6.000 6.000 0.000 peak 2020 weight 0.10000E+01 volume -0.14800E+00 ppm1 0.690 ppm2 3.312 OR { 2020} (segid " " and resid "5 " and name "HD23") (segid " " and resid "30 " and name "HA ") OR { 2020} (segid " " and resid "5 " and name "HD22") (segid " " and resid "30 " and name "HA ") ASSI { 1994} (segid " " and resid "5 " and name "HD22") (segid " " and resid "30 " and name "HG11") 5.000 5.000 0.000 peak 1994 weight 0.10000E+01 volume -0.18660E+01 ppm1 0.690 ppm2 1.309 OR { 1994} (segid " " and resid "5 " and name "HD23") (segid " " and resid "30 " and name "HG11") OR { 1994} (segid " " and resid "5 " and name "HD21") (segid " " and resid "30 " and name "HG11") ASSI { 2015} (segid " " and resid "5 " and name "HD23") (segid " " and resid "30 " and name "HG12") 5.000 5.000 0.000 peak 2015 weight 0.10000E+01 volume -0.52700E+00 ppm1 0.690 ppm2 0.334 OR { 2015} (segid " " and resid "5 " and name "HD22") (segid " " and resid "30 " and name "HG12") OR { 2015} (segid " " and resid "5 " and name "HD21") (segid " " and resid "30 " and name "HG12") ASSI { 2025} (segid " " and resid "6 " and name "HA ") (segid " " and resid "6 " and name "HB1 ") 5.000 5.000 0.000 peak 2025 weight 0.10000E+01 volume -0.10060E+01 ppm1 5.196 ppm2 1.652 ASSI { 2024} (segid " " and resid "6 " and name "HA ") (segid " " and resid "6 " and name "HB2 ") 5.000 5.000 0.000 peak 2024 weight 0.10000E+01 volume -0.14390E+01 ppm1 5.196 ppm2 1.336 ASSI { 2028} (segid " " and resid "6 " and name "HA ") (segid " " and resid "6 " and name "HD2 ") 5.000 5.000 0.000 peak 2028 weight 0.10000E+01 volume -0.54500E+00 ppm1 5.196 ppm2 1.547 OR { 2028} (segid " " and resid "6 " and name "HA ") (segid " " and resid "6 " and name "HD1 ") ASSI { 4640} (segid " " and resid "6 " and name "HA ") (segid " " and resid "6 " and name "HG1 ") 5.000 5.000 0.000 peak 4640 weight 0.10000E+01 volume -0.12500E+01 ppm1 5.204 ppm2 1.375 ASSI { 2026} (segid " " and resid "6 " and name "HA ") (segid " " and resid "6 " and name "HG2 ") 5.000 5.000 0.000 peak 2026 weight 0.10000E+01 volume -0.81400E+00 ppm1 5.196 ppm2 1.204 ASSI { 2008} (segid " " and resid "6 " and name "HA ") (segid " " and resid "12 " and name "HA ") 3.300 3.300 0.000 peak 2008 weight 0.10000E+01 volume -0.24850E+01 ppm1 5.196 ppm2 5.315 ASSI { 2027} (segid " " and resid "6 " and name "HA ") (segid " " and resid "12 " and name "HG22") 5.000 5.000 0.000 peak 2027 weight 0.10000E+01 volume -0.49200E+00 ppm1 5.196 ppm2 1.046 OR { 2027} (segid " " and resid "6 " and name "HA ") (segid " " and resid "12 " and name "HG21") OR { 2027} (segid " " and resid "6 " and name "HA ") (segid " " and resid "12 " and name "HG23") ASSI { 2034} (segid " " and resid "6 " and name "HB2 ") (segid " " and resid "6 " and name "HB1 ") 3.300 3.300 0.000 peak 2034 weight 0.10000E+01 volume -0.26770E+01 ppm1 1.336 ppm2 1.652 ASSI { 2044} (segid " " and resid "6 " and name "HB2 ") (segid " " and resid "6 " and name "HD2 ") 5.000 5.000 0.000 peak 2044 weight 0.10000E+01 volume -0.62400E+00 ppm1 1.336 ppm2 1.547 OR { 2044} (segid " " and resid "6 " and name "HB2 ") (segid " " and resid "6 " and name "HD1 ") ASSI { 2038} (segid " " and resid "6 " and name "HB1 ") (segid " " and resid "6 " and name "HG2 ") 5.000 5.000 0.000 peak 2038 weight 0.10000E+01 volume -0.49200E+00 ppm1 1.665 ppm2 1.204 ASSI { 2040} (segid " " and resid "6 " and name "HB2 ") (segid " " and resid "6 " and name "HG2 ") 5.000 5.000 0.000 peak 2040 weight 0.10000E+01 volume -0.69500E+00 ppm1 1.336 ppm2 1.204 ASSI { 2046} (segid " " and resid "6 " and name "HB2 ") (segid " " and resid "12 " and name "HG22") 6.000 6.000 0.000 peak 2046 weight 0.10000E+01 volume -0.88000E-01 ppm1 1.336 ppm2 1.046 OR { 2046} (segid " " and resid "6 " and name "HB2 ") (segid " " and resid "12 " and name "HG21") OR { 2046} (segid " " and resid "6 " and name "HB2 ") (segid " " and resid "12 " and name "HG23") ASSI { 2037} (segid " " and resid "6 " and name "HB1 ") (segid " " and resid "68 " and name "HA ") 5.000 5.000 0.000 peak 2037 weight 0.10000E+01 volume -0.56500E+00 ppm1 1.652 ppm2 4.999 ASSI { 2045} (segid " " and resid "6 " and name "HB2 ") (segid " " and resid "68 " and name "HA ") 5.000 5.000 0.000 peak 2045 weight 0.10000E+01 volume -0.38200E+00 ppm1 1.336 ppm2 4.999 ASSI { 2061} (segid " " and resid "6 " and name "HD2 ") (segid " " and resid "12 " and name "HA ") 6.000 6.000 0.000 peak 2061 weight 0.10000E+01 volume -0.13700E+00 ppm1 1.547 ppm2 5.315 OR { 2061} (segid " " and resid "6 " and name "HD1 ") (segid " " and resid "12 " and name "HA ") ASSI { 2059} (segid " " and resid "6 " and name "HD1 ") (segid " " and resid "12 " and name "HG23") 6.000 6.000 0.000 peak 2059 weight 0.10000E+01 volume -0.14200E+00 ppm1 1.547 ppm2 1.046 OR { 2059} (segid " " and resid "6 " and name "HD1 ") (segid " " and resid "12 " and name "HG21") OR { 2059} (segid " " and resid "6 " and name "HD2 ") (segid " " and resid "12 " and name "HG22") OR { 2059} (segid " " and resid "6 " and name "HD2 ") (segid " " and resid "12 " and name "HG21") OR { 2059} (segid " " and resid "6 " and name "HD2 ") (segid " " and resid "12 " and name "HG23") OR { 2059} (segid " " and resid "6 " and name "HD1 ") (segid " " and resid "12 " and name "HG22") ASSI { 4660} (segid " " and resid "6 " and name "HG1 ") (segid " " and resid "12 " and name "HA ") 6.000 6.000 0.000 peak 4660 weight 0.10000E+01 volume -0.64000E-01 ppm1 1.375 ppm2 5.310 ASSI { 2173} (segid " " and resid "6 " and name "HG1 ") (segid " " and resid "68 " and name "HA ") 6.000 6.000 0.000 peak 2173 weight 0.10000E+01 volume -0.86000E-01 ppm1 1.375 ppm2 4.993 ASSI { 4688} (segid " " and resid "7 " and name "HG22") (segid " " and resid "6 " and name "HA ") 5.000 5.000 0.000 peak 4688 weight 0.10000E+01 volume -0.70100E+00 ppm1 1.165 ppm2 5.207 OR { 4688} (segid " " and resid "7 " and name "HG21") (segid " " and resid "6 " and name "HA ") OR { 4688} (segid " " and resid "7 " and name "HG23") (segid " " and resid "6 " and name "HA ") ASSI { 2072} (segid " " and resid "7 " and name "HG23") (segid " " and resid "7 " and name "HB ") 3.300 3.300 0.000 peak 2072 weight 0.10000E+01 volume -0.39090E+01 ppm1 1.165 ppm2 4.761 OR { 2072} (segid " " and resid "7 " and name "HG22") (segid " " and resid "7 " and name "HB ") OR { 2072} (segid " " and resid "7 " and name "HG21") (segid " " and resid "7 " and name "HB ") ASSI { 2081} (segid " " and resid "7 " and name "HG21") (segid " " and resid "11 " and name "HB2 ") 5.000 5.000 0.000 peak 2081 weight 0.10000E+01 volume -0.67600E+00 ppm1 1.165 ppm2 1.678 OR { 2081} (segid " " and resid "7 " and name "HG23") (segid " " and resid "11 " and name "HB2 ") OR { 2081} (segid " " and resid "7 " and name "HG22") (segid " " and resid "11 " and name "HB2 ") ASSI { 2082} (segid " " and resid "7 " and name "HG22") (segid " " and resid "34 " and name "HG1 ") 5.000 5.000 0.000 peak 2082 weight 0.10000E+01 volume -0.41300E+00 ppm1 1.165 ppm2 1.995 OR { 2082} (segid " " and resid "7 " and name "HG22") (segid " " and resid "34 " and name "HG2 ") OR { 2082} (segid " " and resid "7 " and name "HG23") (segid " " and resid "34 " and name "HG1 ") OR { 2082} (segid " " and resid "7 " and name "HG21") (segid " " and resid "34 " and name "HG1 ") OR { 2082} (segid " " and resid "7 " and name "HG23") (segid " " and resid "34 " and name "HG2 ") OR { 2082} (segid " " and resid "7 " and name "HG21") (segid " " and resid "34 " and name "HG2 ") ASSI { 2080} (segid " " and resid "7 " and name "HG23") (segid " " and resid "69 " and name "HB1 ") 5.000 5.000 0.000 peak 2080 weight 0.10000E+01 volume -0.70000E+00 ppm1 1.165 ppm2 1.810 OR { 2080} (segid " " and resid "7 " and name "HG21") (segid " " and resid "69 " and name "HB1 ") OR { 2080} (segid " " and resid "7 " and name "HG22") (segid " " and resid "69 " and name "HB1 ") ASSI { 2075} (segid " " and resid "8 " and name "HA ") (segid " " and resid "8 " and name "HB1 ") 3.300 3.300 0.000 peak 2075 weight 0.10000E+01 volume -0.28360E+01 ppm1 4.300 ppm2 1.705 ASSI { 2076} (segid " " and resid "8 " and name "HA ") (segid " " and resid "8 " and name "HB2 ") 3.300 3.300 0.000 peak 2076 weight 0.10000E+01 volume -0.22860E+01 ppm1 4.300 ppm2 1.942 ASSI { 4700} (segid " " and resid "8 " and name "HA ") (segid " " and resid "8 " and name "HD11") 5.000 5.000 0.000 peak 4700 weight 0.10000E+01 volume -0.72500E+00 ppm1 4.287 ppm2 1.019 OR { 4700} (segid " " and resid "8 " and name "HA ") (segid " " and resid "8 " and name "HD12") OR { 4700} (segid " " and resid "8 " and name "HA ") (segid " " and resid "8 " and name "HD13") ASSI { 2069} (segid " " and resid "8 " and name "HA ") (segid " " and resid "8 " and name "HD22") 3.300 3.300 0.000 peak 2069 weight 0.10000E+01 volume -0.23250E+01 ppm1 4.287 ppm2 0.967 OR { 2069} (segid " " and resid "8 " and name "HA ") (segid " " and resid "8 " and name "HD21") OR { 2069} (segid " " and resid "8 " and name "HA ") (segid " " and resid "8 " and name "HD23") ASSI { 2085} (segid " " and resid "8 " and name "HA ") (segid " " and resid "8 " and name "HG ") 5.000 5.000 0.000 peak 2085 weight 0.10000E+01 volume -0.18020E+01 ppm1 4.300 ppm2 1.836 ASSI { 2093} (segid " " and resid "8 " and name "HB1 ") (segid " " and resid "8 " and name "HB2 ") 2.700 2.700 0.000 peak 2093 weight 0.10000E+01 volume -0.41870E+01 ppm1 1.718 ppm2 1.916 ASSI { 2096} (segid " " and resid "8 " and name "HB1 ") (segid " " and resid "8 " and name "HD12") 5.000 5.000 0.000 peak 2096 weight 0.10000E+01 volume -0.80000E+00 ppm1 1.705 ppm2 1.020 OR { 2096} (segid " " and resid "8 " and name "HB1 ") (segid " " and resid "8 " and name "HD11") OR { 2096} (segid " " and resid "8 " and name "HB1 ") (segid " " and resid "8 " and name "HD13") ASSI { 2084} (segid " " and resid "8 " and name "HB2 ") (segid " " and resid "8 " and name "HD12") 5.000 5.000 0.000 peak 2084 weight 0.10000E+01 volume -0.90100E+00 ppm1 1.929 ppm2 1.020 OR { 2084} (segid " " and resid "8 " and name "HB2 ") (segid " " and resid "8 " and name "HD13") OR { 2084} (segid " " and resid "8 " and name "HB2 ") (segid " " and resid "8 " and name "HD11") ASSI { 2097} (segid " " and resid "8 " and name "HB1 ") (segid " " and resid "8 " and name "HD22") 5.000 5.000 0.000 peak 2097 weight 0.10000E+01 volume -0.79100E+00 ppm1 1.718 ppm2 0.967 OR { 2097} (segid " " and resid "8 " and name "HB1 ") (segid " " and resid "8 " and name "HD23") OR { 2097} (segid " " and resid "8 " and name "HB1 ") (segid " " and resid "8 " and name "HD21") ASSI { 4708} (segid " " and resid "8 " and name "HB2 ") (segid " " and resid "8 " and name "HD22") 5.000 5.000 0.000 peak 4708 weight 0.10000E+01 volume -0.45200E+00 ppm1 1.932 ppm2 0.963 OR { 4708} (segid " " and resid "8 " and name "HB2 ") (segid " " and resid "8 " and name "HD23") OR { 4708} (segid " " and resid "8 " and name "HB2 ") (segid " " and resid "8 " and name "HD21") ASSI { 4704} (segid " " and resid "8 " and name "HB2 ") (segid " " and resid "8 " and name "HG ") 5.000 5.000 0.000 peak 4704 weight 0.10000E+01 volume -0.15420E+01 ppm1 1.932 ppm2 1.825 ASSI { 2090} (segid " " and resid "8 " and name "HB2 ") (segid " " and resid "9 " and name "HG21") 6.000 6.000 0.000 peak 2090 weight 0.10000E+01 volume -0.12200E+00 ppm1 1.929 ppm2 1.257 OR { 2090} (segid " " and resid "8 " and name "HB2 ") (segid " " and resid "9 " and name "HG22") OR { 2090} (segid " " and resid "8 " and name "HB2 ") (segid " " and resid "9 " and name "HG23") ASSI { 2101} (segid " " and resid "8 " and name "HD11") (segid " " and resid "8 " and name "HG ") 5.000 5.000 0.000 peak 2101 weight 0.10000E+01 volume -0.17890E+01 ppm1 1.020 ppm2 1.836 OR { 2101} (segid " " and resid "8 " and name "HD13") (segid " " and resid "8 " and name "HG ") OR { 2101} (segid " " and resid "8 " and name "HD12") (segid " " and resid "8 " and name "HG ") ASSI { 2111} (segid " " and resid "8 " and name "HD12") (segid " " and resid "36 " and name "HD12") 5.000 5.000 0.000 peak 2111 weight 0.10000E+01 volume -0.46300E+00 ppm1 1.020 ppm2 0.782 OR { 2111} (segid " " and resid "8 " and name "HD13") (segid " " and resid "36 " and name "HD13") OR { 2111} (segid " " and resid "8 " and name "HD12") (segid " " and resid "36 " and name "HD11") OR { 2111} (segid " " and resid "8 " and name "HD12") (segid " " and resid "36 " and name "HD13") OR { 2111} (segid " " and resid "8 " and name "HD13") (segid " " and resid "36 " and name "HD12") OR { 2111} (segid " " and resid "8 " and name "HD13") (segid " " and resid "36 " and name "HD11") OR { 2111} (segid " " and resid "8 " and name "HD11") (segid " " and resid "36 " and name "HD11") OR { 2111} (segid " " and resid "8 " and name "HD11") (segid " " and resid "36 " and name "HD12") OR { 2111} (segid " " and resid "8 " and name "HD11") (segid " " and resid "36 " and name "HD13") ASSI { 2115} (segid " " and resid "8 " and name "HD11") (segid " " and resid "70 " and name "HA ") 6.000 6.000 0.000 peak 2115 weight 0.10000E+01 volume -0.16600E+00 ppm1 1.020 ppm2 4.392 OR { 2115} (segid " " and resid "8 " and name "HD12") (segid " " and resid "70 " and name "HA ") OR { 2115} (segid " " and resid "8 " and name "HD13") (segid " " and resid "70 " and name "HA ") ASSI { 2118} (segid " " and resid "8 " and name "HD21") (segid " " and resid "8 " and name "HG ") 5.000 5.000 0.000 peak 2118 weight 0.10000E+01 volume -0.16480E+01 ppm1 0.967 ppm2 1.836 OR { 2118} (segid " " and resid "8 " and name "HD23") (segid " " and resid "8 " and name "HG ") OR { 2118} (segid " " and resid "8 " and name "HD22") (segid " " and resid "8 " and name "HG ") ASSI { 4735} (segid " " and resid "8 " and name "HD23") (segid " " and resid "69 " and name "HB1 ") 5.000 5.000 0.000 peak 4735 weight 0.10000E+01 volume -0.18740E+01 ppm1 0.963 ppm2 1.818 OR { 4735} (segid " " and resid "8 " and name "HD22") (segid " " and resid "69 " and name "HB1 ") OR { 4735} (segid " " and resid "8 " and name "HD21") (segid " " and resid "69 " and name "HB1 ") ASSI { 2121} (segid " " and resid "8 " and name "HD23") (segid " " and resid "70 " and name "HA ") 5.000 5.000 0.000 peak 2121 weight 0.10000E+01 volume -0.64100E+00 ppm1 0.967 ppm2 4.392 OR { 2121} (segid " " and resid "8 " and name "HD22") (segid " " and resid "70 " and name "HA ") OR { 2121} (segid " " and resid "8 " and name "HD21") (segid " " and resid "70 " and name "HA ") ASSI { 2098} (segid " " and resid "8 " and name "HG ") (segid " " and resid "8 " and name "HB1 ") 3.300 3.300 0.000 peak 2098 weight 0.10000E+01 volume -0.21400E+01 ppm1 1.836 ppm2 1.705 ASSI { 2120} (segid " " and resid "9 " and name "HA ") (segid " " and resid "9 " and name "HB ") 3.300 3.300 0.000 peak 2120 weight 0.10000E+01 volume -0.35290E+01 ppm1 4.432 ppm2 4.577 ASSI { 2124} (segid " " and resid "9 " and name "HA ") (segid " " and resid "9 " and name "HG22") 3.300 3.300 0.000 peak 2124 weight 0.10000E+01 volume -0.28410E+01 ppm1 4.419 ppm2 1.257 OR { 2124} (segid " " and resid "9 " and name "HA ") (segid " " and resid "9 " and name "HG23") OR { 2124} (segid " " and resid "9 " and name "HA ") (segid " " and resid "9 " and name "HG21") ASSI { 2136} (segid " " and resid "9 " and name "HG21") (segid " " and resid "8 " and name "HB1 ") 6.000 6.000 0.000 peak 2136 weight 0.10000E+01 volume -0.28400E+00 ppm1 1.270 ppm2 1.705 OR { 2136} (segid " " and resid "9 " and name "HG22") (segid " " and resid "8 " and name "HB1 ") OR { 2136} (segid " " and resid "9 " and name "HG23") (segid " " and resid "8 " and name "HB1 ") ASSI { 2139} (segid " " and resid "9 " and name "HG23") (segid " " and resid "8 " and name "HG ") 6.000 6.000 0.000 peak 2139 weight 0.10000E+01 volume -0.16500E+00 ppm1 1.270 ppm2 1.836 OR { 2139} (segid " " and resid "9 " and name "HG22") (segid " " and resid "8 " and name "HG ") OR { 2139} (segid " " and resid "9 " and name "HG21") (segid " " and resid "8 " and name "HG ") ASSI { 2131} (segid " " and resid "9 " and name "HG21") (segid " " and resid "9 " and name "HB ") 3.300 3.300 0.000 peak 2131 weight 0.10000E+01 volume -0.31710E+01 ppm1 1.270 ppm2 4.577 OR { 2131} (segid " " and resid "9 " and name "HG23") (segid " " and resid "9 " and name "HB ") OR { 2131} (segid " " and resid "9 " and name "HG22") (segid " " and resid "9 " and name "HB ") ASSI { 4749} (segid " " and resid "10 " and name "HA2 ") (segid " " and resid "6 " and name "HD2 ") 6.000 6.000 0.000 peak 4749 weight 0.10000E+01 volume -0.11600E+00 ppm1 3.605 ppm2 1.527 OR { 4749} (segid " " and resid "10 " and name "HA2 ") (segid " " and resid "6 " and name "HD1 ") ASSI { 2178} (segid " " and resid "11 " and name "HD2 ") (segid " " and resid "11 " and name "HG2 ") 5.000 5.000 0.000 peak 2178 weight 0.10000E+01 volume -0.96500E+00 ppm1 1.652 ppm2 1.283 OR { 2178} (segid " " and resid "11 " and name "HD1 ") (segid " " and resid "11 " and name "HG2 ") ASSI { 2169} (segid " " and resid "11 " and name "HG2 ") (segid " " and resid "11 " and name "HB1 ") 5.000 5.000 0.000 peak 2169 weight 0.10000E+01 volume -0.39000E+00 ppm1 1.270 ppm2 1.810 ASSI { 2192} (segid " " and resid "12 " and name "HA ") (segid " " and resid "6 " and name "HB2 ") 6.000 6.000 0.000 peak 2192 weight 0.10000E+01 volume -0.20900E+00 ppm1 5.302 ppm2 1.309 ASSI { 2187} (segid " " and resid "12 " and name "HA ") (segid " " and resid "6 " and name "HG2 ") 5.000 5.000 0.000 peak 2187 weight 0.10000E+01 volume -0.31400E+00 ppm1 5.302 ppm2 1.178 ASSI { 2186} (segid " " and resid "12 " and name "HA ") (segid " " and resid "12 " and name "HB ") 5.000 5.000 0.000 peak 2186 weight 0.10000E+01 volume -0.88700E+00 ppm1 5.315 ppm2 3.918 ASSI { 2198} (segid " " and resid "12 " and name "HG23") (segid " " and resid "4 " and name "HD2 ") 5.000 5.000 0.000 peak 2198 weight 0.10000E+01 volume -0.65000E+00 ppm1 1.059 ppm2 7.054 OR { 2198} (segid " " and resid "12 " and name "HG22") (segid " " and resid "4 " and name "HD2 ") OR { 2198} (segid " " and resid "12 " and name "HG23") (segid " " and resid "4 " and name "HD1 ") OR { 2198} (segid " " and resid "12 " and name "HG21") (segid " " and resid "4 " and name "HD1 ") OR { 2198} (segid " " and resid "12 " and name "HG21") (segid " " and resid "4 " and name "HD2 ") OR { 2198} (segid " " and resid "12 " and name "HG22") (segid " " and resid "4 " and name "HD1 ") ASSI { 2210} (segid " " and resid "12 " and name "HG23") (segid " " and resid "4 " and name "HE2 ") 6.000 6.000 0.000 peak 2210 weight 0.10000E+01 volume -0.11300E+00 ppm1 1.046 ppm2 7.265 OR { 2210} (segid " " and resid "12 " and name "HG21") (segid " " and resid "4 " and name "HE1 ") OR { 2210} (segid " " and resid "12 " and name "HG22") (segid " " and resid "4 " and name "HE2 ") OR { 2210} (segid " " and resid "12 " and name "HG23") (segid " " and resid "4 " and name "HE1 ") OR { 2210} (segid " " and resid "12 " and name "HG21") (segid " " and resid "4 " and name "HE2 ") OR { 2210} (segid " " and resid "12 " and name "HG22") (segid " " and resid "4 " and name "HE1 ") ASSI { 2213} (segid " " and resid "13 " and name "HB ") (segid " " and resid "5 " and name "HB2 ") 5.000 5.000 0.000 peak 2213 weight 0.10000E+01 volume -0.32800E+00 ppm1 2.153 ppm2 1.125 ASSI { 2212} (segid " " and resid "13 " and name "HB ") (segid " " and resid "13 " and name "HA ") 5.000 5.000 0.000 peak 2212 weight 0.10000E+01 volume -0.99200E+00 ppm1 2.153 ppm2 4.656 ASSI { 2239} (segid " " and resid "13 " and name "HG22") (segid " " and resid "13 " and name "HA ") 5.000 5.000 0.000 peak 2239 weight 0.10000E+01 volume -0.91900E+00 ppm1 0.888 ppm2 4.656 OR { 2239} (segid " " and resid "13 " and name "HG21") (segid " " and resid "13 " and name "HA ") OR { 2239} (segid " " and resid "13 " and name "HG23") (segid " " and resid "13 " and name "HA ") ASSI { 2243} (segid " " and resid "13 " and name "HG23") (segid " " and resid "34 " and name "HG1 ") 5.000 5.000 0.000 peak 2243 weight 0.10000E+01 volume -0.50200E+00 ppm1 0.888 ppm2 1.995 OR { 2243} (segid " " and resid "13 " and name "HG23") (segid " " and resid "34 " and name "HG2 ") OR { 2243} (segid " " and resid "13 " and name "HG21") (segid " " and resid "34 " and name "HG2 ") OR { 2243} (segid " " and resid "13 " and name "HG21") (segid " " and resid "34 " and name "HG1 ") OR { 2243} (segid " " and resid "13 " and name "HG22") (segid " " and resid "34 " and name "HG1 ") OR { 2243} (segid " " and resid "13 " and name "HG22") (segid " " and resid "34 " and name "HG2 ") ASSI { 4838} (segid " " and resid "14 " and name "HA ") (segid " " and resid "3 " and name "HG23") 6.000 6.000 0.000 peak 4838 weight 0.10000E+01 volume -0.10400E+00 ppm1 5.106 ppm2 0.600 OR { 4838} (segid " " and resid "14 " and name "HA ") (segid " " and resid "3 " and name "HG21") OR { 4838} (segid " " and resid "14 " and name "HA ") (segid " " and resid "3 " and name "HG22") ASSI { 2225} (segid " " and resid "14 " and name "HA ") (segid " " and resid "4 " and name "HD1 ") 5.000 5.000 0.000 peak 2225 weight 0.10000E+01 volume -0.60900E+00 ppm1 5.117 ppm2 7.054 OR { 2225} (segid " " and resid "14 " and name "HA ") (segid " " and resid "4 " and name "HD2 ") ASSI { 2222} (segid " " and resid "14 " and name "HA ") (segid " " and resid "14 " and name "HB ") 5.000 5.000 0.000 peak 2222 weight 0.10000E+01 volume -0.14920E+01 ppm1 5.117 ppm2 4.024 ASSI { 2220} (segid " " and resid "14 " and name "HA ") (segid " " and resid "14 " and name "HG21") 3.300 3.300 0.000 peak 2220 weight 0.10000E+01 volume -0.21660E+01 ppm1 5.117 ppm2 1.099 OR { 2220} (segid " " and resid "14 " and name "HA ") (segid " " and resid "14 " and name "HG23") OR { 2220} (segid " " and resid "14 " and name "HA ") (segid " " and resid "14 " and name "HG22") ASSI { 2236} (segid " " and resid "14 " and name "HA ") (segid " " and resid "15 " and name "HA ") 6.000 6.000 0.000 peak 2236 weight 0.10000E+01 volume -0.85000E-01 ppm1 5.104 ppm2 4.419 ASSI { 2228} (segid " " and resid "14 " and name "HA ") (segid " " and resid "15 " and name "HB ") 6.000 6.000 0.000 peak 2228 weight 0.10000E+01 volume -0.15000E+00 ppm1 5.117 ppm2 1.705 ASSI { 2223} (segid " " and resid "14 " and name "HB ") (segid " " and resid "14 " and name "HG23") 3.300 3.300 0.000 peak 2223 weight 0.10000E+01 volume -0.24670E+01 ppm1 4.024 ppm2 1.099 OR { 2223} (segid " " and resid "14 " and name "HB ") (segid " " and resid "14 " and name "HG22") OR { 2223} (segid " " and resid "14 " and name "HB ") (segid " " and resid "14 " and name "HG21") ASSI { 2266} (segid " " and resid "14 " and name "HG22") (segid " " and resid "4 " and name "HD2 ") 5.000 5.000 0.000 peak 2266 weight 0.10000E+01 volume -0.45300E+00 ppm1 1.112 ppm2 7.054 OR { 2266} (segid " " and resid "14 " and name "HG21") (segid " " and resid "4 " and name "HD1 ") OR { 2266} (segid " " and resid "14 " and name "HG21") (segid " " and resid "4 " and name "HD2 ") OR { 2266} (segid " " and resid "14 " and name "HG23") (segid " " and resid "4 " and name "HD2 ") OR { 2266} (segid " " and resid "14 " and name "HG23") (segid " " and resid "4 " and name "HD1 ") OR { 2266} (segid " " and resid "14 " and name "HG22") (segid " " and resid "4 " and name "HD1 ") ASSI { 2264} (segid " " and resid "14 " and name "HG23") (segid " " and resid "4 " and name "HE1 ") 5.000 5.000 0.000 peak 2264 weight 0.10000E+01 volume -0.53300E+00 ppm1 1.112 ppm2 7.265 OR { 2264} (segid " " and resid "14 " and name "HG22") (segid " " and resid "4 " and name "HE2 ") OR { 2264} (segid " " and resid "14 " and name "HG23") (segid " " and resid "4 " and name "HE2 ") OR { 2264} (segid " " and resid "14 " and name "HG21") (segid " " and resid "4 " and name "HE1 ") OR { 2264} (segid " " and resid "14 " and name "HG22") (segid " " and resid "4 " and name "HE1 ") OR { 2264} (segid " " and resid "14 " and name "HG21") (segid " " and resid "4 " and name "HE2 ") ASSI { 2285} (segid " " and resid "15 " and name "HA ") (segid " " and resid "14 " and name "HG23") 6.000 6.000 0.000 peak 2285 weight 0.10000E+01 volume -0.19500E+00 ppm1 4.419 ppm2 1.099 OR { 2285} (segid " " and resid "15 " and name "HA ") (segid " " and resid "14 " and name "HG22") OR { 2285} (segid " " and resid "15 " and name "HA ") (segid " " and resid "14 " and name "HG21") ASSI { 2271} (segid " " and resid "15 " and name "HA ") (segid " " and resid "15 " and name "HB ") 5.000 5.000 0.000 peak 2271 weight 0.10000E+01 volume -0.11660E+01 ppm1 4.419 ppm2 1.705 ASSI { 2260} (segid " " and resid "15 " and name "HA ") (segid " " and resid "15 " and name "HG23") 3.300 3.300 0.000 peak 2260 weight 0.10000E+01 volume -0.21730E+01 ppm1 4.419 ppm2 0.941 OR { 2260} (segid " " and resid "15 " and name "HA ") (segid " " and resid "15 " and name "HG22") OR { 2260} (segid " " and resid "15 " and name "HA ") (segid " " and resid "15 " and name "HG21") ASSI { 2292} (segid " " and resid "15 " and name "HB ") (segid " " and resid "17 " and name "HG13") 5.000 5.000 0.000 peak 2292 weight 0.10000E+01 volume -0.87200E+00 ppm1 1.705 ppm2 0.651 OR { 2292} (segid " " and resid "15 " and name "HB ") (segid " " and resid "17 " and name "HG11") OR { 2292} (segid " " and resid "15 " and name "HB ") (segid " " and resid "17 " and name "HG12") ASSI { 2296} (segid " " and resid "15 " and name "HB ") (segid " " and resid "26 " and name "HE1 ") 5.000 5.000 0.000 peak 2296 weight 0.10000E+01 volume -0.39700E+00 ppm1 1.705 ppm2 6.896 OR { 2296} (segid " " and resid "15 " and name "HB ") (segid " " and resid "26 " and name "HE2 ") ASSI { 2340} (segid " " and resid "15 " and name "HD13") (segid " " and resid "5 " and name "HB1 ") 5.000 5.000 0.000 peak 2340 weight 0.10000E+01 volume -0.12010E+01 ppm1 0.664 ppm2 1.889 OR { 2340} (segid " " and resid "15 " and name "HD12") (segid " " and resid "5 " and name "HB1 ") OR { 2340} (segid " " and resid "15 " and name "HD11") (segid " " and resid "5 " and name "HB1 ") ASSI { 2336} (segid " " and resid "15 " and name "HD12") (segid " " and resid "15 " and name "HA ") 5.000 5.000 0.000 peak 2336 weight 0.10000E+01 volume -0.11870E+01 ppm1 0.664 ppm2 4.419 OR { 2336} (segid " " and resid "15 " and name "HD11") (segid " " and resid "15 " and name "HA ") OR { 2336} (segid " " and resid "15 " and name "HD13") (segid " " and resid "15 " and name "HA ") ASSI { 2326} (segid " " and resid "15 " and name "HD12") (segid " " and resid "15 " and name "HG22") 3.300 3.300 0.000 peak 2326 weight 0.10000E+01 volume -0.32640E+01 ppm1 0.664 ppm2 0.941 OR { 2326} (segid " " and resid "15 " and name "HD11") (segid " " and resid "15 " and name "HG22") OR { 2326} (segid " " and resid "15 " and name "HD11") (segid " " and resid "15 " and name "HG21") OR { 2326} (segid " " and resid "15 " and name "HD13") (segid " " and resid "15 " and name "HG23") OR { 2326} (segid " " and resid "15 " and name "HD12") (segid " " and resid "15 " and name "HG23") OR { 2326} (segid " " and resid "15 " and name "HD13") (segid " " and resid "15 " and name "HG22") OR { 2326} (segid " " and resid "15 " and name "HD13") (segid " " and resid "15 " and name "HG21") OR { 2326} (segid " " and resid "15 " and name "HD12") (segid " " and resid "15 " and name "HG21") OR { 2326} (segid " " and resid "15 " and name "HD11") (segid " " and resid "15 " and name "HG23") ASSI { 2349} (segid " " and resid "15 " and name "HD11") (segid " " and resid "26 " and name "HD1 ") 6.000 6.000 0.000 peak 2349 weight 0.10000E+01 volume -0.79000E-01 ppm1 0.664 ppm2 7.080 OR { 2349} (segid " " and resid "15 " and name "HD13") (segid " " and resid "26 " and name "HD1 ") OR { 2349} (segid " " and resid "15 " and name "HD12") (segid " " and resid "26 " and name "HD1 ") OR { 2349} (segid " " and resid "15 " and name "HD11") (segid " " and resid "26 " and name "HD2 ") OR { 2349} (segid " " and resid "15 " and name "HD13") (segid " " and resid "26 " and name "HD2 ") OR { 2349} (segid " " and resid "15 " and name "HD12") (segid " " and resid "26 " and name "HD2 ") ASSI { 2344} (segid " " and resid "15 " and name "HD12") (segid " " and resid "26 " and name "HE1 ") 5.000 5.000 0.000 peak 2344 weight 0.10000E+01 volume -0.30900E+00 ppm1 0.664 ppm2 6.896 OR { 2344} (segid " " and resid "15 " and name "HD13") (segid " " and resid "26 " and name "HE1 ") OR { 2344} (segid " " and resid "15 " and name "HD11") (segid " " and resid "26 " and name "HE1 ") OR { 2344} (segid " " and resid "15 " and name "HD13") (segid " " and resid "26 " and name "HE2 ") OR { 2344} (segid " " and resid "15 " and name "HD11") (segid " " and resid "26 " and name "HE2 ") OR { 2344} (segid " " and resid "15 " and name "HD12") (segid " " and resid "26 " and name "HE2 ") ASSI { 2339} (segid " " and resid "15 " and name "HD11") (segid " " and resid "30 " and name "HA ") 5.000 5.000 0.000 peak 2339 weight 0.10000E+01 volume -0.90000E+00 ppm1 0.664 ppm2 3.312 OR { 2339} (segid " " and resid "15 " and name "HD13") (segid " " and resid "30 " and name "HA ") OR { 2339} (segid " " and resid "15 " and name "HD12") (segid " " and resid "30 " and name "HA ") ASSI { 2341} (segid " " and resid "15 " and name "HD11") (segid " " and resid "30 " and name "HD13") 5.000 5.000 0.000 peak 2341 weight 0.10000E+01 volume -0.36900E+00 ppm1 0.664 ppm2 0.045 OR { 2341} (segid " " and resid "15 " and name "HD12") (segid " " and resid "30 " and name "HD12") OR { 2341} (segid " " and resid "15 " and name "HD12") (segid " " and resid "30 " and name "HD11") OR { 2341} (segid " " and resid "15 " and name "HD11") (segid " " and resid "30 " and name "HD11") OR { 2341} (segid " " and resid "15 " and name "HD13") (segid " " and resid "30 " and name "HD12") OR { 2341} (segid " " and resid "15 " and name "HD11") (segid " " and resid "30 " and name "HD12") OR { 2341} (segid " " and resid "15 " and name "HD13") (segid " " and resid "30 " and name "HD13") OR { 2341} (segid " " and resid "15 " and name "HD12") (segid " " and resid "30 " and name "HD13") OR { 2341} (segid " " and resid "15 " and name "HD13") (segid " " and resid "30 " and name "HD11") ASSI { 2343} (segid " " and resid "15 " and name "HD12") (segid " " and resid "30 " and name "HG12") 5.000 5.000 0.000 peak 2343 weight 0.10000E+01 volume -0.57100E+00 ppm1 0.664 ppm2 0.334 OR { 2343} (segid " " and resid "15 " and name "HD11") (segid " " and resid "30 " and name "HG12") OR { 2343} (segid " " and resid "15 " and name "HD13") (segid " " and resid "30 " and name "HG12") ASSI { 2335} (segid " " and resid "15 " and name "HD11") (segid " " and resid "33 " and name "HD1 ") 5.000 5.000 0.000 peak 2335 weight 0.10000E+01 volume -0.14820E+01 ppm1 0.664 ppm2 1.705 OR { 2335} (segid " " and resid "15 " and name "HD13") (segid " " and resid "33 " and name "HD1 ") OR { 2335} (segid " " and resid "15 " and name "HD11") (segid " " and resid "33 " and name "HD2 ") OR { 2335} (segid " " and resid "15 " and name "HD12") (segid " " and resid "33 " and name "HD1 ") OR { 2335} (segid " " and resid "15 " and name "HD13") (segid " " and resid "33 " and name "HD2 ") OR { 2335} (segid " " and resid "15 " and name "HD12") (segid " " and resid "33 " and name "HD2 ") ASSI { 2314} (segid " " and resid "15 " and name "HG21") (segid " " and resid "15 " and name "HB ") 3.300 3.300 0.000 peak 2314 weight 0.10000E+01 volume -0.27390E+01 ppm1 0.941 ppm2 1.705 OR { 2314} (segid " " and resid "15 " and name "HG22") (segid " " and resid "15 " and name "HB ") OR { 2314} (segid " " and resid "15 " and name "HG23") (segid " " and resid "15 " and name "HB ") ASSI { 2325} (segid " " and resid "15 " and name "HG23") (segid " " and resid "17 " and name "HB ") 6.000 6.000 0.000 peak 2325 weight 0.10000E+01 volume -0.26800E+00 ppm1 0.941 ppm2 2.100 OR { 2325} (segid " " and resid "15 " and name "HG22") (segid " " and resid "17 " and name "HB ") OR { 2325} (segid " " and resid "15 " and name "HG21") (segid " " and resid "17 " and name "HB ") ASSI { 2319} (segid " " and resid "15 " and name "HG23") (segid " " and resid "26 " and name "HE1 ") 5.000 5.000 0.000 peak 2319 weight 0.10000E+01 volume -0.69500E+00 ppm1 0.941 ppm2 6.896 OR { 2319} (segid " " and resid "15 " and name "HG21") (segid " " and resid "26 " and name "HE1 ") OR { 2319} (segid " " and resid "15 " and name "HG22") (segid " " and resid "26 " and name "HE1 ") OR { 2319} (segid " " and resid "15 " and name "HG21") (segid " " and resid "26 " and name "HE2 ") OR { 2319} (segid " " and resid "15 " and name "HG22") (segid " " and resid "26 " and name "HE2 ") OR { 2319} (segid " " and resid "15 " and name "HG23") (segid " " and resid "26 " and name "HE2 ") ASSI { 2329} (segid " " and resid "15 " and name "HG22") (segid " " and resid "29 " and name "HA ") 6.000 6.000 0.000 peak 2329 weight 0.10000E+01 volume -0.11700E+00 ppm1 0.941 ppm2 4.182 OR { 2329} (segid " " and resid "15 " and name "HG21") (segid " " and resid "29 " and name "HA ") OR { 2329} (segid " " and resid "15 " and name "HG23") (segid " " and resid "29 " and name "HA ") ASSI { 2316} (segid " " and resid "15 " and name "HG22") (segid " " and resid "29 " and name "HB1 ") 5.000 5.000 0.000 peak 2316 weight 0.10000E+01 volume -0.16300E+01 ppm1 0.941 ppm2 1.863 OR { 2316} (segid " " and resid "15 " and name "HG21") (segid " " and resid "29 " and name "HB1 ") OR { 2316} (segid " " and resid "15 " and name "HG23") (segid " " and resid "29 " and name "HB1 ") ASSI { 2320} (segid " " and resid "15 " and name "HG21") (segid " " and resid "29 " and name "HB2 ") 5.000 5.000 0.000 peak 2320 weight 0.10000E+01 volume -0.63800E+00 ppm1 0.941 ppm2 2.205 OR { 2320} (segid " " and resid "15 " and name "HG22") (segid " " and resid "29 " and name "HB2 ") OR { 2320} (segid " " and resid "15 " and name "HG23") (segid " " and resid "29 " and name "HB2 ") ASSI { 2330} (segid " " and resid "15 " and name "HG21") (segid " " and resid "30 " and name "HD13") 6.000 6.000 0.000 peak 2330 weight 0.10000E+01 volume -0.56000E-01 ppm1 0.941 ppm2 0.045 OR { 2330} (segid " " and resid "15 " and name "HG23") (segid " " and resid "30 " and name "HD11") OR { 2330} (segid " " and resid "15 " and name "HG21") (segid " " and resid "30 " and name "HD12") OR { 2330} (segid " " and resid "15 " and name "HG22") (segid " " and resid "30 " and name "HD12") OR { 2330} (segid " " and resid "15 " and name "HG23") (segid " " and resid "30 " and name "HD12") OR { 2330} (segid " " and resid "15 " and name "HG21") (segid " " and resid "30 " and name "HD11") OR { 2330} (segid " " and resid "15 " and name "HG23") (segid " " and resid "30 " and name "HD13") OR { 2330} (segid " " and resid "15 " and name "HG22") (segid " " and resid "30 " and name "HD13") OR { 2330} (segid " " and resid "15 " and name "HG22") (segid " " and resid "30 " and name "HD11") ASSI { 3377} (segid " " and resid "16 " and name "HA ") (segid " " and resid "15 " and name "HG23") 6.000 6.000 0.000 peak 3377 weight 0.10000E+01 volume -0.80000E-01 ppm1 4.919 ppm2 0.941 OR { 3377} (segid " " and resid "16 " and name "HA ") (segid " " and resid "15 " and name "HG22") OR { 3377} (segid " " and resid "16 " and name "HA ") (segid " " and resid "15 " and name "HG21") ASSI { 2360} (segid " " and resid "17 " and name "HA ") (segid " " and resid "17 " and name "HB ") 5.000 5.000 0.000 peak 2360 weight 0.10000E+01 volume -0.11750E+01 ppm1 4.603 ppm2 2.100 ASSI { 2374} (segid " " and resid "17 " and name "HA ") (segid " " and resid "17 " and name "HG13") 5.000 5.000 0.000 peak 2374 weight 0.10000E+01 volume -0.92700E+00 ppm1 4.603 ppm2 0.651 OR { 2374} (segid " " and resid "17 " and name "HA ") (segid " " and resid "17 " and name "HG11") OR { 2374} (segid " " and resid "17 " and name "HA ") (segid " " and resid "17 " and name "HG12") ASSI { 2375} (segid " " and resid "17 " and name "HA ") (segid " " and resid "17 " and name "HG22") 5.000 5.000 0.000 peak 2375 weight 0.10000E+01 volume -0.44200E+00 ppm1 4.603 ppm2 0.387 OR { 2375} (segid " " and resid "17 " and name "HA ") (segid " " and resid "17 " and name "HG21") OR { 2375} (segid " " and resid "17 " and name "HA ") (segid " " and resid "17 " and name "HG23") ASSI { 4920} (segid " " and resid "17 " and name "HA ") (segid " " and resid "56 " and name "HD12") 5.000 5.000 0.000 peak 4920 weight 0.10000E+01 volume -0.53600E+00 ppm1 4.606 ppm2 0.404 OR { 4920} (segid " " and resid "17 " and name "HA ") (segid " " and resid "56 " and name "HD13") OR { 4920} (segid " " and resid "17 " and name "HA ") (segid " " and resid "56 " and name "HD11") ASSI { 2376} (segid " " and resid "17 " and name "HB ") (segid " " and resid "17 " and name "HG21") 3.300 3.300 0.000 peak 2376 weight 0.10000E+01 volume -0.23370E+01 ppm1 2.113 ppm2 0.387 OR { 2376} (segid " " and resid "17 " and name "HB ") (segid " " and resid "17 " and name "HG22") OR { 2376} (segid " " and resid "17 " and name "HB ") (segid " " and resid "17 " and name "HG23") ASSI { 2379} (segid " " and resid "17 " and name "HB ") (segid " " and resid "21 " and name "HB2 ") 6.000 6.000 0.000 peak 2379 weight 0.10000E+01 volume -0.18600E+00 ppm1 2.113 ppm2 2.917 ASSI { 2390} (segid " " and resid "17 " and name "HG12") (segid " " and resid "1 " and name "HE1 ") 6.000 6.000 0.000 peak 2390 weight 0.10000E+01 volume -0.24700E+00 ppm1 0.651 ppm2 1.520 OR { 2390} (segid " " and resid "17 " and name "HG11") (segid " " and resid "1 " and name "HE3 ") OR { 2390} (segid " " and resid "17 " and name "HG13") (segid " " and resid "1 " and name "HE3 ") OR { 2390} (segid " " and resid "17 " and name "HG12") (segid " " and resid "1 " and name "HE3 ") OR { 2390} (segid " " and resid "17 " and name "HG13") (segid " " and resid "1 " and name "HE1 ") OR { 2390} (segid " " and resid "17 " and name "HG13") (segid " " and resid "1 " and name "HE2 ") OR { 2390} (segid " " and resid "17 " and name "HG11") (segid " " and resid "1 " and name "HE1 ") OR { 2390} (segid " " and resid "17 " and name "HG11") (segid " " and resid "1 " and name "HE2 ") OR { 2390} (segid " " and resid "17 " and name "HG12") (segid " " and resid "1 " and name "HE2 ") ASSI { 2392} (segid " " and resid "17 " and name "HG13") (segid " " and resid "21 " and name "HB2 ") 6.000 6.000 0.000 peak 2392 weight 0.10000E+01 volume -0.90000E-01 ppm1 0.638 ppm2 2.917 OR { 2392} (segid " " and resid "17 " and name "HG11") (segid " " and resid "21 " and name "HB2 ") OR { 2392} (segid " " and resid "17 " and name "HG12") (segid " " and resid "21 " and name "HB2 ") ASSI { 4935} (segid " " and resid "17 " and name "HG12") (segid " " and resid "26 " and name "HB2 ") 6.000 6.000 0.000 peak 4935 weight 0.10000E+01 volume -0.27100E+00 ppm1 0.641 ppm2 3.192 OR { 4935} (segid " " and resid "17 " and name "HG11") (segid " " and resid "26 " and name "HB2 ") OR { 4935} (segid " " and resid "17 " and name "HG13") (segid " " and resid "26 " and name "HB2 ") ASSI { 2387} (segid " " and resid "17 " and name "HG11") (segid " " and resid "26 " and name "HE1 ") 5.000 5.000 0.000 peak 2387 weight 0.10000E+01 volume -0.55200E+00 ppm1 0.651 ppm2 6.896 OR { 2387} (segid " " and resid "17 " and name "HG12") (segid " " and resid "26 " and name "HE1 ") OR { 2387} (segid " " and resid "17 " and name "HG13") (segid " " and resid "26 " and name "HE1 ") OR { 2387} (segid " " and resid "17 " and name "HG13") (segid " " and resid "26 " and name "HE2 ") OR { 2387} (segid " " and resid "17 " and name "HG11") (segid " " and resid "26 " and name "HE2 ") OR { 2387} (segid " " and resid "17 " and name "HG12") (segid " " and resid "26 " and name "HE2 ") ASSI { 2398} (segid " " and resid "17 " and name "HG22") (segid " " and resid "1 " and name "HE1 ") 5.000 5.000 0.000 peak 2398 weight 0.10000E+01 volume -0.13740E+01 ppm1 0.387 ppm2 1.520 OR { 2398} (segid " " and resid "17 " and name "HG23") (segid " " and resid "1 " and name "HE1 ") OR { 2398} (segid " " and resid "17 " and name "HG22") (segid " " and resid "1 " and name "HE3 ") OR { 2398} (segid " " and resid "17 " and name "HG22") (segid " " and resid "1 " and name "HE2 ") OR { 2398} (segid " " and resid "17 " and name "HG21") (segid " " and resid "1 " and name "HE1 ") OR { 2398} (segid " " and resid "17 " and name "HG23") (segid " " and resid "1 " and name "HE3 ") OR { 2398} (segid " " and resid "17 " and name "HG21") (segid " " and resid "1 " and name "HE3 ") OR { 2398} (segid " " and resid "17 " and name "HG23") (segid " " and resid "1 " and name "HE2 ") OR { 2398} (segid " " and resid "17 " and name "HG21") (segid " " and resid "1 " and name "HE2 ") ASSI { 2396} (segid " " and resid "17 " and name "HG22") (segid " " and resid "17 " and name "HG13") 3.300 3.300 0.000 peak 2396 weight 0.10000E+01 volume -0.31670E+01 ppm1 0.387 ppm2 0.651 OR { 2396} (segid " " and resid "17 " and name "HG22") (segid " " and resid "17 " and name "HG11") OR { 2396} (segid " " and resid "17 " and name "HG22") (segid " " and resid "17 " and name "HG12") OR { 2396} (segid " " and resid "17 " and name "HG23") (segid " " and resid "17 " and name "HG12") OR { 2396} (segid " " and resid "17 " and name "HG21") (segid " " and resid "17 " and name "HG12") OR { 2396} (segid " " and resid "17 " and name "HG23") (segid " " and resid "17 " and name "HG11") OR { 2396} (segid " " and resid "17 " and name "HG21") (segid " " and resid "17 " and name "HG11") OR { 2396} (segid " " and resid "17 " and name "HG23") (segid " " and resid "17 " and name "HG13") OR { 2396} (segid " " and resid "17 " and name "HG21") (segid " " and resid "17 " and name "HG13") ASSI { 2409} (segid " " and resid "17 " and name "HG21") (segid " " and resid "18 " and name "HA ") 6.000 6.000 0.000 peak 2409 weight 0.10000E+01 volume -0.10800E+00 ppm1 0.387 ppm2 5.025 OR { 2409} (segid " " and resid "17 " and name "HG23") (segid " " and resid "18 " and name "HA ") OR { 2409} (segid " " and resid "17 " and name "HG22") (segid " " and resid "18 " and name "HA ") ASSI { 2414} (segid " " and resid "17 " and name "HG23") (segid " " and resid "19 " and name "HA ") 6.000 6.000 0.000 peak 2414 weight 0.10000E+01 volume -0.83000E-01 ppm1 0.387 ppm2 3.997 OR { 2414} (segid " " and resid "17 " and name "HG21") (segid " " and resid "19 " and name "HA ") OR { 2414} (segid " " and resid "17 " and name "HG22") (segid " " and resid "19 " and name "HA ") ASSI { 2405} (segid " " and resid "17 " and name "HG22") (segid " " and resid "26 " and name "HB2 ") 6.000 6.000 0.000 peak 2405 weight 0.10000E+01 volume -0.11700E+00 ppm1 0.374 ppm2 3.180 OR { 2405} (segid " " and resid "17 " and name "HG21") (segid " " and resid "26 " and name "HB2 ") OR { 2405} (segid " " and resid "17 " and name "HG23") (segid " " and resid "26 " and name "HB2 ") ASSI { 2408} (segid " " and resid "17 " and name "HG22") (segid " " and resid "26 " and name "HD1 ") 6.000 6.000 0.000 peak 2408 weight 0.10000E+01 volume -0.13600E+00 ppm1 0.387 ppm2 7.080 OR { 2408} (segid " " and resid "17 " and name "HG23") (segid " " and resid "26 " and name "HD1 ") OR { 2408} (segid " " and resid "17 " and name "HG21") (segid " " and resid "26 " and name "HD1 ") OR { 2408} (segid " " and resid "17 " and name "HG21") (segid " " and resid "26 " and name "HD2 ") OR { 2408} (segid " " and resid "17 " and name "HG22") (segid " " and resid "26 " and name "HD2 ") OR { 2408} (segid " " and resid "17 " and name "HG23") (segid " " and resid "26 " and name "HD2 ") ASSI { 4948} (segid " " and resid "17 " and name "HG22") (segid " " and resid "26 " and name "HE1 ") 6.000 6.000 0.000 peak 4948 weight 0.10000E+01 volume -0.65000E-01 ppm1 0.383 ppm2 6.890 OR { 4948} (segid " " and resid "17 " and name "HG23") (segid " " and resid "26 " and name "HE1 ") OR { 4948} (segid " " and resid "17 " and name "HG21") (segid " " and resid "26 " and name "HE1 ") OR { 4948} (segid " " and resid "17 " and name "HG21") (segid " " and resid "26 " and name "HE2 ") OR { 4948} (segid " " and resid "17 " and name "HG22") (segid " " and resid "26 " and name "HE2 ") OR { 4948} (segid " " and resid "17 " and name "HG23") (segid " " and resid "26 " and name "HE2 ") ASSI { 2417} (segid " " and resid "18 " and name "HA ") (segid " " and resid "18 " and name "HB1 ") 5.000 5.000 0.000 peak 2417 weight 0.10000E+01 volume -0.13140E+01 ppm1 5.012 ppm2 2.100 ASSI { 2418} (segid " " and resid "18 " and name "HA ") (segid " " and resid "18 " and name "HB2 ") 5.000 5.000 0.000 peak 2418 weight 0.10000E+01 volume -0.82700E+00 ppm1 5.012 ppm2 1.652 ASSI { 2420} (segid " " and resid "18 " and name "HA ") (segid " " and resid "18 " and name "HG1 ") 5.000 5.000 0.000 peak 2420 weight 0.10000E+01 volume -0.49700E+00 ppm1 5.012 ppm2 2.337 ASSI { 2416} (segid " " and resid "18 " and name "HA ") (segid " " and resid "19 " and name "HD1 ") 5.000 5.000 0.000 peak 2416 weight 0.10000E+01 volume -0.19560E+01 ppm1 5.012 ppm2 4.024 ASSI { 2415} (segid " " and resid "18 " and name "HA ") (segid " " and resid "19 " and name "HD2 ") 3.300 3.300 0.000 peak 2415 weight 0.10000E+01 volume -0.26890E+01 ppm1 5.012 ppm2 3.734 ASSI { 4974} (segid " " and resid "18 " and name "HA ") (segid " " and resid "19 " and name "HG2 ") 5.000 5.000 0.000 peak 4974 weight 0.10000E+01 volume -0.58700E+00 ppm1 5.017 ppm2 2.016 ASSI { 2425} (segid " " and resid "18 " and name "HB1 ") (segid " " and resid "18 " and name "HG1 ") 5.000 5.000 0.000 peak 2425 weight 0.10000E+01 volume -0.13710E+01 ppm1 2.100 ppm2 2.337 ASSI { 2428} (segid " " and resid "18 " and name "HB1 ") (segid " " and resid "19 " and name "HD1 ") 5.000 5.000 0.000 peak 2428 weight 0.10000E+01 volume -0.55000E+00 ppm1 2.100 ppm2 4.024 ASSI { 2434} (segid " " and resid "18 " and name "HB2 ") (segid " " and resid "19 " and name "HD1 ") 5.000 5.000 0.000 peak 2434 weight 0.10000E+01 volume -0.45000E+00 ppm1 1.652 ppm2 4.024 ASSI { 2438} (segid " " and resid "18 " and name "HB2 ") (segid " " and resid "19 " and name "HD2 ") 6.000 6.000 0.000 peak 2438 weight 0.10000E+01 volume -0.16200E+00 ppm1 1.665 ppm2 3.734 ASSI { 2445} (segid " " and resid "19 " and name "HA ") (segid " " and resid "19 " and name "HB1 ") 3.300 3.300 0.000 peak 2445 weight 0.10000E+01 volume -0.21540E+01 ppm1 3.997 ppm2 2.337 ASSI { 2446} (segid " " and resid "19 " and name "HA ") (segid " " and resid "19 " and name "HB2 ") 5.000 5.000 0.000 peak 2446 weight 0.10000E+01 volume -0.18260E+01 ppm1 3.997 ppm2 2.021 ASSI { 4998} (segid " " and resid "19 " and name "HA ") (segid " " and resid "19 " and name "HG2 ") 5.000 5.000 0.000 peak 4998 weight 0.10000E+01 volume -0.19820E+01 ppm1 3.994 ppm2 2.012 ASSI { 2449} (segid " " and resid "19 " and name "HA ") (segid " " and resid "56 " and name "HB1 ") 5.000 5.000 0.000 peak 2449 weight 0.10000E+01 volume -0.64900E+00 ppm1 3.997 ppm2 1.046 ASSI { 2447} (segid " " and resid "19 " and name "HA ") (segid " " and resid "56 " and name "HB2 ") 5.000 5.000 0.000 peak 2447 weight 0.10000E+01 volume -0.12870E+01 ppm1 3.997 ppm2 1.863 ASSI { 2454} (segid " " and resid "19 " and name "HA ") (segid " " and resid "57 " and name "HA ") 6.000 6.000 0.000 peak 2454 weight 0.10000E+01 volume -0.10600E+00 ppm1 3.984 ppm2 4.287 ASSI { 5006} (segid " " and resid "19 " and name "HB1 ") (segid " " and resid "19 " and name "HD1 ") 5.000 5.000 0.000 peak 5006 weight 0.10000E+01 volume -0.18500E+01 ppm1 2.335 ppm2 4.015 ASSI { 2462} (segid " " and resid "19 " and name "HB1 ") (segid " " and resid "57 " and name "HA ") 6.000 6.000 0.000 peak 2462 weight 0.10000E+01 volume -0.15800E+00 ppm1 2.337 ppm2 4.287 ASSI { 2492} (segid " " and resid "19 " and name "HD2 ") (segid " " and resid "17 " and name "HG21") 6.000 6.000 0.000 peak 2492 weight 0.10000E+01 volume -0.83000E-01 ppm1 3.734 ppm2 0.387 OR { 2492} (segid " " and resid "19 " and name "HD2 ") (segid " " and resid "17 " and name "HG23") OR { 2492} (segid " " and resid "19 " and name "HD2 ") (segid " " and resid "17 " and name "HG22") ASSI { 2485} (segid " " and resid "19 " and name "HD1 ") (segid " " and resid "18 " and name "HG1 ") 5.000 5.000 0.000 peak 2485 weight 0.10000E+01 volume -0.38700E+00 ppm1 4.024 ppm2 2.337 ASSI { 2444} (segid " " and resid "19 " and name "HD2 ") (segid " " and resid "19 " and name "HD1 ") 2.700 2.700 0.000 peak 2444 weight 0.10000E+01 volume -0.40400E+01 ppm1 3.734 ppm2 4.024 ASSI { 2483} (segid " " and resid "19 " and name "HD1 ") (segid " " and resid "19 " and name "HG2 ") 5.000 5.000 0.000 peak 2483 weight 0.10000E+01 volume -0.12150E+01 ppm1 4.024 ppm2 2.021 ASSI { 2478} (segid " " and resid "19 " and name "HG2 ") (segid " " and resid "1 " and name "HE2 ") 5.000 5.000 0.000 peak 2478 weight 0.10000E+01 volume -0.32300E+00 ppm1 2.008 ppm2 1.520 OR { 2478} (segid " " and resid "19 " and name "HG2 ") (segid " " and resid "1 " and name "HE3 ") OR { 2478} (segid " " and resid "19 " and name "HG2 ") (segid " " and resid "1 " and name "HE1 ") ASSI { 2494} (segid " " and resid "20 " and name "HB2 ") (segid " " and resid "20 " and name "HB1 ") 2.700 2.700 0.000 peak 2494 weight 0.10000E+01 volume -0.68520E+01 ppm1 4.142 ppm2 3.786 ASSI { 5079} (segid " " and resid "21 " and name "HB1 ") (segid " " and resid "17 " and name "HG22") 5.000 5.000 0.000 peak 5079 weight 0.10000E+01 volume -0.35300E+00 ppm1 2.588 ppm2 0.377 OR { 5079} (segid " " and resid "21 " and name "HB1 ") (segid " " and resid "17 " and name "HG23") OR { 5079} (segid " " and resid "21 " and name "HB1 ") (segid " " and resid "17 " and name "HG21") ASSI { 5074} (segid " " and resid "21 " and name "HB2 ") (segid " " and resid "17 " and name "HG23") 5.000 5.000 0.000 peak 5074 weight 0.10000E+01 volume -0.57400E+00 ppm1 2.914 ppm2 0.375 OR { 5074} (segid " " and resid "21 " and name "HB2 ") (segid " " and resid "17 " and name "HG21") OR { 5074} (segid " " and resid "21 " and name "HB2 ") (segid " " and resid "17 " and name "HG22") ASSI { 2518} (segid " " and resid "21 " and name "HB1 ") (segid " " and resid "21 " and name "HA ") 5.000 5.000 0.000 peak 2518 weight 0.10000E+01 volume -0.85400E+00 ppm1 2.601 ppm2 4.682 ASSI { 2511} (segid " " and resid "21 " and name "HB2 ") (segid " " and resid "21 " and name "HA ") 5.000 5.000 0.000 peak 2511 weight 0.10000E+01 volume -0.52300E+00 ppm1 2.917 ppm2 4.682 ASSI { 2512} (segid " " and resid "21 " and name "HB2 ") (segid " " and resid "56 " and name "HD12") 5.000 5.000 0.000 peak 2512 weight 0.10000E+01 volume -0.57200E+00 ppm1 2.917 ppm2 0.414 OR { 2512} (segid " " and resid "21 " and name "HB2 ") (segid " " and resid "56 " and name "HD11") OR { 2512} (segid " " and resid "21 " and name "HB2 ") (segid " " and resid "56 " and name "HD13") ASSI { 2521} (segid " " and resid "22 " and name "HG23") (segid " " and resid "22 " and name "HB ") 2.700 2.700 0.000 peak 2521 weight 0.10000E+01 volume -0.41710E+01 ppm1 1.336 ppm2 4.814 OR { 2521} (segid " " and resid "22 " and name "HG22") (segid " " and resid "22 " and name "HB ") OR { 2521} (segid " " and resid "22 " and name "HG21") (segid " " and resid "22 " and name "HB ") ASSI { 2528} (segid " " and resid "22 " and name "HG23") (segid " " and resid "25 " and name "HB1 ") 6.000 6.000 0.000 peak 2528 weight 0.10000E+01 volume -0.90000E-01 ppm1 1.336 ppm2 3.075 OR { 2528} (segid " " and resid "22 " and name "HG22") (segid " " and resid "25 " and name "HB1 ") OR { 2528} (segid " " and resid "22 " and name "HG21") (segid " " and resid "25 " and name "HB1 ") ASSI { 2526} (segid " " and resid "22 " and name "HG21") (segid " " and resid "25 " and name "HB2 ") 6.000 6.000 0.000 peak 2526 weight 0.10000E+01 volume -0.81000E-01 ppm1 1.336 ppm2 2.943 OR { 2526} (segid " " and resid "22 " and name "HG23") (segid " " and resid "25 " and name "HB2 ") OR { 2526} (segid " " and resid "22 " and name "HG22") (segid " " and resid "25 " and name "HB2 ") ASSI { 2524} (segid " " and resid "22 " and name "HG21") (segid " " and resid "55 " and name "HA ") 5.000 5.000 0.000 peak 2524 weight 0.10000E+01 volume -0.60200E+00 ppm1 1.336 ppm2 5.236 OR { 2524} (segid " " and resid "22 " and name "HG22") (segid " " and resid "55 " and name "HA ") OR { 2524} (segid " " and resid "22 " and name "HG23") (segid " " and resid "55 " and name "HA ") ASSI { 2531} (segid " " and resid "23 " and name "HA ") (segid " " and resid "23 " and name "HG13") 5.000 5.000 0.000 peak 2531 weight 0.10000E+01 volume -0.16390E+01 ppm1 3.576 ppm2 0.835 OR { 2531} (segid " " and resid "23 " and name "HA ") (segid " " and resid "23 " and name "HG11") OR { 2531} (segid " " and resid "23 " and name "HA ") (segid " " and resid "23 " and name "HG12") ASSI { 2525} (segid " " and resid "23 " and name "HA ") (segid " " and resid "23 " and name "HG23") 3.300 3.300 0.000 peak 2525 weight 0.10000E+01 volume -0.21160E+01 ppm1 3.576 ppm2 1.046 OR { 2525} (segid " " and resid "23 " and name "HA ") (segid " " and resid "23 " and name "HG22") OR { 2525} (segid " " and resid "23 " and name "HA ") (segid " " and resid "23 " and name "HG21") ASSI { 2539} (segid " " and resid "23 " and name "HA ") (segid " " and resid "26 " and name "HA ") 6.000 6.000 0.000 peak 2539 weight 0.10000E+01 volume -0.92000E-01 ppm1 3.562 ppm2 4.551 ASSI { 5096} (segid " " and resid "23 " and name "HA ") (segid " " and resid "43 " and name "HD11") 5.000 5.000 0.000 peak 5096 weight 0.10000E+01 volume -0.14270E+01 ppm1 3.573 ppm2 0.790 OR { 5096} (segid " " and resid "23 " and name "HA ") (segid " " and resid "43 " and name "HD13") OR { 5096} (segid " " and resid "23 " and name "HA ") (segid " " and resid "43 " and name "HD12") ASSI { 2535} (segid " " and resid "23 " and name "HA ") (segid " " and resid "56 " and name "HD13") 6.000 6.000 0.000 peak 2535 weight 0.10000E+01 volume -0.21800E+00 ppm1 3.576 ppm2 0.414 OR { 2535} (segid " " and resid "23 " and name "HA ") (segid " " and resid "56 " and name "HD11") OR { 2535} (segid " " and resid "23 " and name "HA ") (segid " " and resid "56 " and name "HD12") ASSI { 2533} (segid " " and resid "23 " and name "HA ") (segid " " and resid "56 " and name "HD23") 5.000 5.000 0.000 peak 2533 weight 0.10000E+01 volume -0.72900E+00 ppm1 3.576 ppm2 0.308 OR { 2533} (segid " " and resid "23 " and name "HA ") (segid " " and resid "56 " and name "HD21") OR { 2533} (segid " " and resid "23 " and name "HA ") (segid " " and resid "56 " and name "HD22") ASSI { 2583} (segid " " and resid "23 " and name "HG11") (segid " " and resid "27 " and name "HE1 ") 5.000 5.000 0.000 peak 2583 weight 0.10000E+01 volume -0.46600E+00 ppm1 0.848 ppm2 2.759 OR { 2583} (segid " " and resid "23 " and name "HG12") (segid " " and resid "27 " and name "HE1 ") OR { 2583} (segid " " and resid "23 " and name "HG13") (segid " " and resid "27 " and name "HE1 ") ASSI { 2576} (segid " " and resid "23 " and name "HG13") (segid " " and resid "27 " and name "HE2 ") 5.000 5.000 0.000 peak 2576 weight 0.10000E+01 volume -0.11470E+01 ppm1 0.848 ppm2 2.601 OR { 2576} (segid " " and resid "23 " and name "HG12") (segid " " and resid "27 " and name "HE2 ") OR { 2576} (segid " " and resid "23 " and name "HG11") (segid " " and resid "27 " and name "HE2 ") ASSI { 2589} (segid " " and resid "23 " and name "HG11") (segid " " and resid "50 " and name "HA ") 6.000 6.000 0.000 peak 2589 weight 0.10000E+01 volume -0.14300E+00 ppm1 0.848 ppm2 3.839 OR { 2589} (segid " " and resid "23 " and name "HG12") (segid " " and resid "50 " and name "HA ") OR { 2589} (segid " " and resid "23 " and name "HG13") (segid " " and resid "50 " and name "HA ") ASSI { 2575} (segid " " and resid "23 " and name "HG13") (segid " " and resid "50 " and name "HB1 ") 5.000 5.000 0.000 peak 2575 weight 0.10000E+01 volume -0.69700E+00 ppm1 0.848 ppm2 1.230 OR { 2575} (segid " " and resid "23 " and name "HG11") (segid " " and resid "50 " and name "HB1 ") OR { 2575} (segid " " and resid "23 " and name "HG12") (segid " " and resid "50 " and name "HB1 ") ASSI { 2579} (segid " " and resid "23 " and name "HG13") (segid " " and resid "50 " and name "HB2 ") 5.000 5.000 0.000 peak 2579 weight 0.10000E+01 volume -0.10080E+01 ppm1 0.848 ppm2 1.547 OR { 2579} (segid " " and resid "23 " and name "HG12") (segid " " and resid "50 " and name "HB2 ") OR { 2579} (segid " " and resid "23 " and name "HG11") (segid " " and resid "50 " and name "HB2 ") ASSI { 2592} (segid " " and resid "23 " and name "HG11") (segid " " and resid "59 " and name "HE2 ") 6.000 6.000 0.000 peak 2592 weight 0.10000E+01 volume -0.12400E+00 ppm1 0.861 ppm2 6.869 OR { 2592} (segid " " and resid "23 " and name "HG11") (segid " " and resid "59 " and name "HE1 ") OR { 2592} (segid " " and resid "23 " and name "HG12") (segid " " and resid "59 " and name "HE2 ") OR { 2592} (segid " " and resid "23 " and name "HG13") (segid " " and resid "59 " and name "HE2 ") OR { 2592} (segid " " and resid "23 " and name "HG12") (segid " " and resid "59 " and name "HE1 ") OR { 2592} (segid " " and resid "23 " and name "HG13") (segid " " and resid "59 " and name "HE1 ") ASSI { 2565} (segid " " and resid "23 " and name "HG21") (segid " " and resid "55 " and name "HA ") 6.000 6.000 0.000 peak 2565 weight 0.10000E+01 volume -0.17300E+00 ppm1 1.059 ppm2 5.236 OR { 2565} (segid " " and resid "23 " and name "HG22") (segid " " and resid "55 " and name "HA ") OR { 2565} (segid " " and resid "23 " and name "HG23") (segid " " and resid "55 " and name "HA ") ASSI { 2548} (segid " " and resid "23 " and name "HG23") (segid " " and resid "56 " and name "HD23") 5.000 5.000 0.000 peak 2548 weight 0.10000E+01 volume -0.99500E+00 ppm1 1.059 ppm2 0.308 OR { 2548} (segid " " and resid "23 " and name "HG21") (segid " " and resid "56 " and name "HD23") OR { 2548} (segid " " and resid "23 " and name "HG23") (segid " " and resid "56 " and name "HD21") OR { 2548} (segid " " and resid "23 " and name "HG22") (segid " " and resid "56 " and name "HD23") OR { 2548} (segid " " and resid "23 " and name "HG21") (segid " " and resid "56 " and name "HD21") OR { 2548} (segid " " and resid "23 " and name "HG22") (segid " " and resid "56 " and name "HD22") OR { 2548} (segid " " and resid "23 " and name "HG22") (segid " " and resid "56 " and name "HD21") OR { 2548} (segid " " and resid "23 " and name "HG21") (segid " " and resid "56 " and name "HD22") OR { 2548} (segid " " and resid "23 " and name "HG23") (segid " " and resid "56 " and name "HD22") ASSI { 2564} (segid " " and resid "23 " and name "HG21") (segid " " and resid "61 " and name "HD11") 6.000 6.000 0.000 peak 2564 weight 0.10000E+01 volume -0.26700E+00 ppm1 1.059 ppm2 0.387 OR { 2564} (segid " " and resid "23 " and name "HG23") (segid " " and resid "61 " and name "HD13") OR { 2564} (segid " " and resid "23 " and name "HG22") (segid " " and resid "61 " and name "HD11") OR { 2564} (segid " " and resid "23 " and name "HG23") (segid " " and resid "61 " and name "HD11") OR { 2564} (segid " " and resid "23 " and name "HG22") (segid " " and resid "61 " and name "HD13") OR { 2564} (segid " " and resid "23 " and name "HG21") (segid " " and resid "61 " and name "HD12") OR { 2564} (segid " " and resid "23 " and name "HG22") (segid " " and resid "61 " and name "HD12") OR { 2564} (segid " " and resid "23 " and name "HG23") (segid " " and resid "61 " and name "HD12") OR { 2564} (segid " " and resid "23 " and name "HG21") (segid " " and resid "61 " and name "HD13") ASSI { 2595} (segid " " and resid "24 " and name "HA ") (segid " " and resid "23 " and name "HG13") 5.000 5.000 0.000 peak 2595 weight 0.10000E+01 volume -0.31100E+00 ppm1 3.958 ppm2 0.835 OR { 2595} (segid " " and resid "24 " and name "HA ") (segid " " and resid "23 " and name "HG12") OR { 2595} (segid " " and resid "24 " and name "HA ") (segid " " and resid "23 " and name "HG11") ASSI { 2578} (segid " " and resid "24 " and name "HA ") (segid " " and resid "24 " and name "HB2 ") 3.300 3.300 0.000 peak 2578 weight 0.10000E+01 volume -0.26290E+01 ppm1 3.944 ppm2 2.021 ASSI { 2593} (segid " " and resid "24 " and name "HA ") (segid " " and resid "24 " and name "HG1 ") 5.000 5.000 0.000 peak 2593 weight 0.10000E+01 volume -0.65500E+00 ppm1 3.944 ppm2 2.495 ASSI { 2585} (segid " " and resid "24 " and name "HA ") (segid " " and resid "24 " and name "HG2 ") 5.000 5.000 0.000 peak 2585 weight 0.10000E+01 volume -0.10170E+01 ppm1 3.944 ppm2 2.363 ASSI { 2596} (segid " " and resid "24 " and name "HA ") (segid " " and resid "27 " and name "HB1 ") 5.000 5.000 0.000 peak 2596 weight 0.10000E+01 volume -0.35300E+00 ppm1 3.944 ppm2 1.441 ASSI { 2588} (segid " " and resid "24 " and name "HA ") (segid " " and resid "27 " and name "HD1 ") 5.000 5.000 0.000 peak 2588 weight 0.10000E+01 volume -0.10510E+01 ppm1 3.944 ppm2 1.652 OR { 2588} (segid " " and resid "24 " and name "HA ") (segid " " and resid "27 " and name "HD2 ") ASSI { 2598} (segid " " and resid "24 " and name "HA ") (segid " " and resid "27 " and name "HE2 ") 6.000 6.000 0.000 peak 2598 weight 0.10000E+01 volume -0.16400E+00 ppm1 3.944 ppm2 2.627 ASSI { 5137} (segid " " and resid "24 " and name "HA ") (segid " " and resid "27 " and name "HG1 ") 5.000 5.000 0.000 peak 5137 weight 0.10000E+01 volume -0.11850E+01 ppm1 3.947 ppm2 1.615 ASSI { 344} (segid " " and resid "24 " and name "HB1 ") (segid " " and resid "24 " and name "HA ") 5.000 5.000 0.000 peak 344 weight 0.10000E+01 volume -0.11260E+01 ppm1 2.087 ppm2 3.944 ASSI { 2602} (segid " " and resid "24 " and name "HB1 ") (segid " " and resid "24 " and name "HG1 ") 5.000 5.000 0.000 peak 2602 weight 0.10000E+01 volume -0.11900E+01 ppm1 2.087 ppm2 2.522 ASSI { 2604} (segid " " and resid "24 " and name "HB2 ") (segid " " and resid "24 " and name "HG1 ") 5.000 5.000 0.000 peak 2604 weight 0.10000E+01 volume -0.10310E+01 ppm1 2.021 ppm2 2.522 ASSI { 5140} (segid " " and resid "24 " and name "HB1 ") (segid " " and resid "24 " and name "HG2 ") 5.000 5.000 0.000 peak 5140 weight 0.10000E+01 volume -0.18550E+01 ppm1 2.082 ppm2 2.367 ASSI { 5145} (segid " " and resid "24 " and name "HB2 ") (segid " " and resid "24 " and name "HG2 ") 5.000 5.000 0.000 peak 5145 weight 0.10000E+01 volume -0.18460E+01 ppm1 2.025 ppm2 2.368 ASSI { 2609} (segid " " and resid "24 " and name "HB2 ") (segid " " and resid "52 " and name "HB1 ") 6.000 6.000 0.000 peak 2609 weight 