!!index array str "NDP" !entry.NDP.unit.atoms table str name str type int typex int resx int flags int seq int elmnt dbl chg "P1" "P" 0 1 131072 1 15 0.942647 "O1" "O2" 0 1 131072 2 8 -0.730357 "O2" "O2" 0 1 131072 3 8 -0.730357 "O3" "OS" 0 1 131072 4 8 -0.356772 "C1" "CT" 0 1 131072 5 6 -0.006696 "C2" "CT" 0 1 131072 6 6 0.079414 "O4" "OS" 0 1 131072 7 8 -0.392815 "C3" "CT" 0 1 131072 8 6 0.117029 "O5" "OH" 0 1 131072 9 8 -0.642890 "C4" "CT" 0 1 131072 10 6 0.102985 "O6" "OH" 0 1 131072 11 8 -0.632214 "C5" "CT" 0 1 131072 12 6 0.061272 "N1" "N*" 0 1 131072 13 7 0.017819 "C6" "CK" 0 1 131072 14 6 0.062362 "N2" "NB" 0 1 131072 15 7 -0.636127 "C7" "CB" 0 1 131072 16 6 0.145792 "C8" "CA" 0 1 131073 17 6 0.647257 "N3" "N2" 0 1 131073 18 7 -0.868126 "N4" "NC" 0 1 131073 19 7 -0.758996 "C9" "CQ