0.10000E+01 volume -0.13000E+00 ppm1 2.021 ppm2 2.653 ASSI { 2618} (segid " " and resid "25 " and name "HA ") (segid " " and resid "25 " and name "HB1 ") 5.000 5.000 0.000 peak 2618 weight 0.10000E+01 volume -0.11950E+01 ppm1 4.551 ppm2 3.075 ASSI { 2619} (segid " " and resid "25 " and name "HA ") (segid " " and resid "25 " and name "HB2 ") 5.000 5.000 0.000 peak 2619 weight 0.10000E+01 volume -0.11240E+01 ppm1 4.551 ppm2 2.943 ASSI { 2617} (segid " " and resid "25 " and name "HA ") (segid " " and resid "28 " and name "HB2 ") 5.000 5.000 0.000 peak 2617 weight 0.10000E+01 volume -0.12690E+01 ppm1 4.551 ppm2 1.626 OR { 2617} (segid " " and resid "25 " and name "HA ") (segid " " and resid "28 " and name "HB1 ") OR { 2617} (segid " " and resid "25 " and name "HA ") (segid " " and resid "28 " and name "HB3 ") ASSI { 2624} (segid " " and resid "25 " and name "HB2 ") (segid " " and resid "25 " and name "HB1 ") 2.700 2.700 0.000 peak 2624 weight 0.10000E+01 volume -0.57590E+01 ppm1 2.930 ppm2 3.075 ASSI { 2629} (segid " " and resid "26 " and name "HA ") (segid " " and resid "26 " and name "HB1 ") 5.000 5.000 0.000 peak 2629 weight 0.10000E+01 volume -0.65600E+00 ppm1 4.551 ppm2 3.576 ASSI { 2628} (segid " " and resid "26 " and name "HA ") (segid " " and resid "26 " and name "HB2 ") 5.000 5.000 0.000 peak 2628 weight 0.10000E+01 volume -0.92900E+00 ppm1 4.551 ppm2 3.180 ASSI { 2639} (segid " " and resid "26 " and name "HB2 ") (segid " " and resid "23 " and name "HA ") 3.300 3.300 0.000 peak 2639 weight 0.10000E+01 volume -0.38910E+01 ppm1 3.194 ppm2 3.576 ASSI { 5173} (segid " " and resid "26 " and name "HB2 ") (segid " " and resid "26 " and name "HB1 ") 3.300 3.300 0.000 peak 5173 weight 0.10000E+01 volume -0.36580E+01 ppm1 3.187 ppm2 3.561 ASSI { 2636} (segid " " and resid "26 " and name "HB1 ") (segid " " and resid "26 " and name "HD2 ") 5.000 5.000 0.000 peak 2636 weight 0.10000E+01 volume -0.38100E+00 ppm1 3.576 ppm2 7.080 OR { 2636} (segid " " and resid "26 " and name "HB1 ") (segid " " and resid "26 " and name "HD1 ") ASSI { 2643} (segid " " and resid "26 " and name "HB2 ") (segid " " and resid "26 " and name "HD1 ") 5.000 5.000 0.000 peak 2643 weight 0.10000E+01 volume -0.37500E+00 ppm1 3.194 ppm2 7.080 OR { 2643} (segid " " and resid "26 " and name "HB2 ") (segid " " and resid "26 " and name "HD2 ") ASSI { 2638} (segid " " and resid "26 " and name "HB1 ") (segid " " and resid "56 " and name "HD11") 6.000 6.000 0.000 peak 2638 weight 0.10000E+01 volume -0.19700E+00 ppm1 3.576 ppm2 0.414 OR { 2638} (segid " " and resid "26 " and name "HB1 ") (segid " " and resid "56 " and name "HD13") OR { 2638} (segid " " and resid "26 " and name "HB1 ") (segid " " and resid "56 " and name "HD12") ASSI { 2641} (segid " " and resid "26 " and name "HB2 ") (segid " " and resid "56 " and name "HD11") 5.000 5.000 0.000 peak 2641 weight 0.10000E+01 volume -0.41900E+00 ppm1 3.194 ppm2 0.414 OR { 2641} (segid " " and resid "26 " and name "HB2 ") (segid " " and resid "56 " and name "HD13") OR { 2641} (segid " " and resid "26 " and name "HB2 ") (segid " " and resid "56 " and name "HD12") ASSI { 2642} (segid " " and resid "26 " and name "HB2 ") (segid " " and resid "56 " and name "HD22") 5.000 5.000 0.000 peak 2642 weight 0.10000E+01 volume -0.38000E+00 ppm1 3.194 ppm2 0.308 OR { 2642} (segid " " and resid "26 " and name "HB2 ") (segid " " and resid "56 " and name "HD23") OR { 2642} (segid " " and resid "26 " and name "HB2 ") (segid " " and resid "56 " and name "HD21") ASSI { 2665} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "15 " and name "HB ") 6.000 6.000 0.000 peak 2665 weight 0.10000E+01 volume -0.22600E+00 ppm1 7.067 ppm2 1.705 OR { 2665} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "15 " and name "HB ") ASSI { 2661} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "15 " and name "HG23") 5.000 5.000 0.000 peak 2661 weight 0.10000E+01 volume -0.48300E+00 ppm1 7.067 ppm2 0.941 OR { 2661} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "15 " and name "HG21") OR { 2661} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "15 " and name "HG22") OR { 2661} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "15 " and name "HG21") OR { 2661} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "15 " and name "HG22") OR { 2661} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "15 " and name "HG23") ASSI { 2658} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "23 " and name "HA ") 5.000 5.000 0.000 peak 2658 weight 0.10000E+01 volume -0.67400E+00 ppm1 7.067 ppm2 3.576 OR { 2658} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "23 " and name "HA ") ASSI { 2664} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "30 " and name "HD13") 6.000 6.000 0.000 peak 2664 weight 0.10000E+01 volume -0.14200E+00 ppm1 7.067 ppm2 0.045 OR { 2664} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "30 " and name "HD11") OR { 2664} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "30 " and name "HD12") OR { 2664} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "30 " and name "HD12") OR { 2664} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "30 " and name "HD11") OR { 2664} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "30 " and name "HD13") ASSI { 2659} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "43 " and name "HD11") 5.000 5.000 0.000 peak 2659 weight 0.10000E+01 volume -0.63200E+00 ppm1 7.067 ppm2 0.782 OR { 2659} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "43 " and name "HD12") OR { 2659} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "43 " and name "HD13") OR { 2659} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "43 " and name "HD12") OR { 2659} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "43 " and name "HD11") OR { 2659} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "43 " and name "HD13") ASSI { 2662} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "56 " and name "HD22") 5.000 5.000 0.000 peak 2662 weight 0.10000E+01 volume -0.32200E+00 ppm1 7.067 ppm2 0.308 OR { 2662} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "56 " and name "HD21") OR { 2662} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "56 " and name "HD23") OR { 2662} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "56 " and name "HD22") OR { 2662} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "56 " and name "HD23") OR { 2662} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "56 " and name "HD21") ASSI { 2670} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "43 " and name "HD11") 5.000 5.000 0.000 peak 2670 weight 0.10000E+01 volume -0.58400E+00 ppm1 6.883 ppm2 0.782 OR { 2670} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "43 " and name "HD12") OR { 2670} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "43 " and name "HD13") OR { 2670} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "43 " and name "HD11") OR { 2670} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "43 " and name "HD12") OR { 2670} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "43 " and name "HD13") ASSI { 2669} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "50 " and name "HD11") 5.000 5.000 0.000 peak 2669 weight 0.10000E+01 volume -0.70900E+00 ppm1 6.883 ppm2 0.572 OR { 2669} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "50 " and name "HD13") OR { 2669} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "50 " and name "HD12") OR { 2669} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "50 " and name "HD11") OR { 2669} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "50 " and name "HD12") OR { 2669} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "50 " and name "HD13") ASSI { 2683} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "50 " and name "HD21") 6.000 6.000 0.000 peak 2683 weight 0.10000E+01 volume -0.63000E-01 ppm1 6.896 ppm2 0.150 OR { 2683} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "50 " and name "HD23") OR { 2683} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "50 " and name "HD22") OR { 2683} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "50 " and name "HD23") OR { 2683} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "50 " and name "HD21") OR { 2683} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "50 " and name "HD22") ASSI { 2674} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "61 " and name "HD11") 6.000 6.000 0.000 peak 2674 weight 0.10000E+01 volume -0.23000E+00 ppm1 6.883 ppm2 0.387 OR { 2674} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "61 " and name "HD12") OR { 2674} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "61 " and name "HD13") OR { 2674} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "61 " and name "HD13") OR { 2674} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "61 " and name "HD12") OR { 2674} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "61 " and name "HD11") ASSI { 5222} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "67 " and name "HD12") 5.000 5.000 0.000 peak 5222 weight 0.10000E+01 volume -0.91200E+00 ppm1 6.891 ppm2 0.687 OR { 5222} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "67 " and name "HD11") OR { 5222} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "67 " and name "HD13") OR { 5222} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "67 " and name "HD11") OR { 5222} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "67 " and name "HD12") OR { 5222} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "67 " and name "HD13") ASSI { 5216} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "67 " and name "HG23") 5.000 5.000 0.000 peak 5216 weight 0.10000E+01 volume -0.74900E+00 ppm1 6.891 ppm2 0.968 OR { 5216} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "67 " and name "HG22") OR { 5216} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "67 " and name "HG21") OR { 5216} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "67 " and name "HG21") OR { 5216} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "67 " and name "HG23") OR { 5216} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "67 " and name "HG22") ASSI { 2652} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "5 " and name "HB2 ") 6.000 6.000 0.000 peak 2652 weight 0.10000E+01 volume -0.15600E+00 ppm1 6.813 ppm2 1.119 ASSI { 2649} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "26 " and name "HD1 ") 5.000 5.000 0.000 peak 2649 weight 0.10000E+01 volume -0.40500E+00 ppm1 6.817 ppm2 7.080 OR { 2649} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "26 " and name "HD2 ") ASSI { 5178} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "26 " and name "HE2 ") 2.700 2.700 0.000 peak 5178 weight 0.10000E+01 volume -0.50830E+01 ppm1 6.813 ppm2 6.891 OR { 5178} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "26 " and name "HE1 ") ASSI { 2647} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "67 " and name "HD11") 5.000 5.000 0.000 peak 2647 weight 0.10000E+01 volume -0.80300E+00 ppm1 6.817 ppm2 0.703 OR { 2647} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "67 " and name "HD13") OR { 2647} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "67 " and name "HD12") ASSI { 5181} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "67 " and name "HG12") 6.000 6.000 0.000 peak 5181 weight 0.10000E+01 volume -0.23600E+00 ppm1 6.813 ppm2 1.170 ASSI { 2650} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "67 " and name "HG23") 5.000 5.000 0.000 peak 2650 weight 0.10000E+01 volume -0.32000E+00 ppm1 6.817 ppm2 0.967 OR { 2650} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "67 " and name "HG21") OR { 2650} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "67 " and name "HG22") ASSI { 2277} (segid " " and resid "27 " and name "HA ") (segid " " and resid "27 " and name "HB1 ") 5.000 5.000 0.000 peak 2277 weight 0.10000E+01 volume -0.12700E+01 ppm1 4.379 ppm2 1.415 ASSI { 2275} (segid " " and resid "27 " and name "HA ") (segid " " and resid "27 " and name "HG1 ") 5.000 5.000 0.000 peak 2275 weight 0.10000E+01 volume -0.16140E+01 ppm1 4.379 ppm2 1.626 ASSI { 2261} (segid " " and resid "27 " and name "HA ") (segid " " and resid "30 " and name "HB ") 3.300 3.300 0.000 peak 2261 weight 0.10000E+01 volume -0.24350E+01 ppm1 4.379 ppm2 1.995 ASSI { 2270} (segid " " and resid "27 " and name "HA ") (segid " " and resid "30 " and name "HD11") 5.000 5.000 0.000 peak 2270 weight 0.10000E+01 volume -0.14190E+01 ppm1 4.379 ppm2 0.045 OR { 2270} (segid " " and resid "27 " and name "HA ") (segid " " and resid "30 " and name "HD12") OR { 2270} (segid " " and resid "27 " and name "HA ") (segid " " and resid "30 " and name "HD13") ASSI { 2282} (segid " " and resid "27 " and name "HA ") (segid " " and resid "30 " and name "HG11") 5.000 5.000 0.000 peak 2282 weight 0.10000E+01 volume -0.47400E+00 ppm1 4.379 ppm2 1.309 ASSI { 2280} (segid " " and resid "27 " and name "HA ") (segid " " and resid "30 " and name "HG21") 5.000 5.000 0.000 peak 2280 weight 0.10000E+01 volume -0.43300E+00 ppm1 4.379 ppm2 0.519 OR { 2280} (segid " " and resid "27 " and name "HA ") (segid " " and resid "30 " and name "HG22") OR { 2280} (segid " " and resid "27 " and name "HA ") (segid " " and resid "30 " and name "HG23") ASSI { 2281} (segid " " and resid "27 " and name "HA ") (segid " " and resid "43 " and name "HD13") 5.000 5.000 0.000 peak 2281 weight 0.10000E+01 volume -0.56700E+00 ppm1 4.379 ppm2 0.782 OR { 2281} (segid " " and resid "27 " and name "HA ") (segid " " and resid "43 " and name "HD11") OR { 2281} (segid " " and resid "27 " and name "HA ") (segid " " and resid "43 " and name "HD12") ASSI { 2684} (segid " " and resid "27 " and name "HB2 ") (segid " " and resid "27 " and name "HA ") 5.000 5.000 0.000 peak 2684 weight 0.10000E+01 volume -0.38900E+00 ppm1 2.008 ppm2 4.366 ASSI { 2689} (segid " " and resid "27 " and name "HB1 ") (segid " " and resid "38 " and name "HA ") 5.000 5.000 0.000 peak 2689 weight 0.10000E+01 volume -0.36100E+00 ppm1 1.428 ppm2 4.050 ASSI { 2691} (segid " " and resid "27 " and name "HB1 ") (segid " " and resid "43 " and name "HD13") 6.000 6.000 0.000 peak 2691 weight 0.10000E+01 volume -0.13800E+00 ppm1 1.415 ppm2 0.809 OR { 2691} (segid " " and resid "27 " and name "HB1 ") (segid " " and resid "43 " and name "HD11") OR { 2691} (segid " " and resid "27 " and name "HB1 ") (segid " " and resid "43 " and name "HD12") ASSI { 2728} (segid " " and resid "27 " and name "HD1 ") (segid " " and resid "27 " and name "HE1 ") 5.000 5.000 0.000 peak 2728 weight 0.10000E+01 volume -0.57600E+00 ppm1 1.639 ppm2 2.759 OR { 2728} (segid " " and resid "27 " and name "HD2 ") (segid " " and resid "27 " and name "HE1 ") ASSI { 2727} (segid " " and resid "27 " and name "HD2 ") (segid " " and resid "27 " and name "HE2 ") 5.000 5.000 0.000 peak 2727 weight 0.10000E+01 volume -0.57100E+00 ppm1 1.639 ppm2 2.601 OR { 2727} (segid " " and resid "27 " and name "HD1 ") (segid " " and resid "27 " and name "HE2 ") ASSI { 2722} (segid " " and resid "27 " and name "HE2 ") (segid " " and resid "27 " and name "HB1 ") 6.000 6.000 0.000 peak 2722 weight 0.10000E+01 volume -0.19600E+00 ppm1 2.614 ppm2 1.415 ASSI { 2721} (segid " " and resid "27 " and name "HE2 ") (segid " " and resid "27 " and name "HB2 ") 6.000 6.000 0.000 peak 2721 weight 0.10000E+01 volume -0.12800E+00 ppm1 2.614 ppm2 2.021 ASSI { 5261} (segid " " and resid "27 " and name "HE1 ") (segid " " and resid "27 " and name "HG1 ") 5.000 5.000 0.000 peak 5261 weight 0.10000E+01 volume -0.13490E+01 ppm1 2.751 ppm2 1.614 ASSI { 2772} (segid " " and resid "27 " and name "HE2 ") (segid " " and resid "27 " and name "HG1 ") 5.000 5.000 0.000 peak 2772 weight 0.10000E+01 volume -0.12480E+01 ppm1 2.608 ppm2 1.613 ASSI { 2725} (segid " " and resid "27 " and name "HE2 ") (segid " " and resid "41 " and name "HB2 ") 6.000 6.000 0.000 peak 2725 weight 0.10000E+01 volume -0.12800E+00 ppm1 2.614 ppm2 1.942 ASSI { 5256} (segid " " and resid "27 " and name "HE1 ") (segid " " and resid "43 " and name "HD12") 5.000 5.000 0.000 peak 5256 weight 0.10000E+01 volume -0.86200E+00 ppm1 2.751 ppm2 0.788 OR { 5256} (segid " " and resid "27 " and name "HE1 ") (segid " " and resid "43 " and name "HD11") OR { 5256} (segid " " and resid "27 " and name "HE1 ") (segid " " and resid "43 " and name "HD13") ASSI { 2762} (segid " " and resid "27 " and name "HE2 ") (segid " " and resid "43 " and name "HD12") 5.000 5.000 0.000 peak 2762 weight 0.10000E+01 volume -0.11670E+01 ppm1 2.608 ppm2 0.787 OR { 2762} (segid " " and resid "27 " and name "HE2 ") (segid " " and resid "43 " and name "HD11") OR { 2762} (segid " " and resid "27 " and name "HE2 ") (segid " " and resid "43 " and name "HD13") ASSI { 2692} (segid " " and resid "27 " and name "HG1 ") (segid " " and resid "27 " and name "HB1 ") 5.000 5.000 0.000 peak 2692 weight 0.10000E+01 volume -0.77400E+00 ppm1 1.612 ppm2 1.415 ASSI { 2726} (segid " " and resid "28 " and name "HA ") (segid " " and resid "28 " and name "HB2 ") 3.300 3.300 0.000 peak 2726 weight 0.10000E+01 volume -0.39180E+01 ppm1 4.168 ppm2 1.626 OR { 2726} (segid " " and resid "28 " and name "HA ") (segid " " and resid "28 " and name "HB3 ") OR { 2726} (segid " " and resid "28 " and name "HA ") (segid " " and resid "28 " and name "HB1 ") ASSI { 2729} (segid " " and resid "28 " and name "HA ") (segid " " and resid "31 " and name "HB1 ") 5.000 5.000 0.000 peak 2729 weight 0.10000E+01 volume -0.10400E+01 ppm1 4.168 ppm2 2.416 ASSI { 2730} (segid " " and resid "28 " and name "HA ") (segid " " and resid "31 " and name "HB2 ") 5.000 5.000 0.000 peak 2730 weight 0.10000E+01 volume -0.78400E+00 ppm1 4.155 ppm2 1.889 ASSI { 2733} (segid " " and resid "28 " and name "HA ") (segid " " and resid "38 " and name "HD1 ") 6.000 6.000 0.000 peak 2733 weight 0.10000E+01 volume -0.18600E+00 ppm1 4.168 ppm2 3.734 OR { 2733} (segid " " and resid "28 " and name "HA ") (segid " " and resid "38 " and name "HD2 ") ASSI { 2740} (segid " " and resid "28 " and name "HB1 ") (segid " " and resid "31 " and name "HB1 ") 6.000 6.000 0.000 peak 2740 weight 0.10000E+01 volume -0.21900E+00 ppm1 1.639 ppm2 2.416 OR { 2740} (segid " " and resid "28 " and name "HB2 ") (segid " " and resid "31 " and name "HB1 ") OR { 2740} (segid " " and resid "28 " and name "HB3 ") (segid " " and resid "31 " and name "HB1 ") ASSI { 2748} (segid " " and resid "29 " and name "HA ") (segid " " and resid "32 " and name "HB1 ") 5.000 5.000 0.000 peak 2748 weight 0.10000E+01 volume 0.40100E+00 ppm1 4.182 ppm2 2.838 ASSI { 2754} (segid " " and resid "29 " and name "HB1 ") (segid " " and resid "29 " and name "HA ") 5.000 5.000 0.000 peak 2754 weight 0.10000E+01 volume -0.83400E+00 ppm1 1.889 ppm2 4.182 ASSI { 2768} (segid " " and resid "29 " and name "HG1 ") (segid " " and resid "15 " and name "HG23") 6.000 6.000 0.000 peak 2768 weight 0.10000E+01 volume -0.10500E+00 ppm1 1.836 ppm2 0.941 OR { 2768} (segid " " and resid "29 " and name "HG1 ") (segid " " and resid "15 " and name "HG22") OR { 2768} (segid " " and resid "29 " and name "HG1 ") (segid " " and resid "15 " and name "HG21") ASSI { 2769} (segid " " and resid "29 " and name "HG1 ") (segid " " and resid "26 " and name "HA ") 6.000 6.000 0.000 peak 2769 weight 0.10000E+01 volume -0.16900E+00 ppm1 1.850 ppm2 4.551 ASSI { 2765} (segid " " and resid "29 " and name "HG1 ") (segid " " and resid "29 " and name "HA ") 5.000 5.000 0.000 peak 2765 weight 0.10000E+01 volume -0.46900E+00 ppm1 1.850 ppm2 4.182 ASSI { 2789} (segid " " and resid "30 " and name "HA ") (segid " " and resid "30 " and name "HB ") 5.000 5.000 0.000 peak 2789 weight 0.10000E+01 volume -0.94000E+00 ppm1 3.325 ppm2 1.995 ASSI { 2788} (segid " " and resid "30 " and name "HA ") (segid " " and resid "30 " and name "HD13") 5.000 5.000 0.000 peak 2788 weight 0.10000E+01 volume -0.51500E+00 ppm1 3.325 ppm2 0.045 OR { 2788} (segid " " and resid "30 " and name "HA ") (segid " " and resid "30 " and name "HD11") OR { 2788} (segid " " and resid "30 " and name "HA ") (segid " " and resid "30 " and name "HD12") ASSI { 2787} (segid " " and resid "30 " and name "HA ") (segid " " and resid "30 " and name "HG11") 5.000 5.000 0.000 peak 2787 weight 0.10000E+01 volume -0.10250E+01 ppm1 3.325 ppm2 1.309 ASSI { 2786} (segid " " and resid "30 " and name "HA ") (segid " " and resid "30 " and name "HG12") 5.000 5.000 0.000 peak 2786 weight 0.10000E+01 volume -0.11880E+01 ppm1 3.325 ppm2 0.334 ASSI { 2784} (segid " " and resid "30 " and name "HA ") (segid " " and resid "30 " and name "HG21") 5.000 5.000 0.000 peak 2784 weight 0.10000E+01 volume -0.17320E+01 ppm1 3.325 ppm2 0.519 OR { 2784} (segid " " and resid "30 " and name "HA ") (segid " " and resid "30 " and name "HG22") OR { 2784} (segid " " and resid "30 " and name "HA ") (segid " " and resid "30 " and name "HG23") ASSI { 2790} (segid " " and resid "30 " and name "HA ") (segid " " and resid "33 " and name "HB2 ") 5.000 5.000 0.000 peak 2790 weight 0.10000E+01 volume -0.66000E+00 ppm1 3.325 ppm2 1.863 ASSI { 2798} (segid " " and resid "30 " and name "HB ") (segid " " and resid "30 " and name "HD12") 5.000 5.000 0.000 peak 2798 weight 0.10000E+01 volume -0.11180E+01 ppm1 2.008 ppm2 0.045 OR { 2798} (segid " " and resid "30 " and name "HB ") (segid " " and resid "30 " and name "HD11") OR { 2798} (segid " " and resid "30 " and name "HB ") (segid " " and resid "30 " and name "HD13") ASSI { 2803} (segid " " and resid "30 " and name "HB ") (segid " " and resid "30 " and name "HG11") 5.000 5.000 0.000 peak 2803 weight 0.10000E+01 volume -0.70400E+00 ppm1 1.995 ppm2 1.309 ASSI { 2808} (segid " " and resid "30 " and name "HB ") (segid " " and resid "30 " and name "HG12") 5.000 5.000 0.000 peak 2808 weight 0.10000E+01 volume -0.45000E+00 ppm1 2.008 ppm2 0.334 ASSI { 5353} (segid " " and resid "30 " and name "HD11") (segid " " and resid "5 " and name "HD22") 3.300 3.300 0.000 peak 5353 weight 0.10000E+01 volume -0.29510E+01 ppm1 0.044 ppm2 0.683 OR { 5353} (segid " " and resid "30 " and name "HD12") (segid " " and resid "5 " and name "HD21") OR { 5353} (segid " " and resid "30 " and name "HD13") (segid " " and resid "5 " and name "HD22") OR { 5353} (segid " " and resid "30 " and name "HD13") (segid " " and resid "5 " and name "HD23") OR { 5353} (segid " " and resid "30 " and name "HD11") (segid " " and resid "5 " and name "HD23") OR { 5353} (segid " " and resid "30 " and name "HD12") (segid " " and resid "5 " and name "HD23") OR { 5353} (segid " " and resid "30 " and name "HD13") (segid " " and resid "5 " and name "HD21") OR { 5353} (segid " " and resid "30 " and name "HD12") (segid " " and resid "5 " and name "HD22") OR { 5353} (segid " " and resid "30 " and name "HD11") (segid " " and resid "5 " and name "HD21") ASSI { 2843} (segid " " and resid "30 " and name "HD13") (segid " " and resid "26 " and name "HE2 ") 5.000 5.000 0.000 peak 2843 weight 0.10000E+01 volume -0.32100E+00 ppm1 0.045 ppm2 6.896 OR { 2843} (segid " " and resid "30 " and name "HD11") (segid " " and resid "26 " and name "HE2 ") OR { 2843} (segid " " and resid "30 " and name "HD12") (segid " " and resid "26 " and name "HE1 ") OR { 2843} (segid " " and resid "30 " and name "HD11") (segid " " and resid "26 " and name "HE1 ") OR { 2843} (segid " " and resid "30 " and name "HD13") (segid " " and resid "26 " and name "HE1 ") OR { 2843} (segid " " and resid "30 " and name "HD12") (segid " " and resid "26 " and name "HE2 ") ASSI { 2838} (segid " " and resid "30 " and name "HD12") (segid " " and resid "30 " and name "HG11") 3.300 3.300 0.000 peak 2838 weight 0.10000E+01 volume -0.25950E+01 ppm1 0.045 ppm2 1.309 OR { 2838} (segid " " and resid "30 " and name "HD13") (segid " " and resid "30 " and name "HG11") OR { 2838} (segid " " and resid "30 " and name "HD11") (segid " " and resid "30 " and name "HG11") ASSI { 2839} (segid " " and resid "30 " and name "HD11") (segid " " and resid "30 " and name "HG12") 3.300 3.300 0.000 peak 2839 weight 0.10000E+01 volume -0.26130E+01 ppm1 0.045 ppm2 0.334 OR { 2839} (segid " " and resid "30 " and name "HD12") (segid " " and resid "30 " and name "HG12") OR { 2839} (segid " " and resid "30 " and name "HD13") (segid " " and resid "30 " and name "HG12") ASSI { 2837} (segid " " and resid "30 " and name "HD13") (segid " " and resid "30 " and name "HG22") 3.300 3.300 0.000 peak 2837 weight 0.10000E+01 volume -0.28640E+01 ppm1 0.045 ppm2 0.519 OR { 2837} (segid " " and resid "30 " and name "HD11") (segid " " and resid "30 " and name "HG23") OR { 2837} (segid " " and resid "30 " and name "HD11") (segid " " and resid "30 " and name "HG22") OR { 2837} (segid " " and resid "30 " and name "HD13") (segid " " and resid "30 " and name "HG21") OR { 2837} (segid " " and resid "30 " and name "HD12") (segid " " and resid "30 " and name "HG23") OR { 2837} (segid " " and resid "30 " and name "HD12") (segid " " and resid "30 " and name "HG21") OR { 2837} (segid " " and resid "30 " and name "HD11") (segid " " and resid "30 " and name "HG21") OR { 2837} (segid " " and resid "30 " and name "HD13") (segid " " and resid "30 " and name "HG23") OR { 2837} (segid " " and resid "30 " and name "HD12") (segid " " and resid "30 " and name "HG22") ASSI { 5351} (segid " " and resid "30 " and name "HD11") (segid " " and resid "43 " and name "HD12") 2.700 2.700 0.000 peak 5351 weight 0.10000E+01 volume -0.51850E+01 ppm1 0.044 ppm2 0.788 OR { 5351} (segid " " and resid "30 " and name "HD11") (segid " " and resid "43 " and name "HD11") OR { 5351} (segid " " and resid "30 " and name "HD13") (segid " " and resid "43 " and name "HD11") OR { 5351} (segid " " and resid "30 " and name "HD12") (segid " " and resid "43 " and name "HD11") OR { 5351} (segid " " and resid "30 " and name "HD12") (segid " " and resid "43 " and name "HD13") OR { 5351} (segid " " and resid "30 " and name "HD12") (segid " " and resid "43 " and name "HD12") OR { 5351} (segid " " and resid "30 " and name "HD13") (segid " " and resid "43 " and name "HD13") OR { 5351} (segid " " and resid "30 " and name "HD11") (segid " " and resid "43 " and name "HD13") OR { 5351} (segid " " and resid "30 " and name "HD13") (segid " " and resid "43 " and name "HD12") ASSI { 5314} (segid " " and resid "30 " and name "HG11") (segid " " and resid "15 " and name "HD13") 5.000 5.000 0.000 peak 5314 weight 0.10000E+01 volume -0.62000E+00 ppm1 1.308 ppm2 0.652 OR { 5314} (segid " " and resid "30 " and name "HG11") (segid " " and resid "15 " and name "HD11") OR { 5314} (segid " " and resid "30 " and name "HG11") (segid " " and resid "15 " and name "HD12") ASSI { 2779} (segid " " and resid "30 " and name "HG12") (segid " " and resid "30 " and name "HG11") 3.300 3.300 0.000 peak 2779 weight 0.10000E+01 volume -0.20350E+01 ppm1 0.334 ppm2 1.309 ASSI { 2802} (segid " " and resid "30 " and name "HG11") (segid " " and resid "30 " and name "HG23") 5.000 5.000 0.000 peak 2802 weight 0.10000E+01 volume -0.56300E+00 ppm1 1.323 ppm2 0.519 OR { 2802} (segid " " and resid "30 " and name "HG11") (segid " " and resid "30 " and name "HG21") OR { 2802} (segid " " and resid "30 " and name "HG11") (segid " " and resid "30 " and name "HG22") ASSI { 2821} (segid " " and resid "30 " and name "HG22") (segid " " and resid "5 " and name "HD23") 5.000 5.000 0.000 peak 2821 weight 0.10000E+01 volume -0.19540E+01 ppm1 0.532 ppm2 0.677 OR { 2821} (segid " " and resid "30 " and name "HG23") (segid " " and resid "5 " and name "HD22") OR { 2821} (segid " " and resid "30 " and name "HG23") (segid " " and resid "5 " and name "HD21") OR { 2821} (segid " " and resid "30 " and name "HG22") (segid " " and resid "5 " and name "HD22") OR { 2821} (segid " " and resid "30 " and name "HG22") (segid " " and resid "5 " and name "HD21") OR { 2821} (segid " " and resid "30 " and name "HG21") (segid " " and resid "5 " and name "HD23") OR { 2821} (segid " " and resid "30 " and name "HG21") (segid " " and resid "5 " and name "HD21") OR { 2821} (segid " " and resid "30 " and name "HG21") (segid " " and resid "5 " and name "HD22") OR { 2821} (segid " " and resid "30 " and name "HG23") (segid " " and resid "5 " and name "HD23") ASSI { 2819} (segid " " and resid "30 " and name "HG23") (segid " " and resid "30 " and name "HB ") 3.300 3.300 0.000 peak 2819 weight 0.10000E+01 volume -0.31040E+01 ppm1 0.532 ppm2 1.995 OR { 2819} (segid " " and resid "30 " and name "HG22") (segid " " and resid "30 " and name "HB ") OR { 2819} (segid " " and resid "30 " and name "HG21") (segid " " and resid "30 " and name "HB ") ASSI { 2827} (segid " " and resid "30 " and name "HG23") (segid " " and resid "34 " and name "HB2 ") 5.000 5.000 0.000 peak 2827 weight 0.10000E+01 volume -0.82900E+00 ppm1 0.532 ppm2 1.652 OR { 2827} (segid " " and resid "30 " and name "HG21") (segid " " and resid "34 " and name "HB2 ") OR { 2827} (segid " " and resid "30 " and name "HG22") (segid " " and resid "34 " and name "HB2 ") ASSI { 2828} (segid " " and resid "30 " and name "HG23") (segid " " and resid "36 " and name "HB ") 5.000 5.000 0.000 peak 2828 weight 0.10000E+01 volume -0.60500E+00 ppm1 0.532 ppm2 1.468 OR { 2828} (segid " " and resid "30 " and name "HG22") (segid " " and resid "36 " and name "HB ") OR { 2828} (segid " " and resid "30 " and name "HG21") (segid " " and resid "36 " and name "HB ") ASSI { 2832} (segid " " and resid "30 " and name "HG23") (segid " " and resid "36 " and name "HG12") 6.000 6.000 0.000 peak 2832 weight 0.10000E+01 volume -0.24200E+00 ppm1 0.532 ppm2 1.151 OR { 2832} (segid " " and resid "30 " and name "HG22") (segid " " and resid "36 " and name "HG12") OR { 2832} (segid " " and resid "30 " and name "HG21") (segid " " and resid "36 " and name "HG12") ASSI { 2835} (segid " " and resid "30 " and name "HG21") (segid " " and resid "41 " and name "HA ") 6.000 6.000 0.000 peak 2835 weight 0.10000E+01 volume -0.72000E-01 ppm1 0.532 ppm2 4.076 OR { 2835} (segid " " and resid "30 " and name "HG22") (segid " " and resid "41 " and name "HA ") OR { 2835} (segid " " and resid "30 " and name "HG23") (segid " " and resid "41 " and name "HA ") ASSI { 2851} (segid " " and resid "31 " and name "HA ") (segid " " and resid "31 " and name "HB2 ") 5.000 5.000 0.000 peak 2851 weight 0.10000E+01 volume 0.61500E+00 ppm1 3.786 ppm2 1.889 ASSI { 2861} (segid " " and resid "31 " and name "HB1 ") (segid " " and resid "31 " and name "HA ") 5.000 5.000 0.000 peak 2861 weight 0.10000E+01 volume -0.56800E+00 ppm1 2.403 ppm2 3.786 ASSI { 2863} (segid " " and resid "31 " and name "HB2 ") (segid " " and resid "31 " and name "HB1 ") 3.300 3.300 0.000 peak 2863 weight 0.10000E+01 volume -0.23880E+01 ppm1 1.889 ppm2 2.416 ASSI { 2850} (segid " " and resid "31 " and name "HB1 ") (segid " " and resid "31 " and name "HG1 ") 5.000 5.000 0.000 peak 2850 weight 0.10000E+01 volume -0.78700E+00 ppm1 2.416 ppm2 2.258 ASSI { 5364} (segid " " and resid "31 " and name "HB1 ") (segid " " and resid "31 " and name "HG2 ") 3.300 3.300 0.000 peak 5364 weight 0.10000E+01 volume -0.25440E+01 ppm1 2.410 ppm2 1.901 ASSI { 2867} (segid " " and resid "31 " and name "HB2 ") (segid " " and resid "37 " and name "HA ") 6.000 6.000 0.000 peak 2867 weight 0.10000E+01 volume -0.19400E+00 ppm1 1.902 ppm2 4.603 ASSI { 5371} (segid " " and resid "31 " and name "HB2 ") (segid " " and resid "38 " and name "HD1 ") 5.000 5.000 0.000 peak 5371 weight 0.10000E+01 volume -0.10270E+01 ppm1 1.889 ppm2 3.719 OR { 5371} (segid " " and resid "31 " and name "HB2 ") (segid " " and resid "38 " and name "HD2 ") ASSI { 2874} (segid " " and resid "31 " and name "HG2 ") (segid " " and resid "31 " and name "HA ") 5.000 5.000 0.000 peak 2874 weight 0.10000E+01 volume -0.76600E+00 ppm1 1.902 ppm2 3.786 ASSI { 5374} (segid " " and resid "31 " and name "HG1 ") (segid " " and resid "38 " and name "HD1 ") 5.000 5.000 0.000 peak 5374 weight 0.10000E+01 volume -0.32300E+00 ppm1 2.261 ppm2 3.720 OR { 5374} (segid " " and resid "31 " and name "HG1 ") (segid " " and resid "38 " and name "HD2 ") ASSI { 5378} (segid " " and resid "31 " and name "HG2 ") (segid " " and resid "38 " and name "HD1 ") 5.000 5.000 0.000 peak 5378 weight 0.10000E+01 volume -0.54900E+00 ppm1 1.901 ppm2 3.719 OR { 5378} (segid " " and resid "31 " and name "HG2 ") (segid " " and resid "38 " and name "HD2 ") ASSI { 2891} (segid " " and resid "33 " and name "HA ") (segid " " and resid "33 " and name "HB2 ") 3.300 3.300 0.000 peak 2891 weight 0.10000E+01 volume -0.20140E+01 ppm1 4.313 ppm2 1.863 ASSI { 2900} (segid " " and resid "33 " and name "HB1 ") (segid " " and resid "30 " and name "HA ") 5.000 5.000 0.000 peak 2900 weight 0.10000E+01 volume -0.31900E+00 ppm1 1.942 ppm2 3.312 ASSI { 2918} (segid " " and resid "33 " and name "HD1 ") (segid " " and resid "33 " and name "HA ") 5.000 5.000 0.000 peak 2918 weight 0.10000E+01 volume -0.94900E+00 ppm1 1.718 ppm2 4.313 OR { 2918} (segid " " and resid "33 " and name "HD2 ") (segid " " and resid "33 " and name "HA ") ASSI { 2952} (segid " " and resid "35 " and name "HA2 ") (segid " " and resid "35 " and name "HA1 ") 2.700 2.700 0.000 peak 2952 weight 0.10000E+01 volume -0.43870E+01 ppm1 3.905 ppm2 4.103 ASSI { 2966} (segid " " and resid "36 " and name "HA ") (segid " " and resid "36 " and name "HB ") 5.000 5.000 0.000 peak 2966 weight 0.10000E+01 volume -0.66000E+00 ppm1 4.498 ppm2 1.468 ASSI { 2968} (segid " " and resid "36 " and name "HA ") (segid " " and resid "36 " and name "HD13") 5.000 5.000 0.000 peak 2968 weight 0.10000E+01 volume -0.49800E+00 ppm1 4.498 ppm2 0.782 OR { 2968} (segid " " and resid "36 " and name "HA ") (segid " " and resid "36 " and name "HD12") OR { 2968} (segid " " and resid "36 " and name "HA ") (segid " " and resid "36 " and name "HD11") ASSI { 2970} (segid " " and resid "36 " and name "HA ") (segid " " and resid "36 " and name "HG11") 5.000 5.000 0.000 peak 2970 weight 0.10000E+01 volume -0.41600E+00 ppm1 4.498 ppm2 1.362 ASSI { 2967} (segid " " and resid "36 " and name "HA ") (segid " " and resid "36 " and name "HG12") 5.000 5.000 0.000 peak 2967 weight 0.10000E+01 volume -0.50400E+00 ppm1 4.498 ppm2 1.125 ASSI { 2965} (segid " " and resid "36 " and name "HA ") (segid " " and resid "36 " and name "HG22") 5.000 5.000 0.000 peak 2965 weight 0.10000E+01 volume -0.12810E+01 ppm1 4.498 ppm2 0.914 OR { 2965} (segid " " and resid "36 " and name "HA ") (segid " " and resid "36 " and name "HG23") OR { 2965} (segid " " and resid "36 " and name "HA ") (segid " " and resid "36 " and name "HG21") ASSI { 2962} (segid " " and resid "36 " and name "HA ") (segid " " and resid "37 " and name "HD1 ") 3.300 3.300 0.000 peak 2962 weight 0.10000E+01 volume -0.27410E+01 ppm1 4.498 ppm2 4.129 ASSI { 2963} (segid " " and resid "36 " and name "HA ") (segid " " and resid "37 " and name "HD2 ") 5.000 5.000 0.000 peak 2963 weight 0.10000E+01 volume -0.19400E+01 ppm1 4.498 ppm2 3.549 ASSI { 2972} (segid " " and resid "36 " and name "HA ") (segid " " and resid "37 " and name "HG1 ") 5.000 5.000 0.000 peak 2972 weight 0.10000E+01 volume -0.41900E+00 ppm1 4.498 ppm2 2.047 OR { 2972} (segid " " and resid "36 " and name "HA ") (segid " " and resid "37 " and name "HG2 ") ASSI { 2975} (segid " " and resid "36 " and name "HB ") (segid " " and resid "36 " and name "HG11") 5.000 5.000 0.000 peak 2975 weight 0.10000E+01 volume -0.88300E+00 ppm1 1.481 ppm2 1.362 ASSI { 2977} (segid " " and resid "36 " and name "HB ") (segid " " and resid "36 " and name "HG12") 5.000 5.000 0.000 peak 2977 weight 0.10000E+01 volume -0.65000E+00 ppm1 1.481 ppm2 1.151 ASSI { 2980} (segid " " and resid "36 " and name "HB ") (segid " " and resid "41 " and name "HG1 ") 6.000 6.000 0.000 peak 2980 weight 0.10000E+01 volume -0.18600E+00 ppm1 1.481 ppm2 2.495 ASSI { 3017} (segid " " and resid "36 " and name "HD12") (segid " " and resid "34 " and name "HB2 ") 5.000 5.000 0.000 peak 3017 weight 0.10000E+01 volume -0.58500E+00 ppm1 0.796 ppm2 1.652 OR { 3017} (segid " " and resid "36 " and name "HD11") (segid " " and resid "34 " and name "HB2 ") OR { 3017} (segid " " and resid "36 " and name "HD13") (segid " " and resid "34 " and name "HB2 ") ASSI { 3018} (segid " " and resid "36 " and name "HD12") (segid " " and resid "34 " and name "HG2 ") 5.000 5.000 0.000 peak 3018 weight 0.10000E+01 volume -0.37000E+00 ppm1 0.796 ppm2 1.995 OR { 3018} (segid " " and resid "36 " and name "HD13") (segid " " and resid "34 " and name "HG2 ") OR { 3018} (segid " " and resid "36 " and name "HD11") (segid " " and resid "34 " and name "HG1 ") OR { 3018} (segid " " and resid "36 " and name "HD13") (segid " " and resid "34 " and name "HG1 ") OR { 3018} (segid " " and resid "36 " and name "HD12") (segid " " and resid "34 " and name "HG1 ") OR { 3018} (segid " " and resid "36 " and name "HD11") (segid " " and resid "34 " and name "HG2 ") ASSI { 3010} (segid " " and resid "36 " and name "HD13") (segid " " and resid "36 " and name "HG11") 3.300 3.300 0.000 peak 3010 weight 0.10000E+01 volume -0.21730E+01 ppm1 0.796 ppm2 1.362 OR { 3010} (segid " " and resid "36 " and name "HD12") (segid " " and resid "36 " and name "HG11") OR { 3010} (segid " " and resid "36 " and name "HD11") (segid " " and resid "36 " and name "HG11") ASSI { 3009} (segid " " and resid "36 " and name "HD11") (segid " " and resid "36 " and name "HG12") 3.300 3.300 0.000 peak 3009 weight 0.10000E+01 volume -0.24750E+01 ppm1 0.796 ppm2 1.125 OR { 3009} (segid " " and resid "36 " and name "HD13") (segid " " and resid "36 " and name "HG12") OR { 3009} (segid " " and resid "36 " and name "HD12") (segid " " and resid "36 " and name "HG12") ASSI { 5464} (segid " " and resid "36 " and name "HD13") (segid " " and resid "37 " and name "HD1 ") 6.000 6.000 0.000 peak 5464 weight 0.10000E+01 volume -0.24000E+00 ppm1 0.789 ppm2 4.137 OR { 5464} (segid " " and resid "36 " and name "HD12") (segid " " and resid "37 " and name "HD1 ") OR { 5464} (segid " " and resid "36 " and name "HD11") (segid " " and resid "37 " and name "HD1 ") ASSI { 3022} (segid " " and resid "36 " and name "HD13") (segid " " and resid "37 " and name "HD2 ") 6.000 6.000 0.000 peak 3022 weight 0.10000E+01 volume -0.12000E+00 ppm1 0.796 ppm2 3.549 OR { 3022} (segid " " and resid "36 " and name "HD12") (segid " " and resid "37 " and name "HD2 ") OR { 3022} (segid " " and resid "36 " and name "HD11") (segid " " and resid "37 " and name "HD2 ") ASSI { 3021} (segid " " and resid "36 " and name "HD11") (segid " " and resid "41 " and name "HA ") 6.000 6.000 0.000 peak 3021 weight 0.10000E+01 volume -0.26000E+00 ppm1 0.796 ppm2 4.103 OR { 3021} (segid " " and resid "36 " and name "HD12") (segid " " and resid "41 " and name "HA ") OR { 3021} (segid " " and resid "36 " and name "HD13") (segid " " and resid "41 " and name "HA ") ASSI { 3019} (segid " " and resid "36 " and name "HD12") (segid " " and resid "41 " and name "HG1 ") 6.000 6.000 0.000 peak 3019 weight 0.10000E+01 volume -0.28000E+00 ppm1 0.796 ppm2 2.495 OR { 3019} (segid " " and resid "36 " and name "HD11") (segid " " and resid "41 " and name "HG1 ") OR { 3019} (segid " " and resid "36 " and name "HD13") (segid " " and resid "41 " and name "HG1 ") ASSI { 2961} (segid " " and resid "36 " and name "HG11") (segid " " and resid "36 " and name "HG12") 2.700 2.700 0.000 peak 2961 weight 0.10000E+01 volume -0.45740E+01 ppm1 1.375 ppm2 1.125 ASSI { 2989} (segid " " and resid "36 " and name "HG11") (segid " " and resid "37 " and name "HD1 ") 6.000 6.000 0.000 peak 2989 weight 0.10000E+01 volume -0.10800E+00 ppm1 1.375 ppm2 4.129 ASSI { 2993} (segid " " and resid "36 " and name "HG21") (segid " " and resid "36 " and name "HB ") 3.300 3.300 0.000 peak 2993 weight 0.10000E+01 volume -0.21390E+01 ppm1 0.901 ppm2 1.468 OR { 2993} (segid " " and resid "36 " and name "HG23") (segid " " and resid "36 " and name "HB ") OR { 2993} (segid " " and resid "36 " and name "HG22") (segid " " and resid "36 " and name "HB ") ASSI { 3001} (segid " " and resid "36 " and name "HG23") (segid " " and resid "37 " and name "HD1 ") 5.000 5.000 0.000 peak 3001 weight 0.10000E+01 volume -0.73900E+00 ppm1 0.901 ppm2 4.129 OR { 3001} (segid " " and resid "36 " and name "HG22") (segid " " and resid "37 " and name "HD1 ") OR { 3001} (segid " " and resid "36 " and name "HG21") (segid " " and resid "37 " and name "HD1 ") ASSI { 3000} (segid " " and resid "36 " and name "HG22") (segid " " and resid "37 " and name "HD2 ") 5.000 5.000 0.000 peak 3000 weight 0.10000E+01 volume -0.79100E+00 ppm1 0.901 ppm2 3.549 OR { 3000} (segid " " and resid "36 " and name "HG23") (segid " " and resid "37 " and name "HD2 ") OR { 3000} (segid " " and resid "36 " and name "HG21") (segid " " and resid "37 " and name "HD2 ") ASSI { 3006} (segid " " and resid "36 " and name "HG22") (segid " " and resid "37 " and name "HG2 ") 6.000 6.000 0.000 peak 3006 weight 0.10000E+01 volume -0.25700E+00 ppm1 0.901 ppm2 2.047 OR { 3006} (segid " " and resid "36 " and name "HG23") (segid " " and resid "37 " and name "HG2 ") OR { 3006} (segid " " and resid "36 " and name "HG21") (segid " " and resid "37 " and name "HG2 ") OR { 3006} (segid " " and resid "36 " and name "HG22") (segid " " and resid "37 " and name "HG1 ") OR { 3006} (segid " " and resid "36 " and name "HG23") (segid " " and resid "37 " and name "HG1 ") OR { 3006} (segid " " and resid "36 " and name "HG21") (segid " " and resid "37 " and name "HG1 ") ASSI { 2996} (segid " " and resid "36 " and name "HG23") (segid " " and resid "40 " and name "HB2 ") 5.000 5.000 0.000 peak 2996 weight 0.10000E+01 volume -0.12330E+01 ppm1 0.901 ppm2 1.784 OR { 2996} (segid " " and resid "36 " and name "HG22") (segid " " and resid "40 " and name "HB2 ") OR { 2996} (segid " " and resid "36 " and name "HG21") (segid " " and resid "40 " and name "HB2 ") ASSI { 3004} (segid " " and resid "36 " and name "HG22") (segid " " and resid "40 " and name "HG2 ") 5.000 5.000 0.000 peak 3004 weight 0.10000E+01 volume -0.41500E+00 ppm1 0.901 ppm2 2.363 OR { 3004} (segid " " and resid "36 " and name "HG22") (segid " " and resid "40 " and name "HG1 ") OR { 3004} (segid " " and resid "36 " and name "HG23") (segid " " and resid "40 " and name "HG1 ") OR { 3004} (segid " " and resid "36 " and name "HG23") (segid " " and resid "40 " and name "HG2 ") OR { 3004} (segid " " and resid "36 " and name "HG21") (segid " " and resid "40 " and name "HG1 ") OR { 3004} (segid " " and resid "36 " and name "HG21") (segid " " and resid "40 " and name "HG2 ") ASSI { 5451} (segid " " and resid "36 " and name "HG21") (segid " " and resid "41 " and name "HA ") 5.000 5.000 0.000 peak 5451 weight 0.10000E+01 volume -0.81900E+00 ppm1 0.902 ppm2 4.091 OR { 5451} (segid " " and resid "36 " and name "HG23") (segid " " and resid "41 " and name "HA ") OR { 5451} (segid " " and resid "36 " and name "HG22") (segid " " and resid "41 " and name "HA ") ASSI { 2999} (segid " " and resid "36 " and name "HG23") (segid " " and resid "41 " and name "HG2 ") 5.000 5.000 0.000 peak 2999 weight 0.10000E+01 volume -0.81900E+00 ppm1 0.901 ppm2 1.599 OR { 2999} (segid " " and resid "36 " and name "HG21") (segid " " and resid "41 " and name "HG2 ") OR { 2999} (segid " " and resid "36 " and name "HG22") (segid " " and resid "41 " and name "HG2 ") ASSI { 3025} (segid " " and resid "37 " and name "HA ") (segid " " and resid "37 " and name "HB1 ") 5.000 5.000 0.000 peak 3025 weight 0.10000E+01 volume -0.67700E+00 ppm1 4.603 ppm2 2.416 ASSI { 3026} (segid " " and resid "37 " and name "HA ") (segid " " and resid "37 " and name "HB2 ") 5.000 5.000 0.000 peak 3026 weight 0.10000E+01 volume -0.47000E+00 ppm1 4.603 ppm2 1.942 ASSI { 3027} (segid " " and resid "37 " and name "HA ") (segid " " and resid "37 " and name "HG1 ") 5.000 5.000 0.000 peak 3027 weight 0.10000E+01 volume -0.35300E+00 ppm1 4.603 ppm2 2.047 OR { 3027} (segid " " and resid "37 " and name "HA ") (segid " " and resid "37 " and name "HG2 ") ASSI { 3035} (segid " " and resid "37 " and name "HB1 ") (segid " " and resid "37 " and name "HD1 ") 6.000 6.000 0.000 peak 3035 weight 0.10000E+01 volume -0.22600E+00 ppm1 2.403 ppm2 4.129 ASSI { 3039} (segid " " and resid "37 " and name "HB2 ") (segid " " and resid "37 " and name "HD2 ") 5.000 5.000 0.000 peak 3039 weight 0.10000E+01 volume -0.35800E+00 ppm1 1.955 ppm2 3.549 ASSI { 3031} (segid " " and resid "37 " and name "HB1 ") (segid " " and resid "37 " and name "HG1 ") 3.300 3.300 0.000 peak 3031 weight 0.10000E+01 volume -0.26540E+01 ppm1 2.403 ppm2 2.047 OR { 3031} (segid " " and resid "37 " and name "HB1 ") (segid " " and resid "37 " and name "HG2 ") ASSI { 3033} (segid " " and resid "37 " and name "HB1 ") (segid " " and resid "38 " and name "HD2 ") 5.000 5.000 0.000 peak 3033 weight 0.10000E+01 volume -0.89700E+00 ppm1 2.403 ppm2 3.734 OR { 3033} (segid " " and resid "37 " and name "HB1 ") (segid " " and resid "38 " and name "HD1 ") ASSI { 3038} (segid " " and resid "37 " and name "HB2 ") (segid " " and resid "38 " and name "HD2 ") 5.000 5.000 0.000 peak 3038 weight 0.10000E+01 volume -0.51800E+00 ppm1 1.955 ppm2 3.734 OR { 3038} (segid " " and resid "37 " and name "HB2 ") (segid " " and resid "38 " and name "HD1 ") ASSI { 3052} (segid " " and resid "37 " and name "HD1 ") (segid " " and resid "36 " and name "HB ") 6.000 6.000 0.000 peak 3052 weight 0.10000E+01 volume -0.10700E+00 ppm1 4.142 ppm2 1.468 ASSI { 3062} (segid " " and resid "37 " and name "HD2 ") (segid " " and resid "36 " and name "HB ") 6.000 6.000 0.000 peak 3062 weight 0.10000E+01 volume -0.11200E+00 ppm1 3.562 ppm2 1.468 ASSI { 3051} (segid " " and resid "37 " and name "HD1 ") (segid " " and resid "36 " and name "HG12") 6.000 6.000 0.000 peak 3051 weight 0.10000E+01 volume -0.96000E-01 ppm1 4.142 ppm2 1.125 ASSI { 3058} (segid " " and resid "37 " and name "HD2 ") (segid " " and resid "37 " and name "HB1 ") 5.000 5.000 0.000 peak 3058 weight 0.10000E+01 volume -0.46700E+00 ppm1 3.562 ppm2 2.390 ASSI { 3047} (segid " " and resid "37 " and name "HD1 ") (segid " " and resid "37 " and name "HB2 ") 5.000 5.000 0.000 peak 3047 weight 0.10000E+01 volume -0.33300E+00 ppm1 4.142 ppm2 1.942 ASSI { 3041} (segid " " and resid "37 " and name "HD1 ") (segid " " and resid "37 " and name "HD2 ") 2.700 2.700 0.000 peak 3041 weight 0.10000E+01 volume -0.40970E+01 ppm1 4.142 ppm2 3.549 ASSI { 3043} (segid " " and resid "37 " and name "HD1 ") (segid " " and resid "37 " and name "HG1 ") 5.000 5.000 0.000 peak 3043 weight 0.10000E+01 volume -0.15660E+01 ppm1 4.142 ppm2 2.047 OR { 3043} (segid " " and resid "37 " and name "HD1 ") (segid " " and resid "37 " and name "HG2 ") ASSI { 3054} (segid " " and resid "37 " and name "HD2 ") (segid " " and resid "37 " and name "HG2 ") 5.000 5.000 0.000 peak 3054 weight 0.10000E+01 volume -0.14170E+01 ppm1 3.562 ppm2 2.047 OR { 3054} (segid " " and resid "37 " and name "HD2 ") (segid " " and resid "37 " and name "HG1 ") ASSI { 3060} (segid " " and resid "37 " and name "HD2 ") (segid " " and resid "40 " and name "HB1 ") 6.000 6.000 0.000 peak 3060 weight 0.10000E+01 volume -0.25300E+00 ppm1 3.562 ppm2 2.469 ASSI { 3057} (segid " " and resid "37 " and name "HD2 ") (segid " " and resid "40 " and name "HB2 ") 5.000 5.000 0.000 peak 3057 weight 0.10000E+01 volume -0.39500E+00 ppm1 3.562 ppm2 1.784 ASSI { 5517} (segid " " and resid "38 " and name "HA ") (segid " " and resid "27 " and name "HA ") 6.000 6.000 0.000 peak 5517 weight 0.10000E+01 volume -0.16200E+00 ppm1 4.056 ppm2 4.371 ASSI { 3066} (segid " " and resid "38 " and name "HA ") (segid " " and resid "27 " and name "HD2 ") 5.000 5.000 0.000 peak 3066 weight 0.10000E+01 volume -0.17960E+01 ppm1 4.063 ppm2 1.626 OR { 3066} (segid " " and resid "38 " and name "HA ") (segid " " and resid "27 " and name "HD1 ") ASSI { 3082} (segid " " and resid "38 " and name "HA ") (segid " " and resid "36 " and name "HG23") 6.000 6.000 0.000 peak 3082 weight 0.10000E+01 volume -0.13800E+00 ppm1 4.063 ppm2 0.888 OR { 3082} (segid " " and resid "38 " and name "HA ") (segid " " and resid "36 " and name "HG21") OR { 3082} (segid " " and resid "38 " and name "HA ") (segid " " and resid "36 " and name "HG22") ASSI { 3073} (segid " " and resid "38 " and name "HA ") (segid " " and resid "38 " and name "HB1 ") 5.000 5.000 0.000 peak 3073 weight 0.10000E+01 volume -0.16190E+01 ppm1 4.063 ppm2 2.258 ASSI { 3074} (segid " " and resid "38 " and name "HA ") (segid " " and resid "38 " and name "HB2 ") 5.000 5.000 0.000 peak 3074 weight 0.10000E+01 volume -0.14540E+01 ppm1 4.063 ppm2 2.021 ASSI { 3079} (segid " " and resid "38 " and name "HA ") (segid " " and resid "38 " and name "HD1 ") 5.000 5.000 0.000 peak 3079 weight 0.10000E+01 volume -0.35800E+00 ppm1 4.063 ppm2 3.734 OR { 3079} (segid " " and resid "38 " and name "HA ") (segid " " and resid "38 " and name "HD2 ") ASSI { 3081} (segid " " and resid "38 " and name "HA ") (segid " " and resid "39 " and name "HA ") 6.000 6.000 0.000 peak 3081 weight 0.10000E+01 volume -0.16100E+00 ppm1 4.063 ppm2 4.392 ASSI { 3078} (segid " " and resid "38 " and name "HA ") (segid " " and resid "41 " and name "HB2 ") 5.000 5.000 0.000 peak 3078 weight 0.10000E+01 volume -0.59600E+00 ppm1 4.063 ppm2 1.942 ASSI { 3077} (segid " " and resid "38 " and name "HA ") (segid " " and resid "41 " and name "HG1 ") 5.000 5.000 0.000 peak 3077 weight 0.10000E+01 volume -0.67900E+00 ppm1 4.063 ppm2 2.495 ASSI { 5531} (segid " " and resid "38 " and name "HA ") (segid " " and resid "41 " and name "HG2 ") 5.000 5.000 0.000 peak 5531 weight 0.10000E+01 volume -0.15690E+01 ppm1 4.056 ppm2 1.592 ASSI { 3091} (segid " " and resid "38 " and name "HB2 ") (segid " " and resid "38 " and name "HD2 ") 5.000 5.000 0.000 peak 3091 weight 0.10000E+01 volume -0.46700E+00 ppm1 2.034 ppm2 3.734 OR { 3091} (segid " " and resid "38 " and name "HB2 ") (segid " " and resid "38 " and name "HD1 ") ASSI { 3106} (segid " " and resid "38 " and name "HD1 ") (segid " " and resid "31 " and name "HB1 ") 5.000 5.000 0.000 peak 3106 weight 0.10000E+01 volume -0.12110E+01 ppm1 3.721 ppm2 2.416 OR { 3106} (segid " " and resid "38 " and name "HD2 ") (segid " " and resid "31 " and name "HB1 ") ASSI { 3102} (segid " " and resid "38 " and name "HD2 ") (segid " " and resid "37 " and name "HA ") 3.300 3.300 0.000 peak 3102 weight 0.10000E+01 volume -0.33920E+01 ppm1 3.721 ppm2 4.603 OR { 3102} (segid " " and resid "38 " and name "HD1 ") (segid " " and resid "37 " and name "HA ") ASSI { 3105} (segid " " and resid "38 " and name "HD2 ") (segid " " and resid "38 " and name "HG2 ") 5.000 5.000 0.000 peak 3105 weight 0.10000E+01 volume -0.15180E+01 ppm1 3.721 ppm2 1.626 OR { 3105} (segid " " and resid "38 " and name "HD1 ") (segid " " and resid "38 " and name "HG2 ") ASSI { 3110} (segid " " and resid "39 " and name "HA ") (segid " " and resid "39 " and name "HB1 ") 3.300 3.300 0.000 peak 3110 weight 0.10000E+01 volume -0.28950E+01 ppm1 4.406 ppm2 2.759 ASSI { 3119} (segid " " and resid "39 " and name "HB2 ") (segid " " and resid "39 " and name "HB1 ") 2.700 2.700 0.000 peak 3119 weight 0.10000E+01 volume -0.72830E+01 ppm1 2.653 ppm2 2.759 ASSI { 3123} (segid " " and resid "40 " and name "HB1 ") (segid " " and resid "40 " and name "HG2 ") 3.300 3.300 0.000 peak 3123 weight 0.10000E+01 volume -0.22150E+01 ppm1 2.469 ppm2 2.363 OR { 3123} (segid " " and resid "40 " and name "HB1 ") (segid " " and resid "40 " and name "HG1 ") ASSI { 3142} (segid " " and resid "40 " and name "HG2 ") (segid " " and resid "37 " and name "HD1 ") 6.000 6.000 0.000 peak 3142 weight 0.10000E+01 volume -0.10900E+00 ppm1 2.363 ppm2 4.129 OR { 3142} (segid " " and resid "40 " and name "HG1 ") (segid " " and resid "37 " and name "HD1 ") ASSI { 3141} (segid " " and resid "40 " and name "HG1 ") (segid " " and resid "37 " and name "HD2 ") 6.000 6.000 0.000 peak 3141 weight 0.10000E+01 volume -0.21600E+00 ppm1 2.377 ppm2 3.549 OR { 3141} (segid " " and resid "40 " and name "HG2 ") (segid " " and resid "37 " and name "HD2 ") ASSI { 3139} (segid " " and resid "40 " and name "HG2 ") (segid " " and resid "37 " and name "HG2 ") 5.000 5.000 0.000 peak 3139 weight 0.10000E+01 volume -0.66100E+00 ppm1 2.377 ppm2 2.047 OR { 3139} (segid " " and resid "40 " and name "HG1 ") (segid " " and resid "37 " and name "HG2 ") OR { 3139} (segid " " and resid "40 " and name "HG1 ") (segid " " and resid "37 " and name "HG1 ") OR { 3139} (segid " " and resid "40 " and name "HG2 ") (segid " " and resid "37 " and name "HG1 ") ASSI { 3137} (segid " " and resid "40 " and name "HG1 ") (segid " " and resid "40 " and name "HB2 ") 3.300 3.300 0.000 peak 3137 weight 0.10000E+01 volume -0.20380E+01 ppm1 2.377 ppm2 1.784 OR { 3137} (segid " " and resid "40 " and name "HG2 ") (segid " " and resid "40 " and name "HB2 ") ASSI { 3147} (segid " " and resid "41 " and name "HA ") (segid " " and resid "41 " and name "HB2 ") 5.000 5.000 0.000 peak 3147 weight 0.10000E+01 volume -0.90600E+00 ppm1 4.089 ppm2 1.916 ASSI { 3146} (segid " " and resid "41 " and name "HA ") (segid " " and resid "41 " and name "HG1 ") 5.000 5.000 0.000 peak 3146 weight 0.10000E+01 volume -0.83100E+00 ppm1 4.089 ppm2 2.495 ASSI { 3145} (segid " " and resid "41 " and name "HA ") (segid " " and resid "41 " and name "HG2 ") 5.000 5.000 0.000 peak 3145 weight 0.10000E+01 volume -0.12400E+01 ppm1 4.089 ppm2 1.599 ASSI { 3151} (segid " " and resid "41 " and name "HB2 ") (segid " " and resid "69 " and name "HD11") 5.000 5.000 0.000 peak 3151 weight 0.10000E+01 volume -0.34200E+00 ppm1 1.942 ppm2 0.835 OR { 3151} (segid " " and resid "41 " and name "HB2 ") (segid " " and resid "69 " and name "HD13") OR { 3151} (segid " " and resid "41 " and name "HB2 ") (segid " " and resid "69 " and name "HD12") ASSI { 3175} (segid " " and resid "42 " and name "HB1 ") (segid " " and resid "42 " and name "HA ") 5.000 5.000 0.000 peak 3175 weight 0.10000E+01 volume -0.72300E+00 ppm1 1.705 ppm2 4.419 ASSI { 3183} (segid " " and resid "42 " and name "HB2 ") (segid " " and resid "42 " and name "HA ") 5.000 5.000 0.000 peak 3183 weight 0.10000E+01 volume -0.88200E+00 ppm1 1.520 ppm2 4.419 ASSI { 3173} (segid " " and resid "42 " and name "HB1 ") (segid " " and resid "42 " and name "HD2 ") 5.000 5.000 0.000 peak 3173 weight 0.10000E+01 volume -0.73900E+00 ppm1 1.705 ppm2 3.075 OR { 3173} (segid " " and resid "42 " and name "HB1 ") (segid " " and resid "42 " and name "HD1 ") ASSI { 3177} (segid " " and resid "42 " and name "HB1 ") (segid " " and resid "70 " and name "HG23") 5.000 5.000 0.000 peak 3177 weight 0.10000E+01 volume -0.40500E+00 ppm1 1.705 ppm2 0.809 OR { 3177} (segid " " and resid "42 " and name "HB1 ") (segid " " and resid "70 " and name "HG22") OR { 3177} (segid " " and resid "42 " and name "HB1 ") (segid " " and resid "70 " and name "HG21") ASSI { 3190} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "42 " and name "HA ") 5.000 5.000 0.000 peak 3190 weight 0.10000E+01 volume -0.63700E+00 ppm1 3.088 ppm2 4.419 OR { 3190} (segid " " and resid "42 " and name "HD1 ") (segid " " and resid "42 " and name "HA ") ASSI { 3196} (segid " " and resid "42 " and name "HD1 ") (segid " " and resid "49 " and name "HG2 ") 6.000 6.000 0.000 peak 3196 weight 0.10000E+01 volume -0.12800E+00 ppm1 3.075 ppm2 2.258 OR { 3196} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "49 " and name "HG1 ") OR { 3196} (segid " " and resid "42 " and name "HD1 ") (segid " " and resid "49 " and name "HG1 ") OR { 3196} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "49 " and name "HG2 ") ASSI { 3189} (segid " " and resid "42 " and name "HD1 ") (segid " " and resid "70 " and name "HG23") 5.000 5.000 0.000 peak 3189 weight 0.10000E+01 volume -0.61600E+00 ppm1 3.088 ppm2 0.809 OR { 3189} (segid " " and resid "42 " and name "HD1 ") (segid " " and resid "70 " and name "HG22") OR { 3189} (segid " " and resid "42 " and name "HD1 ") (segid " " and resid "70 " and name "HG21") OR { 3189} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "70 " and name "HG23") OR { 3189} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "70 " and name "HG22") OR { 3189} (segid " " and resid "42 " and name "HD2 ") (segid " " and resid "70 " and name "HG21") ASSI { 3198} (segid " " and resid "43 " and name "HA ") (segid " " and resid "43 " and name "HB1 ") 5.000 5.000 0.000 peak 3198 weight 0.10000E+01 volume -0.15000E+01 ppm1 5.354 ppm2 1.020 ASSI { 3200} (segid " " and resid "43 " and name "HA ") (segid " " and resid "43 " and name "HB2 ") 5.000 5.000 0.000 peak 3200 weight 0.10000E+01 volume -0.83500E+00 ppm1 5.354 ppm2 1.731 ASSI { 3201} (segid " " and resid "43 " and name "HA ") (segid " " and resid "43 " and name "HG ") 5.000 5.000 0.000 peak 3201 weight 0.10000E+01 volume -0.62100E+00 ppm1 5.354 ppm2 1.468 ASSI { 5617} (segid " " and resid "43 " and name "HA ") (segid " " and resid "67 " and name "HG22") 5.000 5.000 0.000 peak 5617 weight 0.10000E+01 volume -0.87600E+00 ppm1 5.341 ppm2 0.967 OR { 5617} (segid " " and resid "43 " and name "HA ") (segid " " and resid "67 " and name "HG23") OR { 5617} (segid " " and resid "43 " and name "HA ") (segid " " and resid "67 " and name "HG21") ASSI { 3199} (segid " " and resid "43 " and name "HA ") (segid " " and resid "69 " and name "HA ") 5.000 5.000 0.000 peak 3199 weight 0.10000E+01 volume -0.94300E+00 ppm1 5.354 ppm2 5.078 ASSI { 3204} (segid " " and resid "43 " and name "HB2 ") (segid " " and resid "43 " and name "HB1 ") 3.300 3.300 0.000 peak 3204 weight 0.10000E+01 volume -0.24150E+01 ppm1 1.744 ppm2 1.020 ASSI { 3213} (segid " " and resid "43 " and name "HB1 ") (segid " " and resid "43 " and name "HD12") 5.000 5.000 0.000 peak 3213 weight 0.10000E+01 volume -0.10430E+01 ppm1 1.033 ppm2 0.782 OR { 3213} (segid " " and resid "43 " and name "HB1 ") (segid " " and resid "43 " and name "HD11") OR { 3213} (segid " " and resid "43 " and name "HB1 ") (segid " " and resid "43 " and name "HD13") ASSI { 3206} (segid " " and resid "43 " and name "HB2 ") (segid " " and resid "43 " and name "HD12") 5.000 5.000 0.000 peak 3206 weight 0.10000E+01 volume -0.99800E+00 ppm1 1.744 ppm2 0.782 OR { 3206} (segid " " and resid "43 " and name "HB2 ") (segid " " and resid "43 " and name "HD11") OR { 3206} (segid " " and resid "43 " and name "HB2 ") (segid " " and resid "43 " and name "HD13") ASSI { 3216} (segid " " and resid "43 " and name "HB1 ") (segid " " and resid "43 " and name "HG ") 5.000 5.000 0.000 peak 3216 weight 0.10000E+01 volume -0.53100E+00 ppm1 1.033 ppm2 1.468 ASSI { 3217} (segid " " and resid "43 " and name "HB1 ") (segid " " and resid "50 " and name "HD11") 5.000 5.000 0.000 peak 3217 weight 0.10000E+01 volume -0.37700E+00 ppm1 1.033 ppm2 0.572 OR { 3217} (segid " " and resid "43 " and name "HB1 ") (segid " " and resid "50 " and name "HD12") OR { 3217} (segid " " and resid "43 " and name "HB1 ") (segid " " and resid "50 " and name "HD13") ASSI { 3208} (segid " " and resid "43 " and name "HB2 ") (segid " " and resid "50 " and name "HD11") 5.000 5.000 0.000 peak 3208 weight 0.10000E+01 volume -0.34200E+00 ppm1 1.744 ppm2 0.572 OR { 3208} (segid " " and resid "43 " and name "HB2 ") (segid " " and resid "50 " and name "HD12") OR { 3208} (segid " " and resid "43 " and name "HB2 ") (segid " " and resid "50 " and name "HD13") ASSI { 3212} (segid " " and resid "43 " and name "HB2 ") (segid " " and resid "50 " and name "HD22") 6.000 6.000 0.000 peak 3212 weight 0.10000E+01 volume -0.11300E+00 ppm1 1.757 ppm2 0.150 OR { 3212} (segid " " and resid "43 " and name "HB2 ") (segid " " and resid "50 " and name "HD21") OR { 3212} (segid " " and resid "43 " and name "HB2 ") (segid " " and resid "50 " and name "HD23") ASSI { 5624} (segid " " and resid "43 " and name "HB2 ") (segid " " and resid "50 " and name "HG ") 5.000 5.000 0.000 peak 5624 weight 0.10000E+01 volume -0.43000E+00 ppm1 1.736 ppm2 1.145 ASSI { 5639} (segid " " and resid "43 " and name "HD11") (segid " " and resid "26 " and name "HB1 ") 6.000 6.000 0.000 peak 5639 weight 0.10000E+01 volume -0.10500E+00 ppm1 0.787 ppm2 3.565 OR { 5639} (segid " " and resid "43 " and name "HD13") (segid " " and resid "26 " and name "HB1 ") OR { 5639} (segid " " and resid "43 " and name "HD12") (segid " " and resid "26 " and name "HB1 ") ASSI { 3231} (segid " " and resid "43 " and name "HD21") (segid " " and resid "30 " and name "HD11") 3.300 3.300 0.000 peak 3231 weight 0.10000E+01 volume -0.21620E+01 ppm1 0.756 ppm2 0.045 OR { 3231} (segid " " and resid "43 " and name "HD23") (segid " " and resid "30 " and name "HD12") OR { 3231} (segid " " and resid "43 " and name "HD21") (segid " " and resid "30 " and name "HD13") OR { 3231} (segid " " and resid "43 " and name "HD23") (segid " " and resid "30 " and name "HD13") OR { 3231} (segid " " and resid "43 " and name "HD22") (segid " " and resid "30 " and name "HD11") OR { 3231} (segid " " and resid "43 " and name "HD22") (segid " " and resid "30 " and name "HD12") OR { 3231} (segid " " and resid "43 " and name "HD21") (segid " " and resid "30 " and name "HD12") OR { 3231} (segid " " and resid "43 " and name "HD22") (segid " " and resid "30 " and name "HD13") OR { 3231} (segid " " and resid "43 " and name "HD23") (segid " " and resid "30 " and name "HD11") ASSI { 3240} (segid " " and resid "43 " and name "HD21") (segid " " and resid "30 " and name "HG21") 5.000 5.000 0.000 peak 3240 weight 0.10000E+01 volume -0.51000E+00 ppm1 0.756 ppm2 0.545 OR { 3240} (segid " " and resid "43 " and name "HD21") (segid " " and resid "30 " and name "HG22") OR { 3240} (segid " " and resid "43 " and name "HD22") (segid " " and resid "30 " and name "HG22") OR { 3240} (segid " " and resid "43 " and name "HD23") (segid " " and resid "30 " and name "HG22") OR { 3240} (segid " " and resid "43 " and name "HD23") (segid " " and resid "30 " and name "HG23") OR { 3240} (segid " " and resid "43 " and name "HD22") (segid " " and resid "30 " and name "HG21") OR { 3240} (segid " " and resid "43 " and name "HD22") (segid " " and resid "30 " and name "HG23") OR { 3240} (segid " " and resid "43 " and name "HD23") (segid " " and resid "30 " and name "HG21") OR { 3240} (segid " " and resid "43 " and name "HD21") (segid " " and resid "30 " and name "HG23") ASSI { 3245} (segid " " and resid "44 " and name "HA ") (segid " " and resid "44 " and name "HB ") 5.000 5.000 0.000 peak 3245 weight 0.10000E+01 volume -0.38300E+00 ppm1 4.919 ppm2 1.784 ASSI { 3244} (segid " " and resid "44 " and name "HA ") (segid " " and resid "44 " and name "HG12") 5.000 5.000 0.000 peak 3244 weight 0.10000E+01 volume -0.43200E+00 ppm1 4.919 ppm2 1.072 ASSI { 3251} (segid " " and resid "44 " and name "HB ") (segid " " and resid "44 " and name "HG12") 5.000 5.000 0.000 peak 3251 weight 0.10000E+01 volume -0.58200E+00 ppm1 1.784 ppm2 1.072 ASSI { 3248} (segid " " and resid "44 " and name "HB ") (segid " " and resid "44 " and name "HG21") 3.300 3.300 0.000 peak 3248 weight 0.10000E+01 volume -0.20390E+01 ppm1 1.784 ppm2 0.677 OR { 3248} (segid " " and resid "44 " and name "HB ") (segid " " and resid "44 " and name "HG23") OR { 3248} (segid " " and resid "44 " and name "HB ") (segid " " and resid "44 " and name "HG22") ASSI { 3278} (segid " " and resid "44 " and name "HD11") (segid " " and resid "68 " and name "HB1 ") 5.000 5.000 0.000 peak 3278 weight 0.10000E+01 volume -0.75200E+00 ppm1 0.664 ppm2 3.075 OR { 3278} (segid " " and resid "44 " and name "HD13") (segid " " and resid "68 " and name "HB1 ") OR { 3278} (segid " " and resid "44 " and name "HD11") (segid " " and resid "68 " and name "HB2 ") OR { 3278} (segid " " and resid "44 " and name "HD12") (segid " " and resid "68 " and name "HB2 ") OR { 3278} (segid " " and resid "44 " and name "HD13") (segid " " and resid "68 " and name "HB2 ") OR { 3278} (segid " " and resid "44 " and name "HD12") (segid " " and resid "68 " and name "HB1 ") ASSI { 3254} (segid " " and resid "44 " and name "HG12") (segid " " and resid "44 " and name "HG21") 5.000 5.000 0.000 peak 3254 weight 0.10000E+01 volume -0.13490E+01 ppm1 1.085 ppm2 0.677 OR { 3254} (segid " " and resid "44 " and name "HG12") (segid " " and resid "44 " and name "HG22") OR { 3254} (segid " " and resid "44 " and name "HG12") (segid " " and resid "44 " and name "HG23") ASSI { 3258} (segid " " and resid "44 " and name "HG12") (segid " " and resid "68 " and name "HB1 ") 6.000 6.000 0.000 peak 3258 weight 0.10000E+01 volume -0.12500E+00 ppm1 1.072 ppm2 3.101 OR { 3258} (segid " " and resid "44 " and name "HG12") (segid " " and resid "68 " and name "HB2 ") ASSI { 3259} (segid " " and resid "44 " and name "HG23") (segid " " and resid "44 " and name "HA ") 3.300 3.300 0.000 peak 3259 weight 0.10000E+01 volume -0.21370E+01 ppm1 0.690 ppm2 4.919 OR { 3259} (segid " " and resid "44 " and name "HG22") (segid " " and resid "44 " and name "HA ") OR { 3259} (segid " " and resid "44 " and name "HG21") (segid " " and resid "44 " and name "HA ") ASSI { 3268} (segid " " and resid "44 " and name "HG23") (segid " " and resid "45 " and name "HA ") 6.000 6.000 0.000 peak 3268 weight 0.10000E+01 volume -0.20500E+00 ppm1 0.690 ppm2 5.209 OR { 3268} (segid " " and resid "44 " and name "HG21") (segid " " and resid "45 " and name "HA ") OR { 3268} (segid " " and resid "44 " and name "HG22") (segid " " and resid "45 " and name "HA ") ASSI { 3267} (segid " " and resid "44 " and name "HG23") (segid " " and resid "47 " and name "HA1 ") 5.000 5.000 0.000 peak 3267 weight 0.10000E+01 volume -0.34100E+00 ppm1 0.690 ppm2 4.103 OR { 3267} (segid " " and resid "44 " and name "HG22") (segid " " and resid "47 " and name "HA1 ") OR { 3267} (segid " " and resid "44 " and name "HG21") (segid " " and resid "47 " and name "HA1 ") ASSI { 3264} (segid " " and resid "44 " and name "HG21") (segid " " and resid "47 " and name "HA2 ") 5.000 5.000 0.000 peak 3264 weight 0.10000E+01 volume -0.63000E+00 ppm1 0.690 ppm2 3.444 OR { 3264} (segid " " and resid "44 " and name "HG23") (segid " " and resid "47 " and name "HA2 ") OR { 3264} (segid " " and resid "44 " and name "HG22") (segid " " and resid "47 " and name "HA2 ") ASSI { 3266} (segid " " and resid "44 " and name "HG23") (segid " " and resid "68 " and name "HB2 ") 5.000 5.000 0.000 peak 3266 weight 0.10000E+01 volume -0.54300E+00 ppm1 0.690 ppm2 3.101 OR { 3266} (segid " " and resid "44 " and name "HG21") (segid " " and resid "68 " and name "HB2 ") OR { 3266} (segid " " and resid "44 " and name "HG22") (segid " " and resid "68 " and name "HB2 ") OR { 3266} (segid " " and resid "44 " and name "HG23") (segid " " and resid "68 " and name "HB1 ") OR { 3266} (segid " " and resid "44 " and name "HG21") (segid " " and resid "68 " and name "HB1 ") OR { 3266} (segid " " and resid "44 " and name "HG22") (segid " " and resid "68 " and name "HB1 ") ASSI { 3273} (segid " " and resid "44 " and name "HG21") (segid " " and resid "68 " and name "HD2 ") 6.000 6.000 0.000 peak 3273 weight 0.10000E+01 volume -0.84000E-01 ppm1 0.690 ppm2 7.054 OR { 3273} (segid " " and resid "44 " and name "HG22") (segid " " and resid "68 " and name "HD2 ") OR { 3273} (segid " " and resid "44 " and name "HG23") (segid " " and resid "68 " and name "HD2 ") ASSI { 3284} (segid " " and resid "45 " and name "HA ") (segid " " and resid "45 " and name "HB1 ") 5.000 5.000 0.000 peak 3284 weight 0.10000E+01 volume -0.13880E+01 ppm1 5.209 ppm2 2.943 ASSI { 3285} (segid " " and resid "45 " and name "HA ") (segid " " and resid "45 " and name "HB2 ") 5.000 5.000 0.000 peak 3285 weight 0.10000E+01 volume -0.96200E+00 ppm1 5.209 ppm2 2.811 ASSI { 3282} (segid " " and resid "45 " and name "HA ") (segid " " and resid "45 " and name "HD2 ") 5.000 5.000 0.000 peak 3282 weight 0.10000E+01 volume -0.16730E+01 ppm1 5.209 ppm2 7.449 OR { 3282} (segid " " and resid "45 " and name "HA ") (segid " " and resid "45 " and name "HD1 ") ASSI { 3289} (segid " " and resid "45 " and name "HA ") (segid " " and resid "45 " and name "HE2 ") 5.000 5.000 0.000 peak 3289 weight 0.10000E+01 volume -0.38400E+00 ppm1 5.209 ppm2 7.554 OR { 3289} (segid " " and resid "45 " and name "HA ") (segid " " and resid "45 " and name "HE1 ") ASSI { 3290} (segid " " and resid "45 " and name "HA ") (segid " " and resid "46 " and name "HB2 ") 6.000 6.000 0.000 peak 3290 weight 0.10000E+01 volume -0.12600E+00 ppm1 5.209 ppm2 0.809 OR { 3290} (segid " " and resid "45 " and name "HA ") (segid " " and resid "46 " and name "HB1 ") OR { 3290} (segid " " and resid "45 " and name "HA ") (segid " " and resid "46 " and name "HB3 ") ASSI { 3294} (segid " " and resid "45 " and name "HA ") (segid " " and resid "50 " and name "HD12") 6.000 6.000 0.000 peak 3294 weight 0.10000E+01 volume -0.11300E+00 ppm1 5.209 ppm2 0.572 OR { 3294} (segid " " and resid "45 " and name "HA ") (segid " " and resid "50 " and name "HD13") OR { 3294} (segid " " and resid "45 " and name "HA ") (segid " " and resid "50 " and name "HD11") ASSI { 3293} (segid " " and resid "45 " and name "HA ") (segid " " and resid "50 " and name "HD21") 6.000 6.000 0.000 peak 3293 weight 0.10000E+01 volume -0.88000E-01 ppm1 5.209 ppm2 0.150 OR { 3293} (segid " " and resid "45 " and name "HA ") (segid " " and resid "50 " and name "HD23") OR { 3293} (segid " " and resid "45 " and name "HA ") (segid " " and resid "50 " and name "HD22") ASSI { 3291} (segid " " and resid "45 " and name "HA ") (segid " " and resid "67 " and name "HG11") 6.000 6.000 0.000 peak 3291 weight 0.10000E+01 volume -0.12000E+00 ppm1 5.196 ppm2 1.494 ASSI { 3295} (segid " " and resid "45 " and name "HA ") (segid " " and resid "67 " and name "HG12") 6.000 6.000 0.000 peak 3295 weight 0.10000E+01 volume -0.10700E+00 ppm1 5.209 ppm2 1.178 ASSI { 3288} (segid " " and resid "45 " and name "HA ") (segid " " and resid "67 " and name "HG21") 6.000 6.000 0.000 peak 3288 weight 0.10000E+01 volume -0.28600E+00 ppm1 5.209 ppm2 0.967 OR { 3288} (segid " " and resid "45 " and name "HA ") (segid " " and resid "67 " and name "HG23") OR { 3288} (segid " " and resid "45 " and name "HA ") (segid " " and resid "67 " and name "HG22") ASSI { 3297} (segid " " and resid "45 " and name "HB1 ") (segid " " and resid "45 " and name "HD1 ") 5.000 5.000 0.000 peak 3297 weight 0.10000E+01 volume -0.77500E+00 ppm1 2.956 ppm2 7.449 OR { 3297} (segid " " and resid "45 " and name "HB1 ") (segid " " and resid "45 " and name "HD2 ") ASSI { 3308} (segid " " and resid "45 " and name "HB2 ") (segid " " and resid "45 " and name "HD1 ") 5.000 5.000 0.000 peak 3308 weight 0.10000E+01 volume -0.85300E+00 ppm1 2.811 ppm2 7.449 OR { 3308} (segid " " and resid "45 " and name "HB2 ") (segid " " and resid "45 " and name "HD2 ") ASSI { 3306} (segid " " and resid "45 " and name "HB1 ") (segid " " and resid "45 " and name "HE1 ") 6.000 6.000 0.000 peak 3306 weight 0.10000E+01 volume -0.17800E+00 ppm1 2.956 ppm2 7.554 OR { 3306} (segid " " and resid "45 " and name "HB1 ") (segid " " and resid "45 " and name "HE2 ") ASSI { 5721} (segid " " and resid "45 " and name "HB2 ") (segid " " and resid "45 " and name "HE1 ") 5.000 5.000 0.000 peak 5721 weight 0.10000E+01 volume -0.30000E+00 ppm1 2.807 ppm2 7.546 OR { 5721} (segid " " and resid "45 " and name "HB2 ") (segid " " and resid "45 " and name "HE2 ") ASSI { 3299} (segid " " and resid "45 " and name "HB1 ") (segid " " and resid "50 " and name "HD12") 5.000 5.000 0.000 peak 3299 weight 0.10000E+01 volume -0.38000E+00 ppm1 2.943 ppm2 0.572 OR { 3299} (segid " " and resid "45 " and name "HB1 ") (segid " " and resid "50 " and name "HD13") OR { 3299} (segid " " and resid "45 " and name "HB1 ") (segid " " and resid "50 " and name "HD11") ASSI { 3311} (segid " " and resid "45 " and name "HB2 ") (segid " " and resid "50 " and name "HD13") 5.000 5.000 0.000 peak 3311 weight 0.10000E+01 volume -0.30300E+00 ppm1 2.798 ppm2 0.572 OR { 3311} (segid " " and resid "45 " and name "HB2 ") (segid " " and resid "50 " and name "HD12") OR { 3311} (segid " " and resid "45 " and name "HB2 ") (segid " " and resid "50 " and name "HD11") ASSI { 3298} (segid " " and resid "45 " and name "HB1 ") (segid " " and resid "50 " and name "HD22") 5.000 5.000 0.000 peak 3298 weight 0.10000E+01 volume -0.36500E+00 ppm1 2.943 ppm2 0.150 OR { 3298} (segid " " and resid "45 " and name "HB1 ") (segid " " and resid "50 " and name "HD23") OR { 3298} (segid " " and resid "45 " and name "HB1 ") (segid " " and resid "50 " and name "HD21") ASSI { 3309} (segid " " and resid "45 " and name "HB2 ") (segid " " and resid "50 " and name "HD21") 5.000 5.000 0.000 peak 3309 weight 0.10000E+01 volume -0.44900E+00 ppm1 2.798 ppm2 0.150 OR { 3309} (segid " " and resid "45 " and name "HB2 ") (segid " " and resid "50 " and name "HD22") OR { 3309} (segid " " and resid "45 " and name "HB2 ") (segid " " and resid "50 " and name "HD23") ASSI { 3303} (segid " " and resid "45 " and name "HB1 ") (segid " " and resid "67 " and name "HD11") 6.000 6.000 0.000 peak 3303 weight 0.10000E+01 volume -0.19000E+00 ppm1 2.943 ppm2 0.703 OR { 3303} (segid " " and resid "45 " and name "HB1 ") (segid " " and resid "67 " and name "HD13") OR { 3303} (segid " " and resid "45 " and name "HB1 ") (segid " " and resid "67 " and name "HD12") ASSI { 3316} (segid " " and resid "45 " and name "HB2 ") (segid " " and resid "67 " and name "HG11") 6.000 6.000 0.000 peak 3316 weight 0.10000E+01 volume -0.83000E-01 ppm1 2.798 ppm2 1.494 ASSI { 3314} (segid " " and resid "45 " and name "HB2 ") (segid " " and resid "67 " and name "HG12") 6.000 6.000 0.000 peak 3314 weight 0.10000E+01 volume -0.14900E+00 ppm1 2.798 ppm2 1.178 ASSI { 3329} (segid " " and resid "45 " and name "HD1 ") (segid " " and resid "61 " and name "HD12") 6.000 6.000 0.000 peak 3329 weight 0.10000E+01 volume -0.12000E+00 ppm1 7.449 ppm2 0.387 OR { 3329} (segid " " and resid "45 " and name "HD2 ") (segid " " and resid "61 " and name "HD13") OR { 3329} (segid " " and resid "45 " and name "HD1 ") (segid " " and resid "61 " and name "HD11") OR { 3329} (segid " " and resid "45 " and name "HD2 ") (segid " " and resid "61 " and name "HD12") OR { 3329} (segid " " and resid "45 " and name "HD1 ") (segid " " and resid "61 " and name "HD13") OR { 3329} (segid " " and resid "45 " and name "HD2 ") (segid " " and resid "61 " and name "HD11") ASSI { 3327} (segid " " and resid "45 " and name "HD1 ") (segid " " and resid "67 " and name "HG11") 6.000 6.000 0.000 peak 3327 weight 0.10000E+01 volume -0.11100E+00 ppm1 7.449 ppm2 1.494 OR { 3327} (segid " " and resid "45 " and name "HD2 ") (segid " " and resid "67 " and name "HG11") ASSI { 3313} (segid " " and resid "45 " and name "HZ ") (segid " " and resid "45 " and name "HE1 ") 3.300 3.300 0.000 peak 3313 weight 0.10000E+01 volume -0.30110E+01 ppm1 7.436 ppm2 7.554 OR { 3313} (segid " " and resid "45 " and name "HZ ") (segid " " and resid "45 " and name "HE2 ") ASSI { 3317} (segid " " and resid "45 " and name "HZ ") (segid " " and resid "61 " and name "HA ") 5.000 5.000 0.000 peak 3317 weight 0.10000E+01 volume -0.30100E+00 ppm1 7.436 ppm2 3.180 ASSI { 3337} (segid " " and resid "46 " and name "HA ") (segid " " and resid "46 " and name "HB3 ") 3.300 3.300 0.000 peak 3337 weight 0.10000E+01 volume -0.36170E+01 ppm1 3.707 ppm2 0.809 OR { 3337} (segid " " and resid "46 " and name "HA ") (segid " " and resid "46 " and name "HB2 ") OR { 3337} (segid " " and resid "46 " and name "HA ") (segid " " and resid "46 " and name "HB1 ") ASSI { 3343} (segid " " and resid "46 " and name "HB1 ") (segid " " and resid "45 " and name "HD2 ") 5.000 5.000 0.000 peak 3343 weight 0.10000E+01 volume -0.50900E+00 ppm1 0.809 ppm2 7.449 OR { 3343} (segid " " and resid "46 " and name "HB2 ") (segid " " and resid "45 " and name "HD2 ") OR { 3343} (segid " " and resid "46 " and name "HB2 ") (segid " " and resid "45 " and name "HD1 ") OR { 3343} (segid " " and resid "46 " and name "HB1 ") (segid " " and resid "45 " and name "HD1 ") OR { 3343} (segid " " and resid "46 " and name "HB3 ") (segid " " and resid "45 " and name "HD2 ") OR { 3343} (segid " " and resid "46 " and name "HB3 ") (segid " " and resid "45 " and name "HD1 ") ASSI { 3344} (segid " " and resid "46 " and name "HB1 ") (segid " " and resid "45 " and name "HE2 ") 5.000 5.000 0.000 peak 3344 weight 0.10000E+01 volume -0.34300E+00 ppm1 0.809 ppm2 7.528 OR { 3344} (segid " " and resid "46 " and name "HB2 ") (segid " " and resid "45 " and name "HE2 ") OR { 3344} (segid " " and resid "46 " and name "HB1 ") (segid " " and resid "45 " and name "HE1 ") OR { 3344} (segid " " and resid "46 " and name "HB2 ") (segid " " and resid "45 " and name "HE1 ") OR { 3344} (segid " " and resid "46 " and name "HB3 ") (segid " " and resid "45 " and name "HE1 ") OR { 3344} (segid " " and resid "46 " and name "HB3 ") (segid " " and resid "45 " and name "HE2 ") ASSI { 5745} (segid " " and resid "46 " and name "HB2 ") (segid " " and resid "45 " and name "HZ ") 5.000 5.000 0.000 peak 5745 weight 0.10000E+01 volume -0.54500E+00 ppm1 0.806 ppm2 7.434 OR { 5745} (segid " " and resid "46 " and name "HB1 ") (segid " " and resid "45 " and name "HZ ") OR { 5745} (segid " " and resid "46 " and name "HB3 ") (segid " " and resid "45 " and name "HZ ") ASSI { 3228} (segid " " and resid "49 " and name "HA ") (segid " " and resid "44 " and name "HG21") 5.000 5.000 0.000 peak 3228 weight 0.10000E+01 volume -0.80600E+00 ppm1 4.906 ppm2 0.677 OR { 3228} (segid " " and resid "49 " and name "HA ") (segid " " and resid "44 " and name "HG22") OR { 3228} (segid " " and resid "49 " and name "HA ") (segid " " and resid "44 " and name "HG23") ASSI { 3385} (segid " " and resid "49 " and name "HG1 ") (segid " " and resid "44 " and name "HG12") 6.000 6.000 0.000 peak 3385 weight 0.10000E+01 volume -0.15900E+00 ppm1 2.258 ppm2 1.072 OR { 3385} (segid " " and resid "49 " and name "HG2 ") (segid " " and resid "44 " and name "HG12") ASSI { 3394} (segid " " and resid "50 " and name "HA ") (segid " " and resid "23 " and name "HG21") 5.000 5.000 0.000 peak 3394 weight 0.10000E+01 volume -0.37500E+00 ppm1 3.826 ppm2 1.046 OR { 3394} (segid " " and resid "50 " and name "HA ") (segid " " and resid "23 " and name "HG23") OR { 3394} (segid " " and resid "50 " and name "HA ") (segid " " and resid "23 " and name "HG22") ASSI { 3389} (segid " " and resid "50 " and name "HA ") (segid " " and resid "50 " and name "HB1 ") 5.000 5.000 0.000 peak 3389 weight 0.10000E+01 volume -0.14410E+01 ppm1 3.826 ppm2 1.230 ASSI { 3391} (segid " " and resid "50 " and name "HA ") (segid " " and resid "50 " and name "HB2 ") 5.000 5.000 0.000 peak 3391 weight 0.10000E+01 volume -0.84000E+00 ppm1 3.826 ppm2 1.520 ASSI { 3393} (segid " " and resid "50 " and name "HA ") (segid " " and resid "50 " and name "HD13") 5.000 5.000 0.000 peak 3393 weight 0.10000E+01 volume -0.38800E+00 ppm1 3.826 ppm2 0.572 OR { 3393} (segid " " and resid "50 " and name "HA ") (segid " " and resid "50 " and name "HD12") OR { 3393} (segid " " and resid "50 " and name "HA ") (segid " " and resid "50 " and name "HD11") ASSI { 3388} (segid " " and resid "50 " and name "HA ") (segid " " and resid "50 " and name "HD23") 5.000 5.000 0.000 peak 3388 weight 0.10000E+01 volume -0.16100E+01 ppm1 3.826 ppm2 0.150 OR { 3388} (segid " " and resid "50 " and name "HA ") (segid " " and resid "50 " and name "HD22") OR { 3388} (segid " " and resid "50 " and name "HA ") (segid " " and resid "50 " and name "HD21") ASSI { 5776} (segid " " and resid "50 " and name "HA ") (segid " " and resid "50 " and name "HG ") 5.000 5.000 0.000 peak 5776 weight 0.10000E+01 volume -0.95700E+00 ppm1 3.828 ppm2 1.145 ASSI { 3398} (segid " " and resid "50 " and name "HA ") (segid " " and resid "59 " and name "HD2 ") 6.000 6.000 0.000 peak 3398 weight 0.10000E+01 volume -0.10400E+00 ppm1 3.826 ppm2 7.265 OR { 3398} (segid " " and resid "50 " and name "HA ") (segid " " and resid "59 " and name "HD1 ") ASSI { 3392} (segid " " and resid "50 " and name "HA ") (segid " " and resid "59 " and name "HE1 ") 5.000 5.000 0.000 peak 3392 weight 0.10000E+01 volume -0.53400E+00 ppm1 3.826 ppm2 6.869 OR { 3392} (segid " " and resid "50 " and name "HA ") (segid " " and resid "59 " and name "HE2 ") ASSI { 3400} (segid " " and resid "50 " and name "HB1 ") (segid " " and resid "23 " and name "HG22") 5.000 5.000 0.000 peak 3400 weight 0.10000E+01 volume -0.87200E+00 ppm1 1.230 ppm2 1.046 OR { 3400} (segid " " and resid "50 " and name "HB1 ") (segid " " and resid "23 " and name "HG21") OR { 3400} (segid " " and resid "50 " and name "HB1 ") (segid " " and resid "23 " and name "HG23") ASSI { 3402} (segid " " and resid "50 " and name "HB2 ") (segid " " and resid "50 " and name "HB1 ") 3.300 3.300 0.000 peak 3402 weight 0.10000E+01 volume -0.24510E+01 ppm1 1.533 ppm2 1.230 ASSI { 3410} (segid " " and resid "50 " and name "HB1 ") (segid " " and resid "50 " and name "HD13") 5.000 5.000 0.000 peak 3410 weight 0.10000E+01 volume -0.54700E+00 ppm1 1.230 ppm2 0.572 OR { 3410} (segid " " and resid "50 " and name "HB1 ") (segid " " and resid "50 " and name "HD12") OR { 3410} (segid " " and resid "50 " and name "HB1 ") (segid " " and resid "50 " and name "HD11") ASSI { 3403} (segid " " and resid "50 " and name "HB2 ") (segid " " and resid "50 " and name "HD11") 5.000 5.000 0.000 peak 3403 weight 0.10000E+01 volume -0.54700E+00 ppm1 1.533 ppm2 0.572 OR { 3403} (segid " " and resid "50 " and name "HB2 ") (segid " " and resid "50 " and name "HD12") OR { 3403} (segid " " and resid "50 " and name "HB2 ") (segid " " and resid "50 " and name "HD13") ASSI { 3411} (segid " " and resid "50 " and name "HB1 ") (segid " " and resid "50 " and name "HD21") 5.000 5.000 0.000 peak 3411 weight 0.10000E+01 volume -0.43200E+00 ppm1 1.230 ppm2 0.150 OR { 3411} (segid " " and resid "50 " and name "HB1 ") (segid " " and resid "50 " and name "HD22") OR { 3411} (segid " " and resid "50 " and name "HB1 ") (segid " " and resid "50 " and name "HD23") ASSI { 3407} (segid " " and resid "50 " and name "HB2 ") (segid " " and resid "50 " and name "HD23") 5.000 5.000 0.000 peak 3407 weight 0.10000E+01 volume -0.31000E+00 ppm1 1.533 ppm2 0.150 OR { 3407} (segid " " and resid "50 " and name "HB2 ") (segid " " and resid "50 " and name "HD21") OR { 3407} (segid " " and resid "50 " and name "HB2 ") (segid " " and resid "50 " and name "HD22") ASSI { 5782} (segid " " and resid "50 " and name "HB1 ") (segid " " and resid "59 " and name "HE1 ") 6.000 6.000 0.000 peak 5782 weight 0.10000E+01 volume -0.10200E+00 ppm1 1.228 ppm2 6.859 OR { 5782} (segid " " and resid "50 " and name "HB1 ") (segid " " and resid "59 " and name "HE2 ") ASSI { 3432} (segid " " and resid "50 " and name "HD12") (segid " " and resid "44 " and name "HA ") 6.000 6.000 0.000 peak 3432 weight 0.10000E+01 volume -0.24700E+00 ppm1 0.572 ppm2 4.919 OR { 3432} (segid " " and resid "50 " and name "HD11") (segid " " and resid "44 " and name "HA ") OR { 3432} (segid " " and resid "50 " and name "HD13") (segid " " and resid "44 " and name "HA ") ASSI { 2365} (segid " " and resid "50 " and name "HD11") (segid " " and resid "45 " and name "HD1 ") 6.000 6.000 0.000 peak 2365 weight 0.10000E+01 volume -0.82000E-01 ppm1 0.569 ppm2 7.441 OR { 2365} (segid " " and resid "50 " and name "HD12") (segid " " and resid "45 " and name "HD2 ") OR { 2365} (segid " " and resid "50 " and name "HD12") (segid " " and resid "45 " and name "HD1 ") OR { 2365} (segid " " and resid "50 " and name "HD13") (segid " " and resid "45 " and name "HD2 ") OR { 2365} (segid " " and resid "50 " and name "HD11") (segid " " and resid "45 " and name "HD2 ") OR { 2365} (segid " " and resid "50 " and name "HD13") (segid " " and resid "45 " and name "HD1 ") ASSI { 3414} (segid " " and resid "50 " and name "HD13") (segid " " and resid "50 " and name "HD22") 3.300 3.300 0.000 peak 3414 weight 0.10000E+01 volume -0.26680E+01 ppm1 0.572 ppm2 0.150 OR { 3414} (segid " " and resid "50 " and name "HD12") (segid " " and resid "50 " and name "HD21") OR { 3414} (segid " " and resid "50 " and name "HD11") (segid " " and resid "50 " and name "HD22") OR { 3414} (segid " " and resid "50 " and name "HD12") (segid " " and resid "50 " and name "HD22") OR { 3414} (segid " " and resid "50 " and name "HD11") (segid " " and resid "50 " and name "HD21") OR { 3414} (segid " " and resid "50 " and name "HD13") (segid " " and resid "50 " and name "HD23") OR { 3414} (segid " " and resid "50 " and name "HD11") (segid " " and resid "50 " and name "HD23") OR { 3414} (segid " " and resid "50 " and name "HD12") (segid " " and resid "50 " and name "HD23") OR { 3414} (segid " " and resid "50 " and name "HD13") (segid " " and resid "50 " and name "HD21") ASSI { 3428} (segid " " and resid "50 " and name "HD12") (segid " " and resid "56 " and name "HD21") 5.000 5.000 0.000 peak 3428 weight 0.10000E+01 volume -0.55000E+00 ppm1 0.572 ppm2 0.308 OR { 3428} (segid " " and resid "50 " and name "HD13") (segid " " and resid "56 " and name "HD22") OR { 3428} (segid " " and resid "50 " and name "HD12") (segid " " and resid "56 " and name "HD23") OR { 3428} (segid " " and resid "50 " and name "HD12") (segid " " and resid "56 " and name "HD22") OR { 3428} (segid " " and resid "50 " and name "HD11") (segid " " and resid "56 " and name "HD22") OR { 3428} (segid " " and resid "50 " and name "HD11") (segid " " and resid "56 " and name "HD21") OR { 3428} (segid " " and resid "50 " and name "HD13") (segid " " and resid "56 " and name "HD23") OR { 3428} (segid " " and resid "50 " and name "HD13") (segid " " and resid "56 " and name "HD21") OR { 3428} (segid " " and resid "50 " and name "HD11") (segid " " and resid "56 " and name "HD23") ASSI { 3433} (segid " " and resid "50 " and name "HD12") (segid " " and resid "59 " and name "HE1 ") 5.000 5.000 0.000 peak 3433 weight 0.10000E+01 volume -0.34200E+00 ppm1 0.572 ppm2 6.869 OR { 3433} (segid " " and resid "50 " and name "HD13") (segid " " and resid "59 " and name "HE2 ") OR { 3433} (segid " " and resid "50 " and name "HD12") (segid " " and resid "59 " and name "HE2 ") OR { 3433} (segid " " and resid "50 " and name "HD13") (segid " " and resid "59 " and name "HE1 ") OR { 3433} (segid " " and resid "50 " and name "HD11") (segid " " and resid "59 " and name "HE2 ") OR { 3433} (segid " " and resid "50 " and name "HD11") (segid " " and resid "59 " and name "HE1 ") ASSI { 5815} (segid " " and resid "50 " and name "HD11") (segid " " and resid "67 " and name "HG11") 5.000 5.000 0.000 peak 5815 weight 0.10000E+01 volume -0.92900E+00 ppm1 0.570 ppm2 1.474 OR { 5815} (segid " " and resid "50 " and name "HD12") (segid " " and resid "67 " and name "HG11") OR { 5815} (segid " " and resid "50 " and name "HD13") (segid " " and resid "67 " and name "HG11") ASSI { 3440} (segid " " and resid "50 " and name "HD21") (segid " " and resid "43 " and name "HB1 ") 5.000 5.000 0.000 peak 3440 weight 0.10000E+01 volume -0.91000E+00 ppm1 0.150 ppm2 1.046 OR { 3440} (segid " " and resid "50 " and name "HD22") (segid " " and resid "43 " and name "HB1 ") OR { 3440} (segid " " and resid "50 " and name "HD23") (segid " " and resid "43 " and name "HB1 ") ASSI { 3441} (segid " " and resid "50 " and name "HD21") (segid " " and resid "43 " and name "HD13") 5.000 5.000 0.000 peak 3441 weight 0.10000E+01 volume -0.58000E+00 ppm1 0.150 ppm2 0.809 OR { 3441} (segid " " and resid "50 " and name "HD23") (segid " " and resid "43 " and name "HD11") OR { 3441} (segid " " and resid "50 " and name "HD22") (segid " " and resid "43 " and name "HD13") OR { 3441} (segid " " and resid "50 " and name "HD23") (segid " " and resid "43 " and name "HD13") OR { 3441} (segid " " and resid "50 " and name "HD21") (segid " " and resid "43 " and name "HD11") OR { 3441} (segid " " and resid "50 " and name "HD23") (segid " " and resid "43 " and name "HD12") OR { 3441} (segid " " and resid "50 " and name "HD21") (segid " " and resid "43 " and name "HD12") OR { 3441} (segid " " and resid "50 " and name "HD22") (segid " " and resid "43 " and name "HD12") OR { 3441} (segid " " and resid "50 " and name "HD22") (segid " " and resid "43 " and name "HD11") ASSI { 3452} (segid " " and resid "50 " and name "HD23") (segid " " and resid "44 " and name "HA ") 6.000 6.000 0.000 peak 3452 weight 0.10000E+01 volume -0.13400E+00 ppm1 0.150 ppm2 4.919 OR { 3452} (segid " " and resid "50 " and name "HD21") (segid " " and resid "44 " and name "HA ") OR { 3452} (segid " " and resid "50 " and name "HD22") (segid " " and resid "44 " and name "HA ") ASSI { 3453} (segid " " and resid "50 " and name "HD22") (segid " " and resid "45 " and name "HD1 ") 6.000 6.000 0.000 peak 3453 weight 0.10000E+01 volume -0.18200E+00 ppm1 0.150 ppm2 7.449 OR { 3453} (segid " " and resid "50 " and name "HD21") (segid " " and resid "45 " and name "HD2 ") OR { 3453} (segid " " and resid "50 " and name "HD21") (segid " " and resid "45 " and name "HD1 ") OR { 3453} (segid " " and resid "50 " and name "HD22") (segid " " and resid "45 " and name "HD2 ") OR { 3453} (segid " " and resid "50 " and name "HD23") (segid " " and resid "45 " and name "HD1 ") OR { 3453} (segid " " and resid "50 " and name "HD23") (segid " " and resid "45 " and name "HD2 ") ASSI { 3422} (segid " " and resid "50 " and name "HD22") (segid " " and resid "50 " and name "HG ") 5.000 5.000 0.000 peak 3422 weight 0.10000E+01 volume -0.19830E+01 ppm1 0.150 ppm2 1.151 OR { 3422} (segid " " and resid "50 " and name "HD23") (segid " " and resid "50 " and name "HG ") OR { 3422} (segid " " and resid "50 " and name "HD21") (segid " " and resid "50 " and name "HG ") ASSI { 3451} (segid " " and resid "50 " and name "HD21") (segid " " and resid "59 " and name "HB1 ") 6.000 6.000 0.000 peak 3451 weight 0.10000E+01 volume -0.17900E+00 ppm1 0.150 ppm2 3.497 OR { 3451} (segid " " and resid "50 " and name "HD22") (segid " " and resid "59 " and name "HB1 ") OR { 3451} (segid " " and resid "50 " and name "HD23") (segid " " and resid "59 " and name "HB1 ") ASSI { 3445} (segid " " and resid "50 " and name "HD21") (segid " " and resid "59 " and name "HD1 ") 5.000 5.000 0.000 peak 3445 weight 0.10000E+01 volume -0.42700E+00 ppm1 0.150 ppm2 7.265 OR { 3445} (segid " " and resid "50 " and name "HD22") (segid " " and resid "59 " and name "HD1 ") OR { 3445} (segid " " and resid "50 " and name "HD21") (segid " " and resid "59 " and name "HD2 ") OR { 3445} (segid " " and resid "50 " and name "HD22") (segid " " and resid "59 " and name "HD2 ") OR { 3445} (segid " " and resid "50 " and name "HD23") (segid " " and resid "59 " and name "HD1 ") OR { 3445} (segid " " and resid "50 " and name "HD23") (segid " " and resid "59 " and name "HD2 ") ASSI { 3438} (segid " " and resid "50 " and name "HD22") (segid " " and resid "61 " and name "HD12") 5.000 5.000 0.000 peak 3438 weight 0.10000E+01 volume -0.11560E+01 ppm1 0.150 ppm2 0.387 OR { 3438} (segid " " and resid "50 " and name "HD22") (segid " " and resid "61 " and name "HD13") OR { 3438} (segid " " and resid "50 " and name "HD21") (segid " " and resid "61 " and name "HD11") OR { 3438} (segid " " and resid "50 " and name "HD23") (segid " " and resid "61 " and name "HD11") OR { 3438} (segid " " and resid "50 " and name "HD22") (segid " " and resid "61 " and name "HD11") OR { 3438} (segid " " and resid "50 " and name "HD21") (segid " " and resid "61 " and name "HD12") OR { 3438} (segid " " and resid "50 " and name "HD21") (segid " " and resid "61 " and name "HD13") OR { 3438} (segid " " and resid "50 " and name "HD23") (segid " " and resid "61 " and name "HD13") OR { 3438} (segid " " and resid "50 " and name "HD23") (segid " " and resid "61 " and name "HD12") ASSI { 3448} (segid " " and resid "50 " and name "HD21") (segid " " and resid "67 " and name "HD11") 6.000 6.000 0.000 peak 3448 weight 0.10000E+01 volume -0.27600E+00 ppm1 0.150 ppm2 0.703 OR { 3448} (segid " " and resid "50 " and name "HD22") (segid " " and resid "67 " and name "HD13") OR { 3448} (segid " " and resid "50 " and name "HD21") (segid " " and resid "67 " and name "HD12") OR { 3448} (segid " " and resid "50 " and name "HD22") (segid " " and resid "67 " and name "HD11") OR { 3448} (segid " " and resid "50 " and name "HD21") (segid " " and resid "67 " and name "HD13") OR { 3448} (segid " " and resid "50 " and name "HD23") (segid " " and resid "67 " and name "HD11") OR { 3448} (segid " " and resid "50 " and name "HD23") (segid " " and resid "67 " and name "HD13") OR { 3448} (segid " " and resid "50 " and name "HD23") (segid " " and resid "67 " and name "HD12") OR { 3448} (segid " " and resid "50 " and name "HD22") (segid " " and resid "67 " and name "HD12") ASSI { 3419} (segid " " and resid "50 " and name "HG ") (segid " " and resid "50 " and name "HB2 ") 5.000 5.000 0.000 peak 3419 weight 0.10000E+01 volume -0.75600E+00 ppm1 1.151 ppm2 1.520 ASSI { 3461} (segid " " and resid "51 " and name "HA ") (segid " " and resid "51 " and name "HG1 ") 5.000 5.000 0.000 peak 3461 weight 0.10000E+01 volume -0.34200E+00 ppm1 4.590 ppm2 2.443 ASSI { 3458} (segid " " and resid "51 " and name "HA ") (segid " " and resid "51 " and name "HG2 ") 5.000 5.000 0.000 peak 3458 weight 0.10000E+01 volume -0.58900E+00 ppm1 4.590 ppm2 2.311 ASSI { 3475} (segid " " and resid "51 " and name "HG2 ") (segid " " and resid "51 " and name "HG1 ") 2.700 2.700 0.000 peak 3475 weight 0.10000E+01 volume -0.41030E+01 ppm1 2.298 ppm2 2.443 ASSI { 3484} (segid " " and resid "54 " and name "HA ") (segid " " and resid "54 " and name "HB1 ") 5.000 5.000 0.000 peak 3484 weight 0.10000E+01 volume -0.39900E+00 ppm1 4.827 ppm2 2.390 OR { 3484} (segid " " and resid "54 " and name "HA ") (segid " " and resid "54 " and name "HB2 ") ASSI { 3513} (segid " " and resid "54 " and name "HB2 ") (segid " " and resid "54 " and name "HD1 ") 5.000 5.000 0.000 peak 3513 weight 0.10000E+01 volume -0.53500E+00 ppm1 2.377 ppm2 3.180 OR { 3513} (segid " " and resid "54 " and name "HB2 ") (segid " " and resid "54 " and name "HD2 ") OR { 3513} (segid " " and resid "54 " and name "HB1 ") (segid " " and resid "54 " and name "HD1 ") OR { 3513} (segid " " and resid "54 " and name "HB1 ") (segid " " and resid "54 " and name "HD2 ") ASSI { 3505} (segid " " and resid "54 " and name "HB1 ") (segid " " and resid "54 " and name "HG1 ") 5.000 5.000 0.000 peak 3505 weight 0.10000E+01 volume -0.15360E+01 ppm1 2.377 ppm2 1.942 OR { 3505} (segid " " and resid "54 " and name "HB2 ") (segid " " and resid "54 " and name "HG1 ") ASSI { 3514} (segid " " and resid "54 " and name "HB1 ") (segid " " and resid "58 " and name "HB2 ") 5.000 5.000 0.000 peak 3514 weight 0.10000E+01 volume -0.50900E+00 ppm1 2.377 ppm2 3.022 OR { 3514} (segid " " and resid "54 " and name "HB2 ") (segid " " and resid "58 " and name "HB2 ") ASSI { 3517} (segid " " and resid "54 " and name "HD1 ") (segid " " and resid "54 " and name "HA ") 5.000 5.000 0.000 peak 3517 weight 0.10000E+01 volume -0.64500E+00 ppm1 3.207 ppm2 4.814 OR { 3517} (segid " " and resid "54 " and name "HD2 ") (segid " " and resid "54 " and name "HA ") ASSI { 3481} (segid " " and resid "54 " and name "HD2 ") (segid " " and resid "54 " and name "HG1 ") 5.000 5.000 0.000 peak 3481 weight 0.10000E+01 volume -0.85200E+00 ppm1 3.207 ppm2 1.942 OR { 3481} (segid " " and resid "54 " and name "HD1 ") (segid " " and resid "54 " and name "HG1 ") ASSI { 3497} (segid " " and resid "54 " and name "HG1 ") (segid " " and resid "54 " and name "HA ") 5.000 5.000 0.000 peak 3497 weight 0.10000E+01 volume -0.30400E+00 ppm1 1.942 ppm2 4.814 ASSI { 3529} (segid " " and resid "55 " and name "HB ") (segid " " and resid "55 " and name "HA ") 3.300 3.300 0.000 peak 3529 weight 0.10000E+01 volume -0.21380E+01 ppm1 4.471 ppm2 5.236 ASSI { 3527} (segid " " and resid "55 " and name "HB ") (segid " " and resid "55 " and name "HG23") 3.300 3.300 0.000 peak 3527 weight 0.10000E+01 volume -0.28090E+01 ppm1 4.471 ppm2 1.151 OR { 3527} (segid " " and resid "55 " and name "HB ") (segid " " and resid "55 " and name "HG21") OR { 3527} (segid " " and resid "55 " and name "HB ") (segid " " and resid "55 " and name "HG22") ASSI { 5918} (segid " " and resid "56 " and name "HA ") (segid " " and resid "23 " and name "HG23") 5.000 5.000 0.000 peak 5918 weight 0.10000E+01 volume -0.16330E+01 ppm1 4.041 ppm2 1.061 OR { 5918} (segid " " and resid "56 " and name "HA ") (segid " " and resid "23 " and name "HG21") OR { 5918} (segid " " and resid "56 " and name "HA ") (segid " " and resid "23 " and name "HG22") ASSI { 3541} (segid " " and resid "56 " and name "HA ") (segid " " and resid "56 " and name "HB1 ") 5.000 5.000 0.000 peak 3541 weight 0.10000E+01 volume -0.15660E+01 ppm1 4.037 ppm2 1.046 ASSI { 3546} (segid " " and resid "56 " and name "HA ") (segid " " and resid "56 " and name "HB2 ") 5.000 5.000 0.000 peak 3546 weight 0.10000E+01 volume -0.78200E+00 ppm1 4.037 ppm2 1.863 ASSI { 5921} (segid " " and resid "56 " and name "HA ") (segid " " and resid "56 " and name "HD12") 5.000 5.000 0.000 peak 5921 weight 0.10000E+01 volume -0.13200E+01 ppm1 4.041 ppm2 0.402 OR { 5921} (segid " " and resid "56 " and name "HA ") (segid " " and resid "56 " and name "HD11") OR { 5921} (segid " " and resid "56 " and name "HA ") (segid " " and resid "56 " and name "HD13") ASSI { 3539} (segid " " and resid "56 " and name "HA ") (segid " " and resid "56 " and name "HD21") 3.300 3.300 0.000 peak 3539 weight 0.10000E+01 volume -0.21960E+01 ppm1 4.037 ppm2 0.308 OR { 3539} (segid " " and resid "56 " and name "HA ") (segid " " and resid "56 " and name "HD23") OR { 3539} (segid " " and resid "56 " and name "HA ") (segid " " and resid "56 " and name "HD22") ASSI { 3549} (segid " " and resid "56 " and name "HA ") (segid " " and resid "59 " and name "HB2 ") 6.000 6.000 0.000 peak 3549 weight 0.10000E+01 volume -0.14200E+00 ppm1 4.050 ppm2 2.627 ASSI { 3545} (segid " " and resid "56 " and name "HA ") (segid " " and resid "59 " and name "HD2 ") 5.000 5.000 0.000 peak 3545 weight 0.10000E+01 volume -0.85700E+00 ppm1 4.037 ppm2 7.265 OR { 3545} (segid " " and resid "56 " and name "HA ") (segid " " and resid "59 " and name "HD1 ") ASSI { 3550} (segid " " and resid "56 " and name "HA ") (segid " " and resid "59 " and name "HE1 ") 6.000 6.000 0.000 peak 3550 weight 0.10000E+01 volume -0.13600E+00 ppm1 4.037 ppm2 6.869 OR { 3550} (segid " " and resid "56 " and name "HA ") (segid " " and resid "59 " and name "HE2 ") ASSI { 5915} (segid " " and resid "56 " and name "HA ") (segid " " and resid "61 " and name "HB ") 5.000 5.000 0.000 peak 5915 weight 0.10000E+01 volume -0.53900E+00 ppm1 4.041 ppm2 1.125 ASSI { 3544} (segid " " and resid "56 " and name "HA ") (segid " " and resid "61 " and name "HD11") 5.000 5.000 0.000 peak 3544 weight 0.10000E+01 volume -0.13000E+01 ppm1 4.037 ppm2 0.387 OR { 3544} (segid " " and resid "56 " and name "HA ") (segid " " and resid "61 " and name "HD13") OR { 3544} (segid " " and resid "56 " and name "HA ") (segid " " and resid "61 " and name "HD12") ASSI { 3551} (segid " " and resid "56 " and name "HB2 ") (segid " " and resid "56 " and name "HB1 ") 3.300 3.300 0.000 peak 3551 weight 0.10000E+01 volume -0.24530E+01 ppm1 1.876 ppm2 1.072 ASSI { 3557} (segid " " and resid "56 " and name "HB1 ") (segid " " and resid "56 " and name "HD12") 5.000 5.000 0.000 peak 3557 weight 0.10000E+01 volume -0.10470E+01 ppm1 1.059 ppm2 0.414 OR { 3557} (segid " " and resid "56 " and name "HB1 ") (segid " " and resid "56 " and name "HD11") OR { 3557} (segid " " and resid "56 " and name "HB1 ") (segid " " and resid "56 " and name "HD13") ASSI { 3552} (segid " " and resid "56 " and name "HB2 ") (segid " " and resid "56 " and name "HD11") 5.000 5.000 0.000 peak 3552 weight 0.10000E+01 volume -0.94100E+00 ppm1 1.876 ppm2 0.414 OR { 3552} (segid " " and resid "56 " and name "HB2 ") (segid " " and resid "56 " and name "HD13") OR { 3552} (segid " " and resid "56 " and name "HB2 ") (segid " " and resid "56 " and name "HD12") ASSI { 3559} (segid " " and resid "56 " and name "HB1 ") (segid " " and resid "56 " and name "HD21") 5.000 5.000 0.000 peak 3559 weight 0.10000E+01 volume -0.74400E+00 ppm1 1.059 ppm2 0.308 OR { 3559} (segid " " and resid "56 " and name "HB1 ") (segid " " and resid "56 " and name "HD23") OR { 3559} (segid " " and resid "56 " and name "HB1 ") (segid " " and resid "56 " and name "HD22") ASSI { 3555} (segid " " and resid "56 " and name "HB2 ") (segid " " and resid "56 " and name "HD22") 5.000 5.000 0.000 peak 3555 weight 0.10000E+01 volume -0.46500E+00 ppm1 1.876 ppm2 0.308 OR { 3555} (segid " " and resid "56 " and name "HB2 ") (segid " " and resid "56 " and name "HD23") OR { 3555} (segid " " and resid "56 " and name "HB2 ") (segid " " and resid "56 " and name "HD21") ASSI { 5929} (segid " " and resid "56 " and name "HB2 ") (segid " " and resid "61 " and name "HB ") 5.000 5.000 0.000 peak 5929 weight 0.10000E+01 volume -0.70900E+00 ppm1 1.868 ppm2 1.128 ASSI { 5942} (segid " " and resid "56 " and name "HB1 ") (segid " " and resid "61 " and name "HG23") 5.000 5.000 0.000 peak 5942 weight 0.10000E+01 volume -0.72200E+00 ppm1 1.055 ppm2 0.333 OR { 5942} (segid " " and resid "56 " and name "HB1 ") (segid " " and resid "61 " and name "HG21") OR { 5942} (segid " " and resid "56 " and name "HB1 ") (segid " " and resid "61 " and name "HG22") ASSI { 5926} (segid " " and resid "56 " and name "HB2 ") (segid " " and resid "61 " and name "HG22") 5.000 5.000 0.000 peak 5926 weight 0.10000E+01 volume -0.45000E+00 ppm1 1.868 ppm2 0.334 OR { 5926} (segid " " and resid "56 " and name "HB2 ") (segid " " and resid "61 " and name "HG21") OR { 5926} (segid " " and resid "56 " and name "HB2 ") (segid " " and resid "61 " and name "HG23") ASSI { 3569} (segid " " and resid "56 " and name "HD11") (segid " " and resid "1 " and name "HE1 ") 5.000 5.000 0.000 peak 3569 weight 0.10000E+01 volume -0.32700E+00 ppm1 0.414 ppm2 1.520 OR { 3569} (segid " " and resid "56 " and name "HD12") (segid " " and resid "1 " and name "HE2 ") OR { 3569} (segid " " and resid "56 " and name "HD11") (segid " " and resid "1 " and name "HE2 ") OR { 3569} (segid " " and resid "56 " and name "HD12") (segid " " and resid "1 " and name "HE1 ") OR { 3569} (segid " " and resid "56 " and name "HD13") (segid " " and resid "1 " and name "HE1 ") OR { 3569} (segid " " and resid "56 " and name "HD11") (segid " " and resid "1 " and name "HE3 ") OR { 3569} (segid " " and resid "56 " and name "HD13") (segid " " and resid "1 " and name "HE2 ") OR { 3569} (segid " " and resid "56 " and name "HD12") (segid " " and resid "1 " and name "HE3 ") OR { 3569} (segid " " and resid "56 " and name "HD13") (segid " " and resid "1 " and name "HE3 ") ASSI { 3566} (segid " " and resid "56 " and name "HD12") (segid " " and resid "17 " and name "HB ") 5.000 5.000 0.000 peak 3566 weight 0.10000E+01 volume -0.11630E+01 ppm1 0.414 ppm2 2.100 OR { 3566} (segid " " and resid "56 " and name "HD13") (segid " " and resid "17 " and name "HB ") OR { 3566} (segid " " and resid "56 " and name "HD11") (segid " " and resid "17 " and name "HB ") ASSI { 3573} (segid " " and resid "56 " and name "HD11") (segid " " and resid "21 " and name "HB1 ") 5.000 5.000 0.000 peak 3573 weight 0.10000E+01 volume -0.36400E+00 ppm1 0.414 ppm2 2.601 OR { 3573} (segid " " and resid "56 " and name "HD12") (segid " " and resid "21 " and name "HB1 ") OR { 3573} (segid " " and resid "56 " and name "HD13") (segid " " and resid "21 " and name "HB1 ") ASSI { 3576} (segid " " and resid "56 " and name "HD13") (segid " " and resid "26 " and name "HE1 ") 6.000 6.000 0.000 peak 3576 weight 0.10000E+01 volume -0.82000E-01 ppm1 0.414 ppm2 6.869 OR { 3576} (segid " " and resid "56 " and name "HD13") (segid " " and resid "26 " and name "HE2 ") OR { 3576} (segid " " and resid "56 " and name "HD11") (segid " " and resid "26 " and name "HE2 ") OR { 3576} (segid " " and resid "56 " and name "HD12") (segid " " and resid "26 " and name "HE1 ") OR { 3576} (segid " " and resid "56 " and name "HD12") (segid " " and resid "26 " and name "HE2 ") OR { 3576} (segid " " and resid "56 " and name "HD11") (segid " " and resid "26 " and name "HE1 ") ASSI { 3562} (segid " " and resid "56 " and name "HD11") (segid " " and resid "56 " and name "HD21") 2.700 2.700 0.000 peak 3562 weight 0.10000E+01 volume -0.40230E+01 ppm1 0.414 ppm2 0.308 OR { 3562} (segid " " and resid "56 " and name "HD13") (segid " " and resid "56 " and name "HD23") OR { 3562} (segid " " and resid "56 " and name "HD13") (segid " " and resid "56 " and name "HD22") OR { 3562} (segid " " and resid "56 " and name "HD11") (segid " " and resid "56 " and name "HD22") OR { 3562} (segid " " and resid "56 " and name "HD12") (segid " " and resid "56 " and name "HD23") OR { 3562} (segid " " and resid "56 " and name "HD12") (segid " " and resid "56 " and name "HD22") OR { 3562} (segid " " and resid "56 " and name "HD11") (segid " " and resid "56 " and name "HD23") OR { 3562} (segid " " and resid "56 " and name "HD12") (segid " " and resid "56 " and name "HD21") OR { 3562} (segid " " and resid "56 " and name "HD13") (segid " " and resid "56 " and name "HD21") ASSI { 5963} (segid " " and resid "56 " and name "HD12") (segid " " and resid "61 " and name "HB ") 5.000 5.000 0.000 peak 5963 weight 0.10000E+01 volume -0.34900E+00 ppm1 0.411 ppm2 1.127 OR { 5963} (segid " " and resid "56 " and name "HD11") (segid " " and resid "61 " and name "HB ") OR { 5963} (segid " " and resid "56 " and name "HD13") (segid " " and resid "61 " and name "HB ") ASSI { 5975} (segid " " and resid "56 " and name "HD23") (segid " " and resid "26 " and name "HB1 ") 5.000 5.000 0.000 peak 5975 weight 0.10000E+01 volume -0.11220E+01 ppm1 0.304 ppm2 3.562 OR { 5975} (segid " " and resid "56 " and name "HD22") (segid " " and resid "26 " and name "HB1 ") OR { 5975} (segid " " and resid "56 " and name "HD21") (segid " " and resid "26 " and name "HB1 ") ASSI { 5981} (segid " " and resid "56 " and name "HD23") (segid " " and resid "61 " and name "HB ") 5.000 5.000 0.000 peak 5981 weight 0.10000E+01 volume -0.46900E+00 ppm1 0.304 ppm2 1.127 OR { 5981} (segid " " and resid "56 " and name "HD21") (segid " " and resid "61 " and name "HB ") OR { 5981} (segid " " and resid "56 " and name "HD22") (segid " " and resid "61 " and name "HB ") ASSI { 3598} (segid " " and resid "57 " and name "HA ") (segid " " and resid "19 " and name "HB2 ") 6.000 6.000 0.000 peak 3598 weight 0.10000E+01 volume -0.13300E+00 ppm1 4.287 ppm2 2.021 ASSI { 3595} (segid " " and resid "57 " and name "HA ") (segid " " and resid "57 " and name "HB1 ") 3.300 3.300 0.000 peak 3595 weight 0.10000E+01 volume -0.20690E+01 ppm1 4.287 ppm2 3.760 ASSI { 3594} (segid " " and resid "57 " and name "HA ") (segid " " and resid "57 " and name "HB2 ") 3.300 3.300 0.000 peak 3594 weight 0.10000E+01 volume -0.24880E+01 ppm1 4.287 ppm2 3.892 ASSI { 3599} (segid " " and resid "57 " and name "HA ") (segid " " and resid "61 " and name "HB ") 6.000 6.000 0.000 peak 3599 weight 0.10000E+01 volume -0.11500E+00 ppm1 4.287 ppm2 1.151 ASSI { 3604} (segid " " and resid "57 " and name "HB2 ") (segid " " and resid "19 " and name "HB1 ") 5.000 5.000 0.000 peak 3604 weight 0.10000E+01 volume -0.32800E+00 ppm1 3.892 ppm2 2.337 ASSI { 3603} (segid " " and resid "57 " and name "HB2 ") (segid " " and resid "19 " and name "HB2 ") 5.000 5.000 0.000 peak 3603 weight 0.10000E+01 volume -0.31100E+00 ppm1 3.892 ppm2 2.021 ASSI { 3601} (segid " " and resid "57 " and name "HB2 ") (segid " " and resid "57 " and name "HB1 ") 2.700 2.700 0.000 peak 3601 weight 0.10000E+01 volume -0.69230E+01 ppm1 3.892 ppm2 3.760 ASSI { 3613} (segid " " and resid "58 " and name "HB2 ") (segid " " and resid "59 " and name "HD2 ") 6.000 6.000 0.000 peak 3613 weight 0.10000E+01 volume -0.12500E+00 ppm1 3.022 ppm2 7.265 OR { 3613} (segid " " and resid "58 " and name "HB2 ") (segid " " and resid "59 " and name "HD1 ") ASSI { 3616} (segid " " and resid "59 " and name "HA ") (segid " " and resid "59 " and name "HB1 ") 5.000 5.000 0.000 peak 3616 weight 0.10000E+01 volume -0.12390E+01 ppm1 4.511 ppm2 3.497 ASSI { 3621} (segid " " and resid "59 " and name "HA ") (segid " " and resid "59 " and name "HE2 ") 6.000 6.000 0.000 peak 3621 weight 0.10000E+01 volume -0.13800E+00 ppm1 4.511 ppm2 6.869 OR { 3621} (segid " " and resid "59 " and name "HA ") (segid " " and resid "59 " and name "HE1 ") ASSI { 3623} (segid " " and resid "59 " and name "HA ") (segid " " and resid "61 " and name "HD12") 6.000 6.000 0.000 peak 3623 weight 0.10000E+01 volume -0.99000E-01 ppm1 4.511 ppm2 0.387 OR { 3623} (segid " " and resid "59 " and name "HA ") (segid " " and resid "61 " and name "HD11") OR { 3623} (segid " " and resid "59 " and name "HA ") (segid " " and resid "61 " and name "HD13") ASSI { 3628} (segid " " and resid "59 " and name "HB1 ") (segid " " and resid "45 " and name "HD2 ") 5.000 5.000 0.000 peak 3628 weight 0.10000E+01 volume -0.33800E+00 ppm1 3.510 ppm2 7.449 OR { 3628} (segid " " and resid "59 " and name "HB1 ") (segid " " and resid "45 " and name "HD1 ") ASSI { 3646} (segid " " and resid "59 " and name "HB2 ") (segid " " and resid "59 " and name "HB1 ") 3.300 3.300 0.000 peak 3646 weight 0.10000E+01 volume -0.21980E+01 ppm1 2.640 ppm2 3.497 ASSI { 3655} (segid " " and resid "59 " and name "HB2 ") (segid " " and resid "59 " and name "HE1 ") 6.000 6.000 0.000 peak 3655 weight 0.10000E+01 volume -0.89000E-01 ppm1 2.614 ppm2 6.869 OR { 3655} (segid " " and resid "59 " and name "HB2 ") (segid " " and resid "59 " and name "HE2 ") ASSI { 3626} (segid " " and resid "59 " and name "HB1 ") (segid " " and resid "61 " and name "HD12") 5.000 5.000 0.000 peak 3626 weight 0.10000E+01 volume -0.41500E+00 ppm1 3.510 ppm2 0.387 OR { 3626} (segid " " and resid "59 " and name "HB1 ") (segid " " and resid "61 " and name "HD11") OR { 3626} (segid " " and resid "59 " and name "HB1 ") (segid " " and resid "61 " and name "HD13") ASSI { 3648} (segid " " and resid "59 " and name "HB2 ") (segid " " and resid "61 " and name "HD12") 5.000 5.000 0.000 peak 3648 weight 0.10000E+01 volume -0.47400E+00 ppm1 2.627 ppm2 0.387 OR { 3648} (segid " " and resid "59 " and name "HB2 ") (segid " " and resid "61 " and name "HD11") OR { 3648} (segid " " and resid "59 " and name "HB2 ") (segid " " and resid "61 " and name "HD13") ASSI { 3627} (segid " " and resid "59 " and name "HB1 ") (segid " " and resid "61 " and name "HG11") 5.000 5.000 0.000 peak 3627 weight 0.10000E+01 volume -0.33300E+00 ppm1 3.510 ppm2 1.020 ASSI { 3651} (segid " " and resid "59 " and name "HB2 ") (segid " " and resid "61 " and name "HG11") 5.000 5.000 0.000 peak 3651 weight 0.10000E+01 volume -0.37100E+00 ppm1 2.627 ppm2 1.020 ASSI { 3654} (segid " " and resid "59 " and name "HB2 ") (segid " " and resid "61 " and name "HG12") 6.000 6.000 0.000 peak 3654 weight 0.10000E+01 volume -0.10300E+00 ppm1 2.614 ppm2 -0.403 ASSI { 3639} (segid " " and resid "59 " and name "HD2 ") (segid " " and resid "23 " and name "HG22") 5.000 5.000 0.000 peak 3639 weight 0.10000E+01 volume -0.43200E+00 ppm1 7.278 ppm2 1.046 OR { 3639} (segid " " and resid "59 " and name "HD2 ") (segid " " and resid "23 " and name "HG21") OR { 3639} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "23 " and name "HG23") OR { 3639} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "23 " and name "HG21") OR { 3639} (segid " " and resid "59 " and name "HD2 ") (segid " " and resid "23 " and name "HG23") OR { 3639} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "23 " and name "HG22") ASSI { 3640} (segid " " and resid "59 " and name "HD2 ") (segid " " and resid "48 " and name "HD2 ") 5.000 5.000 0.000 peak 3640 weight 0.10000E+01 volume -0.38500E+00 ppm1 7.265 ppm2 1.916 OR { 3640} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "48 " and name "HD1 ") OR { 3640} (segid " " and resid "59 " and name "HD2 ") (segid " " and resid "48 " and name "HD1 ") OR { 3640} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "48 " and name "HD2 ") ASSI { 6037} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "61 " and name "HG11") 5.000 5.000 0.000 peak 6037 weight 0.10000E+01 volume -0.45400E+00 ppm1 7.267 ppm2 1.025 OR { 6037} (segid " " and resid "59 " and name "HD2 ") (segid " " and resid "61 " and name "HG11") ASSI { 6049} (segid " " and resid "59 " and name "HE2 ") (segid " " and resid "48 " and name "HD2 ") 5.000 5.000 0.000 peak 6049 weight 0.10000E+01 volume -0.70600E+00 ppm1 6.864 ppm2 1.906 OR { 6049} (segid " " and resid "59 " and name "HE2 ") (segid " " and resid "48 " and name "HD1 ") OR { 6049} (segid " " and resid "59 " and name "HE1 ") (segid " " and resid "48 " and name "HD2 ") OR { 6049} (segid " " and resid "59 " and name "HE1 ") (segid " " and resid "48 " and name "HD1 ") ASSI { 3658} (segid " " and resid "59 " and name "HE1 ") (segid " " and resid "50 " and name "HD21") 5.000 5.000 0.000 peak 3658 weight 0.10000E+01 volume -0.35100E+00 ppm1 6.856 ppm2 0.150 OR { 3658} (segid " " and resid "59 " and name "HE1 ") (segid " " and resid "50 " and name "HD22") OR { 3658} (segid " " and resid "59 " and name "HE2 ") (segid " " and resid "50 " and name "HD22") OR { 3658} (segid " " and resid "59 " and name "HE1 ") (segid " " and resid "50 " and name "HD23") OR { 3658} (segid " " and resid "59 " and name "HE2 ") (segid " " and resid "50 " and name "HD23") OR { 3658} (segid " " and resid "59 " and name "HE2 ") (segid " " and resid "50 " and name "HD21") ASSI { 3638} (segid " " and resid "59 " and name "HE2 ") (segid " " and resid "54 " and name "HB2 ") 3.300 3.300 0.000 peak 3638 weight 0.10000E+01 volume -0.22740E+01 ppm1 6.856 ppm2 2.363 OR { 3638} (segid " " and resid "59 " and name "HE1 ") (segid " " and resid "54 " and name "HB1 ") OR { 3638} (segid " " and resid "59 " and name "HE2 ") (segid " " and resid "54 " and name "HB1 ") OR { 3638} (segid " " and resid "59 " and name "HE1 ") (segid " " and resid "54 " and name "HB2 ") ASSI { 3657} (segid " " and resid "59 " and name "HE2 ") (segid " " and resid "54 " and name "HG1 ") 5.000 5.000 0.000 peak 3657 weight 0.10000E+01 volume -0.83900E+00 ppm1 6.856 ppm2 1.942 OR { 3657} (segid " " and resid "59 " and name "HE1 ") (segid " " and resid "54 " and name "HG1 ") ASSI { 6052} (segid " " and resid "59 " and name "HE2 ") (segid " " and resid "58 " and name "HB1 ") 5.000 5.000 0.000 peak 6052 weight 0.10000E+01 volume -0.15470E+01 ppm1 6.864 ppm2 2.315 OR { 6052} (segid " " and resid "59 " and name "HE1 ") (segid " " and resid "58 " and name "HB1 ") ASSI { 3667} (segid " " and resid "59 " and name "HE1 ") (segid " " and resid "59 " and name "HB1 ") 6.000 6.000 0.000 peak 3667 weight 0.10000E+01 volume -0.14300E+00 ppm1 6.856 ppm2 3.523 OR { 3667} (segid " " and resid "59 " and name "HE2 ") (segid " " and resid "59 " and name "HB1 ") ASSI { 3660} (segid " " and resid "60 " and name "HA ") (segid " " and resid "60 " and name "HB1 ") 5.000 5.000 0.000 peak 3660 weight 0.10000E+01 volume -0.18500E+01 ppm1 4.379 ppm2 3.312 ASSI { 3662} (segid " " and resid "60 " and name "HA ") (segid " " and resid "60 " and name "HB2 ") 5.000 5.000 0.000 peak 3662 weight 0.10000E+01 volume -0.16710E+01 ppm1 4.379 ppm2 2.864 ASSI { 3666} (segid " " and resid "60 " and name "HB2 ") (segid " " and resid "60 " and name "HB1 ") 2.700 2.700 0.000 peak 3666 weight 0.10000E+01 volume -0.40440E+01 ppm1 2.851 ppm2 3.312 ASSI { 3684} (segid " " and resid "61 " and name "HA ") (segid " " and resid "45 " and name "HE1 ") 5.000 5.000 0.000 peak 3684 weight 0.10000E+01 volume -0.30400E+00 ppm1 3.194 ppm2 7.554 OR { 3684} (segid " " and resid "61 " and name "HA ") (segid " " and resid "45 " and name "HE2 ") ASSI { 3681} (segid " " and resid "61 " and name "HA ") (segid " " and resid "61 " and name "HB ") 5.000 5.000 0.000 peak 3681 weight 0.10000E+01 volume -0.76800E+00 ppm1 3.194 ppm2 1.125 ASSI { 6074} (segid " " and resid "61 " and name "HA ") (segid " " and resid "61 " and name "HD12") 5.000 5.000 0.000 peak 6074 weight 0.10000E+01 volume -0.16690E+01 ppm1 3.189 ppm2 0.382 OR { 6074} (segid " " and resid "61 " and name "HA ") (segid " " and resid "61 " and name "HD13") OR { 6074} (segid " " and resid "61 " and name "HA ") (segid " " and resid "61 " and name "HD11") ASSI { 3680} (segid " " and resid "61 " and name "HA ") (segid " " and resid "61 " and name "HG11") 5.000 5.000 0.000 peak 3680 weight 0.10000E+01 volume -0.11370E+01 ppm1 3.194 ppm2 1.020 ASSI { 3679} (segid " " and resid "61 " and name "HA ") (segid " " and resid "61 " and name "HG12") 5.000 5.000 0.000 peak 3679 weight 0.10000E+01 volume -0.13970E+01 ppm1 3.194 ppm2 -0.403 ASSI { 3677} (segid " " and resid "61 " and name "HA ") (segid " " and resid "61 " and name "HG21") 5.000 5.000 0.000 peak 3677 weight 0.10000E+01 volume -0.17270E+01 ppm1 3.194 ppm2 0.334 OR { 3677} (segid " " and resid "61 " and name "HA ") (segid " " and resid "61 " and name "HG22") OR { 3677} (segid " " and resid "61 " and name "HA ") (segid " " and resid "61 " and name "HG23") ASSI { 3686} (segid " " and resid "61 " and name "HA ") (segid " " and resid "65 " and name "HB2 ") 6.000 6.000 0.000 peak 3686 weight 0.10000E+01 volume -0.17600E+00 ppm1 3.194 ppm2 3.707 ASSI { 3691} (segid " " and resid "61 " and name "HA ") (segid " " and resid "67 " and name "HD12") 6.000 6.000 0.000 peak 3691 weight 0.10000E+01 volume -0.71000E-01 ppm1 3.194 ppm2 0.703 OR { 3691} (segid " " and resid "61 " and name "HA ") (segid " " and resid "67 " and name "HD11") OR { 3691} (segid " " and resid "61 " and name "HA ") (segid " " and resid "67 " and name "HD13") ASSI { 6079} (segid " " and resid "61 " and name "HB ") (segid " " and resid "61 " and name "HD11") 5.000 5.000 0.000 peak 6079 weight 0.10000E+01 volume -0.19020E+01 ppm1 1.130 ppm2 0.381 OR { 6079} (segid " " and resid "61 " and name "HB ") (segid " " and resid "61 " and name "HD13") OR { 6079} (segid " " and resid "61 " and name "HB ") (segid " " and resid "61 " and name "HD12") ASSI { 3737} (segid " " and resid "61 " and name "HD11") (segid " " and resid "45 " and name "HB1 ") 5.000 5.000 0.000 peak 3737 weight 0.10000E+01 volume -0.30600E+00 ppm1 0.400 ppm2 2.943 OR { 3737} (segid " " and resid "61 " and name "HD13") (segid " " and resid "45 " and name "HB1 ") OR { 3737} (segid " " and resid "61 " and name "HD12") (segid " " and resid "45 " and name "HB1 ") ASSI { 3730} (segid " " and resid "61 " and name "HD13") (segid " " and resid "50 " and name "HD12") 5.000 5.000 0.000 peak 3730 weight 0.10000E+01 volume -0.15260E+01 ppm1 0.400 ppm2 0.572 OR { 3730} (segid " " and resid "61 " and name "HD12") (segid " " and resid "50 " and name "HD11") OR { 3730} (segid " " and resid "61 " and name "HD11") (segid " " and resid "50 " and name "HD12") OR { 3730} (segid " " and resid "61 " and name "HD12") (segid " " and resid "50 " and name "HD12") OR { 3730} (segid " " and resid "61 " and name "HD12") (segid " " and resid "50 " and name "HD13") OR { 3730} (segid " " and resid "61 " and name "HD11") (segid " " and resid "50 " and name "HD11") OR { 3730} (segid " " and resid "61 " and name "HD13") (segid " " and resid "50 " and name "HD13") OR { 3730} (segid " " and resid "61 " and name "HD13") (segid " " and resid "50 " and name "HD11") OR { 3730} (segid " " and resid "61 " and name "HD11") (segid " " and resid "50 " and name "HD13") ASSI { 3739} (segid " " and resid "61 " and name "HD12") (segid " " and resid "56 " and name "HB2 ") 5.000 5.000 0.000 peak 3739 weight 0.10000E+01 volume -0.32800E+00 ppm1 0.387 ppm2 1.863 OR { 3739} (segid " " and resid "61 " and name "HD13") (segid " " and resid "56 " and name "HB2 ") OR { 3739} (segid " " and resid "61 " and name "HD11") (segid " " and resid "56 " and name "HB2 ") ASSI { 3738} (segid " " and resid "61 " and name "HD11") (segid " " and resid "59 " and name "HD1 ") 5.000 5.000 0.000 peak 3738 weight 0.10000E+01 volume -0.31100E+00 ppm1 0.400 ppm2 7.265 OR { 3738} (segid " " and resid "61 " and name "HD11") (segid " " and resid "59 " and name "HD2 ") OR { 3738} (segid " " and resid "61 " and name "HD12") (segid " " and resid "59 " and name "HD2 ") OR { 3738} (segid " " and resid "61 " and name "HD13") (segid " " and resid "59 " and name "HD1 ") OR { 3738} (segid " " and resid "61 " and name "HD12") (segid " " and resid "59 " and name "HD1 ") OR { 3738} (segid " " and resid "61 " and name "HD13") (segid " " and resid "59 " and name "HD2 ") ASSI { 3727} (segid " " and resid "61 " and name "HD12") (segid " " and resid "61 " and name "HG11") 3.300 3.300 0.000 peak 3727 weight 0.10000E+01 volume -0.22750E+01 ppm1 0.400 ppm2 1.020 OR { 3727} (segid " " and resid "61 " and name "HD13") (segid " " and resid "61 " and name "HG11") OR { 3727} (segid " " and resid "61 " and name "HD11") (segid " " and resid "61 " and name "HG11") ASSI { 3731} (segid " " and resid "61 " and name "HD13") (segid " " and resid "61 " and name "HG12") 5.000 5.000 0.000 peak 3731 weight 0.10000E+01 volume -0.14230E+01 ppm1 0.400 ppm2 -0.403 OR { 3731} (segid " " and resid "61 " and name "HD11") (segid " " and resid "61 " and name "HG12") OR { 3731} (segid " " and resid "61 " and name "HD12") (segid " " and resid "61 " and name "HG12") ASSI { 6134} (segid " " and resid "61 " and name "HD11") (segid " " and resid "67 " and name "HG12") 5.000 5.000 0.000 peak 6134 weight 0.10000E+01 volume -0.13280E+01 ppm1 0.389 ppm2 1.176 OR { 6134} (segid " " and resid "61 " and name "HD13") (segid " " and resid "67 " and name "HG12") OR { 6134} (segid " " and resid "61 " and name "HD12") (segid " " and resid "67 " and name "HG12") ASSI { 3705} (segid " " and resid "61 " and name "HG11") (segid " " and resid "45 " and name "HD1 ") 6.000 6.000 0.000 peak 3705 weight 0.10000E+01 volume -0.19900E+00 ppm1 1.020 ppm2 7.449 OR { 3705} (segid " " and resid "61 " and name "HG11") (segid " " and resid "45 " and name "HD2 ") ASSI { 3712} (segid " " and resid "61 " and name "HG12") (segid " " and resid "45 " and name "HD1 ") 6.000 6.000 0.000 peak 3712 weight 0.10000E+01 volume -0.13400E+00 ppm1 -0.416 ppm2 7.449 OR { 3712} (segid " " and resid "61 " and name "HG12") (segid " " and resid "45 " and name "HD2 ") ASSI { 3701} (segid " " and resid "61 " and name "HG11") (segid " " and resid "61 " and name "HB ") 5.000 5.000 0.000 peak 3701 weight 0.10000E+01 volume -0.62800E+00 ppm1 1.020 ppm2 1.125 ASSI { 3707} (segid " " and resid "61 " and name "HG12") (segid " " and resid "61 " and name "HB ") 5.000 5.000 0.000 peak 3707 weight 0.10000E+01 volume -0.38800E+00 ppm1 -0.403 ppm2 1.125 ASSI { 3700} (segid " " and resid "61 " and name "HG12") (segid " " and resid "61 " and name "HG11") 3.300 3.300 0.000 peak 3700 weight 0.10000E+01 volume -0.21290E+01 ppm1 -0.403 ppm2 1.020 ASSI { 6095} (segid " " and resid "61 " and name "HG12") (segid " " and resid "61 " and name "HG22") 5.000 5.000 0.000 peak 6095 weight 0.10000E+01 volume -0.80000E+00 ppm1 -0.405 ppm2 0.333 OR { 6095} (segid " " and resid "61 " and name "HG12") (segid " " and resid "61 " and name "HG23") OR { 6095} (segid " " and resid "61 " and name "HG12") (segid " " and resid "61 " and name "HG21") ASSI { 3710} (segid " " and resid "61 " and name "HG12") (segid " " and resid "67 " and name "HD12") 6.000 6.000 0.000 peak 3710 weight 0.10000E+01 volume -0.17100E+00 ppm1 -0.416 ppm2 0.703 OR { 3710} (segid " " and resid "61 " and name "HG12") (segid " " and resid "67 " and name "HD13") OR { 3710} (segid " " and resid "61 " and name "HG12") (segid " " and resid "67 " and name "HD11") ASSI { 3711} (segid " " and resid "61 " and name "HG22") (segid " " and resid "1 " and name "HE1 ") 5.000 5.000 0.000 peak 3711 weight 0.10000E+01 volume -0.12620E+01 ppm1 0.348 ppm2 1.520 OR { 3711} (segid " " and resid "61 " and name "HG21") (segid " " and resid "1 " and name "HE3 ") OR { 3711} (segid " " and resid "61 " and name "HG22") (segid " " and resid "1 " and name "HE3 ") OR { 3711} (segid " " and resid "61 " and name "HG22") (segid " " and resid "1 " and name "HE2 ") OR { 3711} (segid " " and resid "61 " and name "HG21") (segid " " and resid "1 " and name "HE1 ") OR { 3711} (segid " " and resid "61 " and name "HG23") (segid " " and resid "1 " and name "HE1 ") OR { 3711} (segid " " and resid "61 " and name "HG23") (segid " " and resid "1 " and name "HE3 ") OR { 3711} (segid " " and resid "61 " and name "HG23") (segid " " and resid "1 " and name "HE2 ") OR { 3711} (segid " " and resid "61 " and name "HG21") (segid " " and resid "1 " and name "HE2 ") ASSI { 3724} (segid " " and resid "61 " and name "HG23") (segid " " and resid "45 " and name "HD1 ") 6.000 6.000 0.000 peak 3724 weight 0.10000E+01 volume -0.14600E+00 ppm1 0.348 ppm2 7.449 OR { 3724} (segid " " and resid "61 " and name "HG21") (segid " " and resid "45 " and name "HD1 ") OR { 3724} (segid " " and resid "61 " and name "HG22") (segid " " and resid "45 " and name "HD1 ") OR { 3724} (segid " " and resid "61 " and name "HG22") (segid " " and resid "45 " and name "HD2 ") OR { 3724} (segid " " and resid "61 " and name "HG21") (segid " " and resid "45 " and name "HD2 ") OR { 3724} (segid " " and resid "61 " and name "HG23") (segid " " and resid "45 " and name "HD2 ") ASSI { 3725} (segid " " and resid "61 " and name "HG23") (segid " " and resid "45 " and name "HE1 ") 6.000 6.000 0.000 peak 3725 weight 0.10000E+01 volume -0.98000E-01 ppm1 0.334 ppm2 7.554 OR { 3725} (segid " " and resid "61 " and name "HG21") (segid " " and resid "45 " and name "HE1 ") OR { 3725} (segid " " and resid "61 " and name "HG22") (segid " " and resid "45 " and name "HE1 ") OR { 3725} (segid " " and resid "61 " and name "HG22") (segid " " and resid "45 " and name "HE2 ") OR { 3725} (segid " " and resid "61 " and name "HG23") (segid " " and resid "45 " and name "HE2 ") OR { 3725} (segid " " and resid "61 " and name "HG21") (segid " " and resid "45 " and name "HE2 ") ASSI { 6104} (segid " " and resid "61 " and name "HG21") (segid " " and resid "45 " and name "HZ ") 6.000 6.000 0.000 peak 6104 weight 0.10000E+01 volume -0.14100E+00 ppm1 0.338 ppm2 7.438 OR { 6104} (segid " " and resid "61 " and name "HG22") (segid " " and resid "45 " and name "HZ ") OR { 6104} (segid " " and resid "61 " and name "HG23") (segid " " and resid "45 " and name "HZ ") ASSI { 3709} (segid " " and resid "61 " and name "HG23") (segid " " and resid "61 " and name "HB ") 3.300 3.300 0.000 peak 3709 weight 0.10000E+01 volume -0.23410E+01 ppm1 0.334 ppm2 1.125 OR { 3709} (segid " " and resid "61 " and name "HG22") (segid " " and resid "61 " and name "HB ") OR { 3709} (segid " " and resid "61 " and name "HG21") (segid " " and resid "61 " and name "HB ") ASSI { 3723} (segid " " and resid "61 " and name "HG22") (segid " " and resid "62 " and name "HA ") 6.000 6.000 0.000 peak 3723 weight 0.10000E+01 volume -0.20300E+00 ppm1 0.334 ppm2 4.551 OR { 3723} (segid " " and resid "61 " and name "HG21") (segid " " and resid "62 " and name "HA ") OR { 3723} (segid " " and resid "61 " and name "HG23") (segid " " and resid "62 " and name "HA ") ASSI { 3719} (segid " " and resid "61 " and name "HG22") (segid " " and resid "65 " and name "HB1 ") 5.000 5.000 0.000 peak 3719 weight 0.10000E+01 volume -0.69200E+00 ppm1 0.348 ppm2 3.971 OR { 3719} (segid " " and resid "61 " and name "HG23") (segid " " and resid "65 " and name "HB1 ") OR { 3719} (segid " " and resid "61 " and name "HG21") (segid " " and resid "65 " and name "HB1 ") ASSI { 3717} (segid " " and resid "61 " and name "HG22") (segid " " and resid "65 " and name "HB2 ") 5.000 5.000 0.000 peak 3717 weight 0.10000E+01 volume -0.94100E+00 ppm1 0.348 ppm2 3.707 OR { 3717} (segid " " and resid "61 " and name "HG23") (segid " " and resid "65 " and name "HB2 ") OR { 3717} (segid " " and resid "61 " and name "HG21") (segid " " and resid "65 " and name "HB2 ") ASSI { 3759} (segid " " and resid "63 " and name "HA ") (segid " " and resid "3 " and name "HG11") 5.000 5.000 0.000 peak 3759 weight 0.10000E+01 volume -0.58300E+00 ppm1 3.931 ppm2 0.572 OR { 3759} (segid " " and resid "63 " and name "HA ") (segid " " and resid "3 " and name "HG12") OR { 3759} (segid " " and resid "63 " and name "HA ") (segid " " and resid "3 " and name "HG13") ASSI { 3766} (segid " " and resid "63 " and name "HA ") (segid " " and resid "61 " and name "HG21") 6.000 6.000 0.000 peak 3766 weight 0.10000E+01 volume -0.10200E+00 ppm1 3.931 ppm2 0.361 OR { 3766} (segid " " and resid "63 " and name "HA ") (segid " " and resid "61 " and name "HG23") OR { 3766} (segid " " and resid "63 " and name "HA ") (segid " " and resid "61 " and name "HG22") ASSI { 3764} (segid " " and resid "63 " and name "HA ") (segid " " and resid "62 " and name "HA ") 6.000 6.000 0.000 peak 3764 weight 0.10000E+01 volume -0.11400E+00 ppm1 3.931 ppm2 4.551 ASSI { 6158} (segid " " and resid "63 " and name "HA ") (segid " " and resid "63 " and name "HD1 ") 5.000 5.000 0.000 peak 6158 weight 0.10000E+01 volume -0.48800E+00 ppm1 3.935 ppm2 1.724 OR { 6158} (segid " " and resid "63 " and name "HA ") (segid " " and resid "63 " and name "HD2 ") ASSI { 6154} (segid " " and resid "63 " and name "HA ") (segid " " and resid "63 " and name "HG1 ") 5.000 5.000 0.000 peak 6154 weight 0.10000E+01 volume -0.93600E+00 ppm1 3.935 ppm2 1.531 ASSI { 3781} (segid " " and resid "63 " and name "HG1 ") (segid " " and resid "63 " and name "HE1 ") 5.000 5.000 0.000 peak 3781 weight 0.10000E+01 volume -0.40100E+00 ppm1 1.547 ppm2 2.996 OR { 3781} (segid " " and resid "63 " and name "HG1 ") (segid " " and resid "63 " and name "HE2 ") ASSI { 3788} (segid " " and resid "63 " and name "HG2 ") (segid " " and resid "63 " and name "HE1 ") 5.000 5.000 0.000 peak 3788 weight 0.10000E+01 volume -0.39900E+00 ppm1 1.428 ppm2 2.996 OR { 3788} (segid " " and resid "63 " and name "HG2 ") (segid " " and resid "63 " and name "HE2 ") ASSI { 3785} (segid " " and resid "63 " and name "HG1 ") (segid " " and resid "64 " and name "HG1 ") 5.000 5.000 0.000 peak 3785 weight 0.10000E+01 volume -0.31900E+00 ppm1 1.533 ppm2 2.153 OR { 3785} (segid " " and resid "63 " and name "HG1 ") (segid " " and resid "64 " and name "HG2 ") ASSI { 3789} (segid " " and resid "63 " and name "HG2 ") (segid " " and resid "64 " and name "HG2 ") 5.000 5.000 0.000 peak 3789 weight 0.10000E+01 volume -0.36000E+00 ppm1 1.428 ppm2 2.153 OR { 3789} (segid " " and resid "63 " and name "HG2 ") (segid " " and resid "64 " and name "HG1 ") ASSI { 3801} (segid " " and resid "64 " and name "HA ") (segid " " and resid "4 " and name "HE1 ") 5.000 5.000 0.000 peak 3801 weight 0.10000E+01 volume -0.45600E+00 ppm1 3.141 ppm2 7.265 OR { 3801} (segid " " and resid "64 " and name "HA ") (segid " " and resid "4 " and name "HE2 ") ASSI { 6185} (segid " " and resid "64 " and name "HA ") (segid " " and resid "4 " and name "HZ ") 5.000 5.000 0.000 peak 6185 weight 0.10000E+01 volume -0.50900E+00 ppm1 3.152 ppm2 7.245 ASSI { 3798} (segid " " and resid "64 " and name "HA ") (segid " " and resid "64 " and name "HB1 ") 5.000 5.000 0.000 peak 3798 weight 0.10000E+01 volume -0.13280E+01 ppm1 3.154 ppm2 2.469 ASSI { 3800} (segid " " and resid "64 " and name "HA ") (segid " " and resid "64 " and name "HB2 ") 5.000 5.000 0.000 peak 3800 weight 0.10000E+01 volume -0.10340E+01 ppm1 3.154 ppm2 2.363 ASSI { 3797} (segid " " and resid "64 " and name "HA ") (segid " " and resid "64 " and name "HG2 ") 5.000 5.000 0.000 peak 3797 weight 0.10000E+01 volume -0.18490E+01 ppm1 3.154 ppm2 2.153 OR { 3797} (segid " " and resid "64 " and name "HA ") (segid " " and resid "64 " and name "HG1 ") ASSI { 3808} (segid " " and resid "64 " and name "HB1 ") (segid " " and resid "4 " and name "HE2 ") 5.000 5.000 0.000 peak 3808 weight 0.10000E+01 volume -0.38900E+00 ppm1 2.482 ppm2 7.265 OR { 3808} (segid " " and resid "64 " and name "HB1 ") (segid " " and resid "4 " and name "HE1 ") ASSI { 3817} (segid " " and resid "64 " and name "HG2 ") (segid " " and resid "4 " and name "HE1 ") 5.000 5.000 0.000 peak 3817 weight 0.10000E+01 volume -0.40700E+00 ppm1 2.126 ppm2 7.265 OR { 3817} (segid " " and resid "64 " and name "HG2 ") (segid " " and resid "4 " and name "HE2 ") OR { 3817} (segid " " and resid "64 " and name "HG1 ") (segid " " and resid "4 " and name "HE1 ") OR { 3817} (segid " " and resid "64 " and name "HG1 ") (segid " " and resid "4 " and name "HE2 ") ASSI { 6201} (segid " " and resid "64 " and name "HG2 ") (segid " " and resid "4 " and name "HZ ") 5.000 5.000 0.000 peak 6201 weight 0.10000E+01 volume -0.39400E+00 ppm1 2.144 ppm2 7.246 OR { 6201} (segid " " and resid "64 " and name "HG1 ") (segid " " and resid "4 " and name "HZ ") ASSI { 3816} (segid " " and resid "65 " and name "HA ") (segid " " and resid "65 " and name "HB1 ") 5.000 5.000 0.000 peak 3816 weight 0.10000E+01 volume -0.67200E+00 ppm1 4.603 ppm2 3.971 ASSI { 3818} (segid " " and resid "65 " and name "HA ") (segid " " and resid "65 " and name "HB2 ") 5.000 5.000 0.000 peak 3818 weight 0.10000E+01 volume -0.45300E+00 ppm1 4.603 ppm2 3.681 ASSI { 3826} (segid " " and resid "65 " and name "HB1 ") (segid " " and resid "45 " and name "HE1 ") 5.000 5.000 0.000 peak 3826 weight 0.10000E+01 volume -0.71200E+00 ppm1 3.971 ppm2 7.554 OR { 3826} (segid " " and resid "65 " and name "HB1 ") (segid " " and resid "45 " and name "HE2 ") ASSI { 3831} (segid " " and resid "65 " and name "HB2 ") (segid " " and resid "65 " and name "HB1 ") 2.700 2.700 0.000 peak 3831 weight 0.10000E+01 volume -0.41140E+01 ppm1 3.694 ppm2 3.971 ASSI { 3846} (segid " " and resid "66 " and name "HA ") (segid " " and resid "4 " and name "HD1 ") 6.000 6.000 0.000 peak 3846 weight 0.10000E+01 volume -0.23300E+00 ppm1 5.328 ppm2 7.054 OR { 3846} (segid " " and resid "66 " and name "HA ") (segid " " and resid "4 " and name "HD2 ") ASSI { 3843} (segid " " and resid "66 " and name "HA ") (segid " " and resid "66 " and name "HB ") 5.000 5.000 0.000 peak 3843 weight 0.10000E+01 volume -0.78200E+00 ppm1 5.341 ppm2 4.129 ASSI { 3845} (segid " " and resid "66 " and name "HA ") (segid " " and resid "67 " and name "HD12") 6.000 6.000 0.000 peak 3845 weight 0.10000E+01 volume -0.22900E+00 ppm1 5.328 ppm2 0.703 OR { 3845} (segid " " and resid "66 " and name "HA ") (segid " " and resid "67 " and name "HD11") OR { 3845} (segid " " and resid "66 " and name "HA ") (segid " " and resid "67 " and name "HD13") ASSI { 3859} (segid " " and resid "67 " and name "HB ") (segid " " and resid "67 " and name "HG11") 5.000 5.000 0.000 peak 3859 weight 0.10000E+01 volume -0.54500E+00 ppm1 1.863 ppm2 1.494 ASSI { 3861} (segid " " and resid "67 " and name "HB ") (segid " " and resid "67 " and name "HG12") 5.000 5.000 0.000 peak 3861 weight 0.10000E+01 volume -0.54400E+00 ppm1 1.863 ppm2 1.178 ASSI { 3926} (segid " " and resid "67 " and name "HD11") (segid " " and resid "5 " and name "HA ") 6.000 6.000 0.000 peak 3926 weight 0.10000E+01 volume -0.88000E-01 ppm1 0.690 ppm2 5.446 OR { 3926} (segid " " and resid "67 " and name "HD12") (segid " " and resid "5 " and name "HA ") OR { 3926} (segid " " and resid "67 " and name "HD13") (segid " " and resid "5 " and name "HA ") ASSI { 3929} (segid " " and resid "67 " and name "HD13") (segid " " and resid "26 " and name "HD2 ") 6.000 6.000 0.000 peak 3929 weight 0.10000E+01 volume -0.68000E-01 ppm1 0.703 ppm2 7.080 OR { 3929} (segid " " and resid "67 " and name "HD11") (segid " " and resid "26 " and name "HD2 ") OR { 3929} (segid " " and resid "67 " and name "HD12") (segid " " and resid "26 " and name "HD2 ") OR { 3929} (segid " " and resid "67 " and name "HD11") (segid " " and resid "26 " and name "HD1 ") OR { 3929} (segid " " and resid "67 " and name "HD12") (segid " " and resid "26 " and name "HD1 ") OR { 3929} (segid " " and resid "67 " and name "HD13") (segid " " and resid "26 " and name "HD1 ") ASSI { 3924} (segid " " and resid "67 " and name "HD13") (segid " " and resid "45 " and name "HA ") 6.000 6.000 0.000 peak 3924 weight 0.10000E+01 volume -0.80000E-01 ppm1 0.690 ppm2 5.209 OR { 3924} (segid " " and resid "67 " and name "HD12") (segid " " and resid "45 " and name "HA ") OR { 3924} (segid " " and resid "67 " and name "HD11") (segid " " and resid "45 " and name "HA ") ASSI { 3906} (segid " " and resid "67 " and name "HD12") (segid " " and resid "61 " and name "HG23") 3.300 3.300 0.000 peak 3906 weight 0.10000E+01 volume -0.21510E+01 ppm1 0.703 ppm2 0.334 OR { 3906} (segid " " and resid "67 " and name "HD12") (segid " " and resid "61 " and name "HG21") OR { 3906} (segid " " and resid "67 " and name "HD11") (segid " " and resid "61 " and name "HG22") OR { 3906} (segid " " and resid "67 " and name "HD13") (segid " " and resid "61 " and name "HG21") OR { 3906} (segid " " and resid "67 " and name "HD11") (segid " " and resid "61 " and name "HG21") OR { 3906} (segid " " and resid "67 " and name "HD13") (segid " " and resid "61 " and name "HG23") OR { 3906} (segid " " and resid "67 " and name "HD11") (segid " " and resid "61 " and name "HG23") OR { 3906} (segid " " and resid "67 " and name "HD13") (segid " " and resid "61 " and name "HG22") OR { 3906} (segid " " and resid "67 " and name "HD12") (segid " " and resid "61 " and name "HG22") ASSI { 3915} (segid " " and resid "67 " and name "HD12") (segid " " and resid "65 " and name "HB1 ") 5.000 5.000 0.000 peak 3915 weight 0.10000E+01 volume -0.30300E+00 ppm1 0.703 ppm2 3.971 OR { 3915} (segid " " and resid "67 " and name "HD13") (segid " " and resid "65 " and name "HB1 ") OR { 3915} (segid " " and resid "67 " and name "HD11") (segid " " and resid "65 " and name "HB1 ") ASSI { 3910} (segid " " and resid "67 " and name "HD12") (segid " " and resid "67 " and name "HG11") 5.000 5.000 0.000 peak 3910 weight 0.10000E+01 volume -0.10130E+01 ppm1 0.690 ppm2 1.494 OR { 3910} (segid " " and resid "67 " and name "HD13") (segid " " and resid "67 " and name "HG11") OR { 3910} (segid " " and resid "67 " and name "HD11") (segid " " and resid "67 " and name "HG11") ASSI { 3908} (segid " " and resid "67 " and name "HD11") (segid " " and resid "67 " and name "HG12") 5.000 5.000 0.000 peak 3908 weight 0.10000E+01 volume -0.11510E+01 ppm1 0.690 ppm2 1.178 OR { 3908} (segid " " and resid "67 " and name "HD12") (segid " " and resid "67 " and name "HG12") OR { 3908} (segid " " and resid "67 " and name "HD13") (segid " " and resid "67 " and name "HG12") ASSI { 3905} (segid " " and resid "67 " and name "HD12") (segid " " and resid "67 " and name "HG23") 5.000 5.000 0.000 peak 3905 weight 0.10000E+01 volume -0.17540E+01 ppm1 0.703 ppm2 0.967 OR { 3905} (segid " " and resid "67 " and name "HD11") (segid " " and resid "67 " and name "HG22") OR { 3905} (segid " " and resid "67 " and name "HD13") (segid " " and resid "67 " and name "HG23") OR { 3905} (segid " " and resid "67 " and name "HD13") (segid " " and resid "67 " and name "HG21") OR { 3905} (segid " " and resid "67 " and name "HD11") (segid " " and resid "67 " and name "HG21") OR { 3905} (segid " " and resid "67 " and name "HD12") (segid " " and resid "67 " and name "HG21") OR { 3905} (segid " " and resid "67 " and name "HD12") (segid " " and resid "67 " and name "HG22") OR { 3905} (segid " " and resid "67 " and name "HD11") (segid " " and resid "67 " and name "HG23") OR { 3905} (segid " " and resid "67 " and name "HD13") (segid " " and resid "67 " and name "HG22") ASSI { 3871} (segid " " and resid "67 " and name "HG11") (segid " " and resid "26 " and name "HZ ") 6.000 6.000 0.000 peak 3871 weight 0.10000E+01 volume -0.91000E-01 ppm1 1.507 ppm2 6.817 ASSI { 3884} (segid " " and resid "67 " and name "HG12") (segid " " and resid "45 " and name "HD2 ") 6.000 6.000 0.000 peak 3884 weight 0.10000E+01 volume -0.12800E+00 ppm1 1.191 ppm2 7.449 OR { 3884} (segid " " and resid "67 " and name "HG12") (segid " " and resid "45 " and name "HD1 ") ASSI { 3880} (segid " " and resid "67 " and name "HG12") (segid " " and resid "50 " and name "HD11") 6.000 6.000 0.000 peak 3880 weight 0.10000E+01 volume -0.23800E+00 ppm1 1.191 ppm2 0.572 OR { 3880} (segid " " and resid "67 " and name "HG12") (segid " " and resid "50 " and name "HD12") OR { 3880} (segid " " and resid "67 " and name "HG12") (segid " " and resid "50 " and name "HD13") ASSI { 3870} (segid " " and resid "67 " and name "HG11") (segid " " and resid "61 " and name "HD13") 6.000 6.000 0.000 peak 3870 weight 0.10000E+01 volume -0.20200E+00 ppm1 1.494 ppm2 0.387 OR { 3870} (segid " " and resid "67 " and name "HG11") (segid " " and resid "61 " and name "HD11") OR { 3870} (segid " " and resid "67 " and name "HG11") (segid " " and resid "61 " and name "HD12") ASSI { 3875} (segid " " and resid "67 " and name "HG12") (segid " " and resid "67 " and name "HG11") 3.300 3.300 0.000 peak 3875 weight 0.10000E+01 volume -0.23180E+01 ppm1 1.178 ppm2 1.494 ASSI { 3856} (segid " " and resid "67 " and name "HG11") (segid " " and resid "67 " and name "HG22") 5.000 5.000 0.000 peak 3856 weight 0.10000E+01 volume -0.66700E+00 ppm1 1.494 ppm2 0.967 OR { 3856} (segid " " and resid "67 " and name "HG11") (segid " " and resid "67 " and name "HG21") OR { 3856} (segid " " and resid "67 " and name "HG11") (segid " " and resid "67 " and name "HG23") ASSI { 3876} (segid " " and resid "67 " and name "HG12") (segid " " and resid "67 " and name "HG23") 5.000 5.000 0.000 peak 3876 weight 0.10000E+01 volume -0.96300E+00 ppm1 1.191 ppm2 0.967 OR { 3876} (segid " " and resid "67 " and name "HG12") (segid " " and resid "67 " and name "HG22") OR { 3876} (segid " " and resid "67 " and name "HG12") (segid " " and resid "67 " and name "HG21") ASSI { 3902} (segid " " and resid "67 " and name "HG22") (segid " " and resid "30 " and name "HD11") 6.000 6.000 0.000 peak 3902 weight 0.10000E+01 volume -0.75000E-01 ppm1 0.980 ppm2 0.045 OR { 3902} (segid " " and resid "67 " and name "HG21") (segid " " and resid "30 " and name "HD13") OR { 3902} (segid " " and resid "67 " and name "HG21") (segid " " and resid "30 " and name "HD12") OR { 3902} (segid " " and resid "67 " and name "HG22") (segid " " and resid "30 " and name "HD12") OR { 3902} (segid " " and resid "67 " and name "HG21") (segid " " and resid "30 " and name "HD11") OR { 3902} (segid " " and resid "67 " and name "HG23") (segid " " and resid "30 " and name "HD11") OR { 3902} (segid " " and resid "67 " and name "HG23") (segid " " and resid "30 " and name "HD12") OR { 3902} (segid " " and resid "67 " and name "HG22") (segid " " and resid "30 " and name "HD13") OR { 3902} (segid " " and resid "67 " and name "HG23") (segid " " and resid "30 " and name "HD13") ASSI { 3896} (segid " " and resid "67 " and name "HG21") (segid " " and resid "45 " and name "HB1 ") 5.000 5.000 0.000 peak 3896 weight 0.10000E+01 volume -0.33200E+00 ppm1 0.980 ppm2 2.943 OR { 3896} (segid " " and resid "67 " and name "HG22") (segid " " and resid "45 " and name "HB1 ") OR { 3896} (segid " " and resid "67 " and name "HG23") (segid " " and resid "45 " and name "HB1 ") ASSI { 3900} (segid " " and resid "67 " and name "HG21") (segid " " and resid "45 " and name "HB2 ") 6.000 6.000 0.000 peak 3900 weight 0.10000E+01 volume -0.13800E+00 ppm1 0.980 ppm2 2.811 OR { 3900} (segid " " and resid "67 " and name "HG23") (segid " " and resid "45 " and name "HB2 ") OR { 3900} (segid " " and resid "67 " and name "HG22") (segid " " and resid "45 " and name "HB2 ") ASSI { 3903} (segid " " and resid "67 " and name "HG23") (segid " " and resid "45 " and name "HD2 ") 6.000 6.000 0.000 peak 3903 weight 0.10000E+01 volume -0.86000E-01 ppm1 0.980 ppm2 7.449 OR { 3903} (segid " " and resid "67 " and name "HG21") (segid " " and resid "45 " and name "HD2 ") OR { 3903} (segid " " and resid "67 " and name "HG22") (segid " " and resid "45 " and name "HD1 ") OR { 3903} (segid " " and resid "67 " and name "HG22") (segid " " and resid "45 " and name "HD2 ") OR { 3903} (segid " " and resid "67 " and name "HG21") (segid " " and resid "45 " and name "HD1 ") OR { 3903} (segid " " and resid "67 " and name "HG23") (segid " " and resid "45 " and name "HD1 ") ASSI { 3897} (segid " " and resid "67 " and name "HG22") (segid " " and resid "61 " and name "HD11") 6.000 6.000 0.000 peak 3897 weight 0.10000E+01 volume -0.23300E+00 ppm1 0.980 ppm2 0.387 OR { 3897} (segid " " and resid "67 " and name "HG21") (segid " " and resid "61 " and name "HD11") OR { 3897} (segid " " and resid "67 " and name "HG22") (segid " " and resid "61 " and name "HD13") OR { 3897} (segid " " and resid "67 " and name "HG23") (segid " " and resid "61 " and name "HD13") OR { 3897} (segid " " and resid "67 " and name "HG23") (segid " " and resid "61 " and name "HD12") OR { 3897} (segid " " and resid "67 " and name "HG22") (segid " " and resid "61 " and name "HD12") OR { 3897} (segid " " and resid "67 " and name "HG23") (segid " " and resid "61 " and name "HD11") OR { 3897} (segid " " and resid "67 " and name "HG21") (segid " " and resid "61 " and name "HD13") OR { 3897} (segid " " and resid "67 " and name "HG21") (segid " " and resid "61 " and name "HD12") ASSI { 3882} (segid " " and resid "67 " and name "HG22") (segid " " and resid "67 " and name "HB ") 3.300 3.300 0.000 peak 3882 weight 0.10000E+01 volume -0.23550E+01 ppm1 0.980 ppm2 1.863 OR { 3882} (segid " " and resid "67 " and name "HG21") (segid " " and resid "67 " and name "HB ") OR { 3882} (segid " " and resid "67 " and name "HG23") (segid " " and resid "67 " and name "HB ") ASSI { 3919} (segid " " and resid "68 " and name "HA ") (segid " " and resid "68 " and name "HB1 ") 3.300 3.300 0.000 peak 3919 weight 0.10000E+01 volume -0.21020E+01 ppm1 4.999 ppm2 3.075 OR { 3919} (segid " " and resid "68 " and name "HA ") (segid " " and resid "68 " and name "HB2 ") ASSI { 3937} (segid " " and resid "68 " and name "HA ") (segid " " and resid "68 " and name "HD2 ") 6.000 6.000 0.000 peak 3937 weight 0.10000E+01 volume -0.14600E+00 ppm1 4.999 ppm2 7.054 ASSI { 3944} (segid " " and resid "68 " and name "HD2 ") (segid " " and resid "68 " and name "HB2 ") 5.000 5.000 0.000 peak 3944 weight 0.10000E+01 volume -0.30100E+00 ppm1 7.067 ppm2 3.101 OR { 3944} (segid " " and resid "68 " and name "HD2 ") (segid " " and resid "68 " and name "HB1 ") ASSI { 3960} (segid " " and resid "69 " and name "HA ") (segid " " and resid "69 " and name "HB1 ") 5.000 5.000 0.000 peak 3960 weight 0.10000E+01 volume -0.10500E+01 ppm1 5.078 ppm2 1.836 ASSI { 3959} (segid " " and resid "69 " and name "HA ") (segid " " and resid "69 " and name "HB2 ") 5.000 5.000 0.000 peak 3959 weight 0.10000E+01 volume -0.14450E+01 ppm1 5.078 ppm2 1.257 ASSI { 3958} (segid " " and resid "69 " and name "HA ") (segid " " and resid "69 " and name "HD12") 3.300 3.300 0.000 peak 3958 weight 0.10000E+01 volume -0.21220E+01 ppm1 5.078 ppm2 0.835 OR { 3958} (segid " " and resid "69 " and name "HA ") (segid " " and resid "69 " and name "HD13") OR { 3958} (segid " " and resid "69 " and name "HA ") (segid " " and resid "69 " and name "HD11") ASSI { 3962} (segid " " and resid "69 " and name "HA ") (segid " " and resid "69 " and name "HG ") 5.000 5.000 0.000 peak 3962 weight 0.10000E+01 volume -0.64800E+00 ppm1 5.078 ppm2 1.415 ASSI { 3965} (segid " " and resid "69 " and name "HB2 ") (segid " " and resid "69 " and name "HB1 ") 3.300 3.300 0.000 peak 3965 weight 0.10000E+01 volume -0.29690E+01 ppm1 1.257 ppm2 1.836 ASSI { 3966} (segid " " and resid "69 " and name "HB1 ") (segid " " and resid "69 " and name "HD21") 5.000 5.000 0.000 peak 3966 weight 0.10000E+01 volume -0.14820E+01 ppm1 1.836 ppm2 0.782 OR { 3966} (segid " " and resid "69 " and name "HB1 ") (segid " " and resid "69 " and name "HD23") OR { 3966} (segid " " and resid "69 " and name "HB1 ") (segid " " and resid "69 " and name "HD22") ASSI { 3970} (segid " " and resid "69 " and name "HB2 ") (segid " " and resid "69 " and name "HD21") 5.000 5.000 0.000 peak 3970 weight 0.10000E+01 volume -0.17490E+01 ppm1 1.257 ppm2 0.782 OR { 3970} (segid " " and resid "69 " and name "HB2 ") (segid " " and resid "69 " and name "HD22") OR { 3970} (segid " " and resid "69 " and name "HB2 ") (segid " " and resid "69 " and name "HD23") ASSI { 3967} (segid " " and resid "69 " and name "HB1 ") (segid " " and resid "69 " and name "HG ") 5.000 5.000 0.000 peak 3967 weight 0.10000E+01 volume -0.10710E+01 ppm1 1.836 ppm2 1.415 ASSI { 3971} (segid " " and resid "69 " and name "HB2 ") (segid " " and resid "69 " and name "HG ") 5.000 5.000 0.000 peak 3971 weight 0.10000E+01 volume -0.12210E+01 ppm1 1.257 ppm2 1.415 ASSI { 3986} (segid " " and resid "69 " and name "HD13") (segid " " and resid "30 " and name "HG23") 5.000 5.000 0.000 peak 3986 weight 0.10000E+01 volume -0.75300E+00 ppm1 0.848 ppm2 0.519 OR { 3986} (segid " " and resid "69 " and name "HD12") (segid " " and resid "30 " and name "HG23") OR { 3986} (segid " " and resid "69 " and name "HD12") (segid " " and resid "30 " and name "HG21") OR { 3986} (segid " " and resid "69 " and name "HD13") (segid " " and resid "30 " and name "HG21") OR { 3986} (segid " " and resid "69 " and name "HD11") (segid " " and resid "30 " and name "HG22") OR { 3986} (segid " " and resid "69 " and name "HD13") (segid " " and resid "30 " and name "HG22") OR { 3986} (segid " " and resid "69 " and name "HD11") (segid " " and resid "30 " and name "HG21") OR { 3986} (segid " " and resid "69 " and name "HD11") (segid " " and resid "30 " and name "HG23") OR { 3986} (segid " " and resid "69 " and name "HD12") (segid " " and resid "30 " and name "HG22") ASSI { 3985} (segid " " and resid "69 " and name "HD13") (segid " " and resid "41 " and name "HA ") 5.000 5.000 0.000 peak 3985 weight 0.10000E+01 volume -0.11520E+01 ppm1 0.848 ppm2 4.103 OR { 3985} (segid " " and resid "69 " and name "HD12") (segid " " and resid "41 " and name "HA ") OR { 3985} (segid " " and resid "69 " and name "HD11") (segid " " and resid "41 " and name "HA ") ASSI { 3989} (segid " " and resid "69 " and name "HD12") (segid " " and resid "41 " and name "HG1 ") 5.000 5.000 0.000 peak 3989 weight 0.10000E+01 volume -0.47400E+00 ppm1 0.848 ppm2 2.495 OR { 3989} (segid " " and resid "69 " and name "HD11") (segid " " and resid "41 " and name "HG1 ") OR { 3989} (segid " " and resid "69 " and name "HD13") (segid " " and resid "41 " and name "HG1 ") ASSI { 3987} (segid " " and resid "69 " and name "HD12") (segid " " and resid "41 " and name "HG2 ") 5.000 5.000 0.000 peak 3987 weight 0.10000E+01 volume -0.12380E+01 ppm1 0.848 ppm2 1.599 OR { 3987} (segid " " and resid "69 " and name "HD11") (segid " " and resid "41 " and name "HG2 ") OR { 3987} (segid " " and resid "69 " and name "HD13") (segid " " and resid "41 " and name "HG2 ") ASSI { 3983} (segid " " and resid "69 " and name "HD13") (segid " " and resid "69 " and name "HB1 ") 5.000 5.000 0.000 peak 3983 weight 0.10000E+01 volume -0.14490E+01 ppm1 0.848 ppm2 1.810 OR { 3983} (segid " " and resid "69 " and name "HD11") (segid " " and resid "69 " and name "HB1 ") OR { 3983} (segid " " and resid "69 " and name "HD12") (segid " " and resid "69 " and name "HB1 ") ASSI { 3984} (segid " " and resid "69 " and name "HD11") (segid " " and resid "69 " and name "HB2 ") 5.000 5.000 0.000 peak 3984 weight 0.10000E+01 volume -0.12080E+01 ppm1 0.848 ppm2 1.257 OR { 3984} (segid " " and resid "69 " and name "HD13") (segid " " and resid "69 " and name "HB2 ") OR { 3984} (segid " " and resid "69 " and name "HD12") (segid " " and resid "69 " and name "HB2 ") ASSI { 3981} (segid " " and resid "69 " and name "HD12") (segid " " and resid "69 " and name "HG ") 3.300 3.300 0.000 peak 3981 weight 0.10000E+01 volume -0.20100E+01 ppm1 0.848 ppm2 1.415 OR { 3981} (segid " " and resid "69 " and name "HD13") (segid " " and resid "69 " and name "HG ") OR { 3981} (segid " " and resid "69 " and name "HD11") (segid " " and resid "69 " and name "HG ") ASSI { 4000} (segid " " and resid "69 " and name "HD22") (segid " " and resid "7 " and name "HG23") 5.000 5.000 0.000 peak 4000 weight 0.10000E+01 volume -0.83100E+00 ppm1 0.796 ppm2 1.151 OR { 4000} (segid " " and resid "69 " and name "HD21") (segid " " and resid "7 " and name "HG23") OR { 4000} (segid " " and resid "69 " and name "HD23") (segid " " and resid "7 " and name "HG22") OR { 4000} (segid " " and resid "69 " and name "HD23") (segid " " and resid "7 " and name "HG23") OR { 4000} (segid " " and resid "69 " and name "HD21") (segid " " and resid "7 " and name "HG22") OR { 4000} (segid " " and resid "69 " and name "HD23") (segid " " and resid "7 " and name "HG21") OR { 4000} (segid " " and resid "69 " and name "HD21") (segid " " and resid "7 " and name "HG21") OR { 4000} (segid " " and resid "69 " and name "HD22") (segid " " and resid "7 " and name "HG21") OR { 4000} (segid " " and resid "69 " and name "HD22") (segid " " and resid "7 " and name "HG22") ASSI { 3998} (segid " " and resid "69 " and name "HD23") (segid " " and resid "30 " and name "HG22") 5.000 5.000 0.000 peak 3998 weight 0.10000E+01 volume -0.86000E+00 ppm1 0.796 ppm2 0.519 OR { 3998} (segid " " and resid "69 " and name "HD22") (segid " " and resid "30 " and name "HG22") OR { 3998} (segid " " and resid "69 " and name "HD21") (segid " " and resid "30 " and name "HG23") OR { 3998} (segid " " and resid "69 " and name "HD22") (segid " " and resid "30 " and name "HG23") OR { 3998} (segid " " and resid "69 " and name "HD22") (segid " " and resid "30 " and name "HG21") OR { 3998} (segid " " and resid "69 " and name "HD23") (segid " " and resid "30 " and name "HG21") OR { 3998} (segid " " and resid "69 " and name "HD21") (segid " " and resid "30 " and name "HG22") OR { 3998} (segid " " and resid "69 " and name "HD21") (segid " " and resid "30 " and name "HG21") OR { 3998} (segid " " and resid "69 " and name "HD23") (segid " " and resid "30 " and name "HG23") ASSI { 3997} (segid " " and resid "69 " and name "HD21") (segid " " and resid "69 " and name "HG ") 5.000 5.000 0.000 peak 3997 weight 0.10000E+01 volume -0.19140E+01 ppm1 0.796 ppm2 1.415 OR { 3997} (segid " " and resid "69 " and name "HD22") (segid " " and resid "69 " and name "HG ") OR { 3997} (segid " " and resid "69 " and name "HD23") (segid " " and resid "69 " and name "HG ") ASSI { 4016} (segid " " and resid "70 " and name "HA ") (segid " " and resid "8 " and name "HG ") 6.000 6.000 0.000 peak 4016 weight 0.10000E+01 volume -0.15500E+00 ppm1 4.392 ppm2 1.836 ASSI { 4014} (segid " " and resid "70 " and name "HA ") (segid " " and resid "69 " and name "HG ") 6.000 6.000 0.000 peak 4014 weight 0.10000E+01 volume -0.20800E+00 ppm1 4.379 ppm2 1.415 ASSI { 4012} (segid " " and resid "70 " and name "HA ") (segid " " and resid "70 " and name "HG23") 5.000 5.000 0.000 peak 4012 weight 0.10000E+01 volume -0.15640E+01 ppm1 4.379 ppm2 0.809 OR { 4012} (segid " " and resid "70 " and name "HA ") (segid " " and resid "70 " and name "HG21") OR { 4012} (segid " " and resid "70 " and name "HA ") (segid " " and resid "70 " and name "HG22") ASSI { 4011} (segid " " and resid "70 " and name "HB ") (segid " " and resid "70 " and name "HG21") 5.000 5.000 0.000 peak 4011 weight 0.10000E+01 volume -0.11820E+01 ppm1 2.074 ppm2 0.809 OR { 4011} (segid " " and resid "70 " and name "HB ") (segid " " and resid "70 " and name "HG22") OR { 4011} (segid " " and resid "70 " and name "HB ") (segid " " and resid "70 " and name "HG23") ASSI { 4037} (segid " " and resid "70 " and name "HG22") (segid " " and resid "68 " and name "HB1 ") 5.000 5.000 0.000 peak 4037 weight 0.10000E+01 volume -0.91400E+00 ppm1 0.809 ppm2 3.075 OR { 4037} (segid " " and resid "70 " and name "HG23") (segid " " and resid "68 " and name "HB1 ") OR { 4037} (segid " " and resid "70 " and name "HG22") (segid " " and resid "68 " and name "HB2 ") OR { 4037} (segid " " and resid "70 " and name "HG23") (segid " " and resid "68 " and name "HB2 ") OR { 4037} (segid " " and resid "70 " and name "HG21") (segid " " and resid "68 " and name "HB1 ") OR { 4037} (segid " " and resid "70 " and name "HG21") (segid " " and resid "68 " and name "HB2 ") ASSI { 4051} (segid " " and resid "70 " and name "HG21") (segid " " and resid "69 " and name "HA ") 6.000 6.000 0.000 peak 4051 weight 0.10000E+01 volume -0.11600E+00 ppm1 0.809 ppm2 5.078 OR { 4051} (segid " " and resid "70 " and name "HG22") (segid " " and resid "69 " and name "HA ") OR { 4051} (segid " " and resid "70 " and name "HG23") (segid " " and resid "69 " and name "HA ") ASSI { 4068} (segid " " and resid "71 " and name "HB2 ") (segid " " and resid "71 " and name "HA ") 5.000 5.000 0.000 peak 4068 weight 0.10000E+01 volume -0.15030E+01 ppm1 1.599 ppm2 4.761 OR { 4068} (segid " " and resid "71 " and name "HB1 ") (segid " " and resid "71 " and name "HA ") ASSI { 4074} (segid " " and resid "72 " and name "HA ") (segid " " and resid "72 " and name "HB1 ") 5.000 5.000 0.000 peak 4074 weight 0.10000E+01 volume -0.11170E+01 ppm1 4.221 ppm2 1.731 ASSI { 6362} (segid " " and resid "72 " and name "HA ") (segid " " and resid "72 " and name "HG2 ") 3.300 3.300 0.000 peak 6362 weight 0.10000E+01 volume -0.25810E+01 ppm1 4.216 ppm2 1.486 OR { 6362} (segid " " and resid "72 " and name "HA ") (segid " " and resid "72 " and name "HG1 ") ASSI { 3174} (segid " " and resid "72 " and name "HB2 ") (segid " " and resid "72 " and name "HB1 ") 2.700 2.700 0.000 peak 3174 weight 0.10000E+01 volume -0.42790E+01 ppm1 1.507 ppm2 1.731 ASSI { 4098} (segid " " and resid "73 " and name "HA ") (segid " " and resid "73 " and name "HB1 ") 5.000 5.000 0.000 peak 4098 weight 0.10000E+01 volume -0.11870E+01 ppm1 4.379 ppm2 1.626 ASSI { 4097} (segid " " and resid "73 " and name "HA ") (segid " " and resid "73 " and name "HB2 ") 5.000 5.000 0.000 peak 4097 weight 0.10000E+01 volume -0.14120E+01 ppm1 4.379 ppm2 1.573 ASSI { 4096} (segid " " and resid "73 " and name "HA ") (segid " " and resid "73 " and name "HD21") 5.000 5.000 0.000 peak 4096 weight 0.10000E+01 volume -0.12270E+01 ppm1 4.379 ppm2 0.861 OR { 4096} (segid " " and resid "73 " and name "HA ") (segid " " and resid "73 " and name "HD22") OR { 4096} (segid " " and resid "73 " and name "HA ") (segid " " and resid "73 " and name "HD23") ASSI { 4100} (segid " " and resid "73 " and name "HB1 ") (segid " " and resid "73 " and name "HB2 ") 2.700 2.700 0.000 peak 4100 weight 0.10000E+01 volume -0.99130E+01 ppm1 1.652 ppm2 1.573 ASSI { 4112} (segid " " and resid "74 " and name "HA ") (segid " " and resid "74 " and name "HB1 ") 5.000 5.000 0.000 peak 4112 weight 0.10000E+01 volume -0.69800E+00 ppm1 4.300 ppm2 1.863 ASSI { 3493} (segid " " and resid "76 " and name "HA2 ") (segid " " and resid "76 " and name "HA1 ") 2.700 2.700 0.000 peak 3493 weight 0.10000E+01 volume -0.20255E+02 ppm1 3.721 ppm2 3.813 ASSI { 6192} (segid " " and resid "4 " and name "HE2 ") (segid " " and resid "64 " and name "HB2 ") 5.000 5.000 0.000 peak 6192 weight 0.10000E+01 volume 0.62900E+00 ppm1 7.269 ppm2 2.357 OR { 6192} (segid " " and resid "4 " and name "HE1 ") (segid " " and resid "64 " and name "HB2 ") ASSI { 5213} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "26 " and name "HE2 ") 2.700 2.700 0.000 peak 5213 weight 0.10000E+01 volume 0.12012E+02 ppm1 7.080 ppm2 6.891 OR { 5213} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "26 " and name "HE1 ") OR { 5213} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "26 " and name "HE1 ") OR { 5213} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "26 " and name "HE2 ") ASSI { 5802} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "50 " and name "HD13") 5.000 5.000 0.000 peak 5802 weight 0.10000E+01 volume 0.39500E+00 ppm1 7.076 ppm2 0.570 OR { 5802} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "50 " and name "HD12") OR { 5802} (segid " " and resid "26 " and name "HD2 ") (segid " " and resid "50 " and name "HD11") OR { 5802} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "50 " and name "HD12") OR { 5802} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "50 " and name "HD13") OR { 5802} (segid " " and resid "26 " and name "HD1 ") (segid " " and resid "50 " and name "HD11") ASSI { 4634} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "5 " and name "HD22") 5.000 5.000 0.000 peak 4634 weight 0.10000E+01 volume 0.72200E+00 ppm1 6.889 ppm2 0.683 OR { 4634} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "5 " and name "HD23") OR { 4634} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "5 " and name "HD21") OR { 4634} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "5 " and name "HD22") OR { 4634} (segid " " and resid "26 " and name "HE1 ") (segid " " and resid "5 " and name "HD21") OR { 4634} (segid " " and resid "26 " and name "HE2 ") (segid " " and resid "5 " and name "HD23") ASSI { 4635} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "5 " and name "HD23") 5.000 5.000 0.000 peak 4635 weight 0.10000E+01 volume 0.32700E+00 ppm1 6.811 ppm2 0.683 OR { 4635} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "5 " and name "HD22") OR { 4635} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "5 " and name "HD21") ASSI { 5344} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "30 " and name "HD12") 5.000 5.000 0.000 peak 5344 weight 0.10000E+01 volume 0.33400E+00 ppm1 6.811 ppm2 0.044 OR { 5344} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "30 " and name "HD11") OR { 5344} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "30 " and name "HD13") ASSI { 6241} (segid " " and resid "26 " and name "HZ ") (segid " " and resid "67 " and name "HB ") 5.000 5.000 0.000 peak 6241 weight 0.10000E+01 volume -0.51500E+00 ppm1 6.809 ppm2 1.848 ASSI { 5735} (segid " " and resid "45 " and name "HD2 ") (segid " " and resid "45 " and name "HE2 ") 2.700 2.700 0.000 peak 5735 weight 0.10000E+01 volume 0.72220E+01 ppm1 7.447 ppm2 7.551 OR { 5735} (segid " " and resid "45 " and name "HD1 ") (segid " " and resid "45 " and name "HE1 ") OR { 5735} (segid " " and resid "45 " and name "HD1 ") (segid " " and resid "45 " and name "HE2 ") OR { 5735} (segid " " and resid "45 " and name "HD2 ") (segid " " and resid "45 " and name "HE1 ") ASSI { 6208} (segid " " and resid "45 " and name "HD1 ") (segid " " and resid "65 " and name "HB1 ") 6.000 6.000 0.000 peak 6208 weight 0.10000E+01 volume 0.26600E+00 ppm1 7.443 ppm2 3.969 OR { 6208} (segid " " and resid "45 " and name "HD2 ") (segid " " and resid "65 " and name "HB1 ") ASSI { 6226} (segid " " and resid "45 " and name "HD1 ") (segid " " and resid "65 " and name "HB2 ") 6.000 6.000 0.000 peak 6226 weight 0.10000E+01 volume 0.96000E-01 ppm1 7.447 ppm2 3.689 OR { 6226} (segid " " and resid "45 " and name "HD2 ") (segid " " and resid "65 " and name "HB2 ") ASSI { 6293} (segid " " and resid "45 " and name "HD1 ") (segid " " and resid "67 " and name "HD13") 5.000 5.000 0.000 peak 6293 weight 0.10000E+01 volume 0.34000E+00 ppm1 7.453 ppm2 0.694 OR { 6293} (segid " " and resid "45 " and name "HD1 ") (segid " " and resid "67 " and name "HD11") OR { 6293} (segid " " and resid "45 " and name "HD2 ") (segid " " and resid "67 " and name "HD12") OR { 6293} (segid " " and resid "45 " and name "HD1 ") (segid " " and resid "67 " and name "HD12") OR { 6293} (segid " " and resid "45 " and name "HD2 ") (segid " " and resid "67 " and name "HD11") OR { 6293} (segid " " and resid "45 " and name "HD2 ") (segid " " and resid "67 " and name "HD13") ASSI { 6224} (segid " " and resid "45 " and name "HE1 ") (segid " " and resid "65 " and name "HB2 ") 5.000 5.000 0.000 peak 6224 weight 0.10000E+01 volume 0.33100E+00 ppm1 7.542 ppm2 3.689 OR { 6224} (segid " " and resid "45 " and name "HE2 ") (segid " " and resid "65 " and name "HB2 ") ASSI { 6209} (segid " " and resid "45 " and name "HZ ") (segid " " and resid "65 " and name "HB1 ") 5.000 5.000 0.000 peak 6209 weight 0.10000E+01 volume 0.31100E+00 ppm1 7.439 ppm2 3.969 ASSI { 6225} (segid " " and resid "45 " and name "HZ ") (segid " " and resid "65 " and name "HB2 ") 6.000 6.000 0.000 peak 6225 weight 0.10000E+01 volume 0.14500E+00 ppm1 7.441 ppm2 3.689 ASSI { 5801} (segid " " and resid "59 " and name "HD2 ") (segid " " and resid "50 " and name "HD13") 5.000 5.000 0.000 peak 5801 weight 0.10000E+01 volume 0.30000E+00 ppm1 7.271 ppm2 0.570 OR { 5801} (segid " " and resid "59 " and name "HD2 ") (segid " " and resid "50 " and name "HD12") OR { 5801} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "50 " and name "HD12") OR { 5801} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "50 " and name "HD11") OR { 5801} (segid " " and resid "59 " and name "HD2 ") (segid " " and resid "50 " and name "HD11") OR { 5801} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "50 " and name "HD13") ASSI { 5886} (segid " " and resid "59 " and name "HD2 ") (segid " " and resid "54 " and name "HB1 ") 5.000 5.000 0.000 peak 5886 weight 0.10000E+01 volume 0.50700E+00 ppm1 7.269 ppm2 2.372 OR { 5886} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "54 " and name "HB1 ") OR { 5886} (segid " " and resid "59 " and name "HD2 ") (segid " " and resid "54 " and name "HB2 ") OR { 5886} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "54 " and name "HB2 ") ASSI { 5967} (segid " " and resid "59 " and name "HD2 ") (segid " " and resid "56 " and name "HD21") 5.000 5.000 0.000 peak 5967 weight 0.10000E+01 volume 0.73100E+00 ppm1 7.268 ppm2 0.304 OR { 5967} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "56 " and name "HD23") OR { 5967} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "56 " and name "HD21") OR { 5967} (segid " " and resid "59 " and name "HD2 ") (segid " " and resid "56 " and name "HD23") OR { 5967} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "56 " and name "HD22") OR { 5967} (segid " " and resid "59 " and name "HD2 ") (segid " " and resid "56 " and name "HD22") ASSI { 6011} (segid " " and resid "59 " and name "HD2 ") (segid " " and resid "59 " and name "HA ") 3.300 3.300 0.000 peak 6011 weight 0.10000E+01 volume -0.21390E+01 ppm1 7.262 ppm2 4.512 OR { 6011} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "59 " and name "HA ") ASSI { 6018} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "59 " and name "HB1 ") 3.300 3.300 0.000 peak 6018 weight 0.10000E+01 volume -0.21820E+01 ppm1 7.268 ppm2 3.503 OR { 6018} (segid " " and resid "59 " and name "HD2 ") (segid " " and resid "59 " and name "HB1 ") ASSI { 6028} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "59 " and name "HB2 ") 3.300 3.300 0.000 peak 6028 weight 0.10000E+01 volume -0.24060E+01 ppm1 7.264 ppm2 2.627 OR { 6028} (segid " " and resid "59 " and name "HD2 ") (segid " " and resid "59 " and name "HB2 ") ASSI { 6061} (segid " " and resid "59 " and name "HD2 ") (segid " " and resid "59 " and name "HE2 ") 2.700 2.700 0.000 peak 6061 weight 0.10000E+01 volume 0.71810E+01 ppm1 7.270 ppm2 6.864 OR { 6061} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "59 " and name "HE1 ") OR { 6061} (segid " " and resid "59 " and name "HD2 ") (segid " " and resid "59 " and name "HE1 ") OR { 6061} (segid " " and resid "59 " and name "HD1 ") (segid " " and resid "59 " and name "HE2 ") ASSI { 5109} (segid " " and resid "59 " and name "HE2 ") (segid " " and resid "23 " and name "HG22") 3.300 3.300 0.000 peak 5109 weight 0.10000E+01 volume 0.25610E+01 ppm1 6.862 ppm2 1.052 OR { 5109} (segid " " and resid "59 " and name "HE1 ") (segid " " and resid "23 " and name "HG23") OR { 5109} (segid " " and resid "59 " and name "HE2 ") (segid " " and resid "23 " and name "HG21") OR { 5109} (segid " " and resid "59 " and name "HE1 ") (segid " " and resid "23 " and name "HG22") OR { 5109} (segid " " and resid "59 " and name "HE2 ") (segid " " and resid "23 " and name "HG23") OR { 5109} (segid " " and resid "59 " and name "HE1 ") (segid " " and resid "23 " and name "HG21") ASSI { 5896} (segid " " and resid "59 " and name "HE2 ") (segid " " and resid "54 " and name "HD1 ") 5.000 5.000 0.000 peak 5896 weight 0.10000E+01 volume -0.60100E+00 ppm1 6.861 ppm2 3.192 OR { 5896} (segid " " and resid "59 " and name "HE2 ") (segid " " and resid "54 " and name "HD2 ") OR { 5896} (segid " " and resid "59 " and name "HE1 ") (segid " " and resid "54 " and name "HD1 ") OR { 5896} (segid " " and resid "59 " and name "HE1 ") (segid " " and resid "54 " and name "HD2 ") ASSI { 6002} (segid " " and resid "59 " and name "HE2 ") (segid " " and resid "58 " and name "HB2 ") 5.000 5.000 0.000 peak 6002 weight 0.10000E+01 volume -0.33300E+00 ppm1 6.858 ppm2 3.013 OR { 6002} (segid " " and resid "59 " and name "HE1 ") (segid " " and resid "58 " and name "HB2 ") ASSI { 4444} (segid " " and resid "1 " and name "HA ") (segid " " and resid "1 " and name "HB2 ") 3.300 3.300 0.000 peak 4444 weight 0.10000E+01 volume 0.20990E+01 ppm1 4.177 ppm2 2.018 ASSI { 4483} (segid " " and resid "1 " and name "HB2 ") (segid " " and resid "1 " and name "HE1 ") 6.000 6.000 0.000 peak 4483 weight 0.10000E+01 volume -0.28600E+00 ppm1 2.016 ppm2 1.519 OR { 4483} (segid " " and resid "1 " and name "HB2 ") (segid " " and resid "1 " and name "HE3 ") OR { 4483} (segid " " and resid "1 " and name "HB2 ") (segid " " and resid "1 " and name "HE2 ") ASSI { 6218} (segid " " and resid "3 " and name "HG21") (segid " " and resid "65 " and name "HB2 ") 6.000 6.000 0.000 peak 6218 weight 0.10000E+01 volume 0.82000E-01 ppm1 0.584 ppm2 3.689 OR { 6218} (segid " " and resid "3 " and name "HG22") (segid " " and resid "65 " and name "HB2 ") OR { 6218} (segid " " and resid "3 " and name "HG23") (segid " " and resid "65 " and name "HB2 ") ASSI { 4765} (segid " " and resid "7 " and name "HG21") (segid " " and resid "11 " and name "HB1 ") 5.000 5.000 0.000 peak 4765 weight 0.10000E+01 volume -0.71800E+00 ppm1 1.164 ppm2 1.787 OR { 4765} (segid " " and resid "7 " and name "HG22") (segid " " and resid "11 " and name "HB1 ") OR { 4765} (segid " " and resid "7 " and name "HG23") (segid " " and resid "11 " and name "HB1 ") ASSI { 4776} (segid " " and resid "11 " and name "HG1 ") (segid " " and resid "11 " and name "HD1 ") 2.700 2.700 0.000 peak 4776 weight 0.10000E+01 volume 0.47060E+01 ppm1 1.417 ppm2 1.639 OR { 4776} (segid " " and resid "11 " and name "HG1 ") (segid " " and resid "11 " and name "HD2 ") ASSI { 4774} (segid " " and resid "11 " and name "HG1 ") (segid " " and resid "11 " and name "HG2 ") 2.700 2.700 0.000 peak 4774 weight 0.10000E+01 volume 0.11061E+02 ppm1 1.437 ppm2 1.273 ASSI { 4827} (segid " " and resid "13 " and name "HB ") (segid " " and resid "13 " and name "HG23") 3.300 3.300 0.000 peak 4827 weight 0.10000E+01 volume -0.24020E+01 ppm1 2.145 ppm2 0.884 OR { 4827} (segid " " and resid "13 " and name "HB ") (segid " " and resid "13 " and name "HG21") OR { 4827} (segid " " and resid "13 " and name "HB ") (segid " " and resid "13 " and name "HG22") ASSI { 5393} (segid " " and resid "15 " and name "HD12") (segid " " and resid "33 " and name "HB2 ") 5.000 5.000 0.000 peak 5393 weight 0.10000E+01 volume -0.76100E+00 ppm1 0.666 ppm2 1.857 OR { 5393} (segid " " and resid "15 " and name "HD11") (segid " " and resid "33 " and name "HB2 ") OR { 5393} (segid " " and resid "15 " and name "HD13") (segid " " and resid "33 " and name "HB2 ") ASSI { 4946} (segid " " and resid "15 " and name "HG23") (segid " " and resid "17 " and name "HG11") 3.300 3.300 0.000 peak 4946 weight 0.10000E+01 volume 0.21820E+01 ppm1 0.938 ppm2 0.641 OR { 4946} (segid " " and resid "15 " and name "HG23") (segid " " and resid "17 " and name "HG13") OR { 4946} (segid " " and resid "15 " and name "HG22") (segid " " and resid "17 " and name "HG13") OR { 4946} (segid " " and resid "15 " and name "HG22") (segid " " and resid "17 " and name "HG12") OR { 4946} (segid " " and resid "15 " and name "HG23") (segid " " and resid "17 " and name "HG12") OR { 4946} (segid " " and resid "15 " and name "HG22") (segid " " and resid "17 " and name "HG11") OR { 4946} (segid " " and resid "15 " and name "HG21") (segid " " and resid "17 " and name "HG12") OR { 4946} (segid " " and resid "15 " and name "HG21") (segid " " and resid "17 " and name "HG13") OR { 4946} (segid " " and resid "15 " and name "HG21") (segid " " and resid "17 " and name "HG11") ASSI { 5201} (segid " " and resid "17 " and name "HG11") (segid " " and resid "26 " and name "HD1 ") 5.000 5.000 0.000 peak 5201 weight 0.10000E+01 volume 0.70800E+00 ppm1 0.643 ppm2 7.077 OR { 5201} (segid " " and resid "17 " and name "HG12") (segid " " and resid "26 " and name "HD1 ") OR { 5201} (segid " " and resid "17 " and name "HG13") (segid " " and resid "26 " and name "HD1 ") OR { 5201} (segid " " and resid "17 " and name "HG11") (segid " " and resid "26 " and name "HD2 ") OR { 5201} (segid " " and resid "17 " and name "HG13") (segid " " and resid "26 " and name "HD2 ") OR { 5201} (segid " " and resid "17 " and name "HG12") (segid " " and resid "26 " and name "HD2 ") ASSI { 4443} (segid " " and resid "17 " and name "HG22") (segid " " and resid "1 " and name "HB1 ") 5.000 5.000 0.000 peak 4443 weight 0.10000E+01 volume -0.31000E+00 ppm1 0.376 ppm2 2.123 OR { 4443} (segid " " and resid "17 " and name "HG21") (segid " " and resid "1 " and name "HB1 ") OR { 4443} (segid " " and resid "17 " and name "HG23") (segid " " and resid "1 " and name "HB1 ") ASSI { 4984} (segid " " and resid "18 " and name "HB2 ") (segid " " and resid "18 " and name "HB1 ") 2.700 2.700 0.000 peak 4984 weight 0.10000E+01 volume 0.51020E+01 ppm1 1.654 ppm2 2.099 ASSI { 4983} (segid " " and resid "18 " and name "HG2 ") (segid " " and resid "18 " and name "HB1 ") 3.300 3.300 0.000 peak 4983 weight 0.10000E+01 volume -0.23700E+01 ppm1 2.221 ppm2 2.099 ASSI { 5974} (segid " " and resid "19 " and name "HA ") (segid " " and resid "56 " and name "HD22") 6.000 6.000 0.000 peak 5974 weight 0.10000E+01 volume 0.87000E-01 ppm1 3.987 ppm2 0.304 OR { 5974} (segid " " and resid "19 " and name "HA ") (segid " " and resid "56 " and name "HD21") OR { 5974} (segid " " and resid "19 " and name "HA ") (segid " " and resid "56 " and name "HD23") ASSI { 6000} (segid " " and resid "19 " and name "HG2 ") (segid " " and resid "57 " and name "HB1 ") 6.000 6.000 0.000 peak 6000 weight 0.10000E+01 volume 0.12300E+00 ppm1 2.013 ppm2 3.757 ASSI { 5845} (segid " " and resid "23 " and name "HG11") (segid " " and resid "51 " and name "HA ") 5.000 5.000 0.000 peak 5845 weight 0.10000E+01 volume -0.39300E+00 ppm1 0.836 ppm2 4.592 OR { 5845} (segid " " and resid "23 " and name "HG12") (segid " " and resid "51 " and name "HA ") OR { 5845} (segid " " and resid "23 " and name "HG13") (segid " " and resid "51 " and name "HA ") ASSI { 5584} (segid " " and resid "27 " and name "HE1 ") (segid " " and resid "41 " and name "HB2 ") 5.000 5.000 0.000 peak 5584 weight 0.10000E+01 volume -0.31800E+00 ppm1 2.748 ppm2 1.924 ASSI { 6336} (segid " " and resid "30 " and name "HD11") (segid " " and resid "69 " and name "HD12") 3.300 3.300 0.000 peak 6336 weight 0.10000E+01 volume 0.34860E+01 ppm1 0.045 ppm2 0.842 OR { 6336} (segid " " and resid "30 " and name "HD12") (segid " " and resid "69 " and name "HD13") OR { 6336} (segid " " and resid "30 " and name "HD11") (segid " " and resid "69 " and name "HD11") OR { 6336} (segid " " and resid "30 " and name "HD13") (segid " " and resid "69 " and name "HD13") OR { 6336} (segid " " and resid "30 " and name "HD12") (segid " " and resid "69 " and name "HD12") OR { 6336} (segid " " and resid "30 " and name "HD13") (segid " " and resid "69 " and name "HD11") OR { 6336} (segid " " and resid "30 " and name "HD12") (segid " " and resid "69 " and name "HD11") OR { 6336} (segid " " and resid "30 " and name "HD11") (segid " " and resid "69 " and name "HD13") OR { 6336} (segid " " and resid "30 " and name "HD13") (segid " " and resid "69 " and name "HD12") ASSI { 5390} (segid " " and resid "33 " and name "HA ") (segid " " and resid "33 " and name "HB1 ") 3.300 3.300 0.000 peak 5390 weight 0.10000E+01 volume 0.22510E+01 ppm1 4.311 ppm2 1.925 ASSI { 5509} (segid " " and resid "37 " and name "HA ") (segid " " and resid "37 " and name "HD2 ") 5.000 5.000 0.000 peak 5509 weight 0.10000E+01 volume -0.36800E+00 ppm1 4.607 ppm2 3.551 ASSI { 5482} (segid " " and resid "37 " and name "HB2 ") (segid " " and resid "37 " and name "HB1 ") 2.700 2.700 0.000 peak 5482 weight 0.10000E+01 volume 0.47740E+01 ppm1 1.952 ppm2 2.408 ASSI { 5553} (segid " " and resid "39 " and name "HA ") (segid " " and resid "39 " and name "HB2 ") 2.700 2.700 0.000 peak 5553 weight 0.10000E+01 volume 0.40600E+01 ppm1 4.391 ppm2 2.656 ASSI { 6359} (segid " " and resid "40 " and name "HB1 ") (segid " " and resid "71 " and name "HD11") 5.000 5.000 0.000 peak 6359 weight 0.10000E+01 volume 0.37000E+00 ppm1 2.469 ppm2 0.976 OR { 6359} (segid " " and resid "40 " and name "HB1 ") (segid " " and resid "71 " and name "HD13") OR { 6359} (segid " " and resid "40 " and name "HB1 ") (segid " " and resid "71 " and name "HD12") ASSI { 5593} (segid " " and resid "41 " and name "HB2 ") (segid " " and resid "41 " and name "HG1 ") 5.000 5.000 0.000 peak 5593 weight 0.10000E+01 volume -0.63800E+00 ppm1 1.932 ppm2 2.488 ASSI { 5636} (segid " " and resid "43 " and name "HA ") (segid " " and resid "43 " and name "HD12") 5.000 5.000 0.000 peak 5636 weight 0.10000E+01 volume -0.31400E+00 ppm1 5.353 ppm2 0.787 OR { 5636} (segid " " and resid "43 " and name "HA ") (segid " " and resid "43 " and name "HD11") OR { 5636} (segid " " and resid "43 " and name "HA ") (segid " " and resid "43 " and name "HD13") ASSI { 4073} (segid " " and resid "43 " and name "HA ") (segid " " and resid "69 " and name "HD12") 5.000 5.000 0.000 peak 4073 weight 0.10000E+01 volume -0.19580E+01 ppm1 5.342 ppm2 0.842 OR { 4073} (segid " " and resid "43 " and name "HA ") (segid " " and resid "69 " and name "HD13") OR { 4073} (segid " " and resid "43 " and name "HA ") (segid " " and resid "69 " and name "HD11") ASSI { 2361} (segid " " and resid "43 " and name "HD11") (segid " " and resid "50 " and name "HB2 ") 6.000 6.000 0.000 peak 2361 weight 0.10000E+01 volume -0.25600E+00 ppm1 0.786 ppm2 1.526 OR { 2361} (segid " " and resid "43 " and name "HD12") (segid " " and resid "50 " and name "HB2 ") OR { 2361} (segid " " and resid "43 " and name "HD13") (segid " " and resid "50 " and name "HB2 ") ASSI { 5586} (segid " " and resid "43 " and name "HD22") (segid " " and resid "41 " and name "HB2 ") 5.000 5.000 0.000 peak 5586 weight 0.10000E+01 volume 0.49700E+00 ppm1 0.748 ppm2 1.924 OR { 5586} (segid " " and resid "43 " and name "HD23") (segid " " and resid "41 " and name "HB2 ") OR { 5586} (segid " " and resid "43 " and name "HD21") (segid " " and resid "41 " and name "HB2 ") ASSI { 6303} (segid " " and resid "44 " and name "HB ") (segid " " and resid "68 " and name "HB2 ") 3.300 3.300 0.000 peak 6303 weight 0.10000E+01 volume -0.21640E+01 ppm1 1.776 ppm2 3.092 OR { 6303} (segid " " and resid "44 " and name "HB ") (segid " " and resid "68 " and name "HB1 ") ASSI { 5761} (segid " " and resid "44 " and name "HD11") (segid " " and resid "49 " and name "HA ") 5.000 5.000 0.000 peak 5761 weight 0.10000E+01 volume -0.10950E+01 ppm1 0.657 ppm2 4.894 OR { 5761} (segid " " and resid "44 " and name "HD13") (segid " " and resid "49 " and name "HA ") OR { 5761} (segid " " and resid "44 " and name "HD12") (segid " " and resid "49 " and name "HA ") ASSI { 5709} (segid " " and resid "45 " and name "HB2 ") (segid " " and resid "45 " and name "HB1 ") 2.700 2.700 0.000 peak 5709 weight 0.10000E+01 volume 0.45570E+01 ppm1 2.804 ppm2 2.943 ASSI { 5749} (segid " " and resid "47 " and name "HA2 ") (segid " " and resid "47 " and name "HA1 ") 2.700 2.700 0.000 peak 5749 weight 0.10000E+01 volume 0.52490E+01 ppm1 3.467 ppm2 4.115 ASSI { 5626} (segid " " and resid "50 " and name "HB1 ") (segid " " and resid "43 " and name "HB2 ") 5.000 5.000 0.000 peak 5626 weight 0.10000E+01 volume 0.31400E+00 ppm1 1.222 ppm2 1.736 ASSI { 5868} (segid " " and resid "52 " and name "HB1 ") (segid " " and resid "52 " and name "HB2 ") 2.700 2.700 0.000 peak 5868 weight 0.10000E+01 volume 0.70980E+01 ppm1 2.672 ppm2 2.496 ASSI { 5081} (segid " " and resid "55 " and name "HA ") (segid " " and resid "22 " and name "HB ") 5.000 5.000 0.000 peak 5081 weight 0.10000E+01 volume 0.38000E+00 ppm1 5.240 ppm2 4.823 ASSI { 5905} (segid " " and resid "55 " and name "HA ") (segid " " and resid "55 " and name "HG22") 3.300 3.300 0.000 peak 5905 weight 0.10000E+01 volume 0.21950E+01 ppm1 5.231 ppm2 1.153 OR { 5905} (segid " " and resid "55 " and name "HA ") (segid " " and resid "55 " and name "HG23") OR { 5905} (segid " " and resid "55 " and name "HA ") (segid " " and resid "55 " and name "HG21") ASSI { 5829} (segid " " and resid "56 " and name "HA ") (segid " " and resid "50 " and name "HD23") 5.000 5.000 0.000 peak 5829 weight 0.10000E+01 volume -0.91000E+00 ppm1 4.050 ppm2 0.149 OR { 5829} (segid " " and resid "56 " and name "HA ") (segid " " and resid "50 " and name "HD21") OR { 5829} (segid " " and resid "56 " and name "HA ") (segid " " and resid "50 " and name "HD22") ASSI { 5210} (segid " " and resid "56 " and name "HD13") (segid " " and resid "26 " and name "HD1 ") 6.000 6.000 0.000 peak 5210 weight 0.10000E+01 volume 0.19800E+00 ppm1 0.410 ppm2 7.077 OR { 5210} (segid " " and resid "56 " and name "HD12") (segid " " and resid "26 " and name "HD1 ") OR { 5210} (segid " " and resid "56 " and name "HD11") (segid " " and resid "26 " and name "HD2 ") OR { 5210} (segid " " and resid "56 " and name "HD13") (segid " " and resid "26 " and name "HD2 ") OR { 5210} (segid " " and resid "56 " and name "HD12") (segid " " and resid "26 " and name "HD2 ") OR { 5210} (segid " " and resid "56 " and name "HD11") (segid " " and resid "26 " and name "HD1 ") ASSI { 6004} (segid " " and resid "58 " and name "HB1 ") (segid " " and resid "58 " and name "HB2 ") 2.700 2.700 0.000 peak 6004 weight 0.10000E+01 volume 0.43490E+01 ppm1 2.310 ppm2 3.013 ASSI { 5714} (segid " " and resid "61 " and name "HD12") (segid " " and resid "45 " and name "HB2 ") 5.000 5.000 0.000 peak 5714 weight 0.10000E+01 volume -0.35600E+00 ppm1 0.385 ppm2 2.807 OR { 5714} (segid " " and resid "61 " and name "HD13") (segid " " and resid "45 " and name "HB2 ") OR { 5714} (segid " " and resid "61 " and name "HD11") (segid " " and resid "45 " and name "HB2 ") ASSI { 4446} (segid " " and resid "63 " and name "HA ") (segid " " and resid "1 " and name "HB2 ") 5.000 5.000 0.000 peak 4446 weight 0.10000E+01 volume 0.16560E+01 ppm1 3.931 ppm2 2.018 ASSI { 6170} (segid " " and resid "63 " and name "HA ") (segid " " and resid "63 " and name "HG2 ") 5.000 5.000 0.000 peak 6170 weight 0.10000E+01 volume -0.53900E+00 ppm1 3.932 ppm2 1.418 ASSI { 6176} (segid " " and resid "63 " and name "HD1 ") (segid " " and resid "63 " and name "HG2 ") 3.300 3.300 0.000 peak 6176 weight 0.10000E+01 volume 0.39120E+01 ppm1 1.719 ppm2 1.418 OR { 6176} (segid " " and resid "63 " and name "HD2 ") (segid " " and resid "63 " and name "HG2 ") ASSI { 6169} (segid " " and resid "63 " and name "HG2 ") (segid " " and resid "63 " and name "HG1 ") 2.700 2.700 0.000 peak 6169 weight 0.10000E+01 volume 0.20414E+02 ppm1 1.415 ppm2 1.532 ASSI { 6190} (segid " " and resid "64 " and name "HB2 ") (segid " " and resid "64 " and name "HB1 ") 2.700 2.700 0.000 peak 6190 weight 0.10000E+01 volume 0.45500E+01 ppm1 2.345 ppm2 2.477 ASSI { 6198} (segid " " and resid "64 " and name "HB2 ") (segid " " and resid "64 " and name "HG1 ") 3.300 3.300 0.000 peak 6198 weight 0.10000E+01 volume -0.23820E+01 ppm1 2.356 ppm2 2.144 OR { 6198} (segid " " and resid "64 " and name "HB2 ") (segid " " and resid "64 " and name "HG2 ") ASSI { 6191} (segid " " and resid "64 " and name "HG2 ") (segid " " and resid "64 " and name "HB1 ") 3.300 3.300 0.000 peak 6191 weight 0.10000E+01 volume -0.28950E+01 ppm1 2.133 ppm2 2.477 OR { 6191} (segid " " and resid "64 " and name "HG1 ") (segid " " and resid "64 " and name "HB1 ") ASSI { 6219} (segid " " and resid "67 " and name "HD12") (segid " " and resid "65 " and name "HB2 ") 5.000 5.000 0.000 peak 6219 weight 0.10000E+01 volume 0.32400E+00 ppm1 0.698 ppm2 3.689 OR { 6219} (segid " " and resid "67 " and name "HD13") (segid " " and resid "65 " and name "HB2 ") OR { 6219} (segid " " and resid "67 " and name "HD11") (segid " " and resid "65 " and name "HB2 ") ASSI { 5707} (segid " " and resid "67 " and name "HG12") (segid " " and resid "45 " and name "HB1 ") 5.000 5.000 0.000 peak 5707 weight 0.10000E+01 volume -0.31200E+00 ppm1 1.180 ppm2 2.943 ASSI { 6337} (segid " " and resid "69 " and name "HA ") (segid " " and resid "69 " and name "HD21") 5.000 5.000 0.000 peak 6337 weight 0.10000E+01 volume -0.32900E+00 ppm1 5.070 ppm2 0.785 OR { 6337} (segid " " and resid "69 " and name "HA ") (segid " " and resid "69 " and name "HD22") OR { 6337} (segid " " and resid "69 " and name "HA ") (segid " " and resid "69 " and name "HD23") ASSI { 5603} (segid " " and resid "70 " and name "HG21") (segid " " and resid "42 " and name "HB2 ") 5.000 5.000 0.000 peak 5603 weight 0.10000E+01 volume 0.72000E+00 ppm1 0.804 ppm2 1.515 OR { 5603} (segid " " and resid "70 " and name "HG22") (segid " " and resid "42 " and name "HB2 ") OR { 5603} (segid " " and resid "70 " and name "HG23") (segid " " and resid "42 " and name "HB2 ") ASSI { 4727} (segid " " and resid "71 " and name "HB2 ") (segid " " and resid "8 " and name "HD11") 3.300 3.300 0.000 peak 4727 weight 0.10000E+01 volume -0.20000E+01 ppm1 1.593 ppm2 1.019 OR { 4727} (segid " " and resid "71 " and name "HB2 ") (segid " " and resid "8 " and name "HD13") OR { 4727} (segid " " and resid "71 " and name "HB2 ") (segid " " and resid "8 " and name "HD12") OR { 4727} (segid " " and resid "71 " and name "HB1 ") (segid " " and resid "8 " and name "HD12") OR { 4727} (segid " " and resid "71 " and name "HB1 ") (segid " " and resid "8 " and name "HD11") OR { 4727} (segid " " and resid "71 " and name "HB1 ") (segid " " and resid "8 " and name "HD13")
Contact the webmaster for help, if required. Saturday, May 11, 2024 8:14:06 AM GMT (wattos1)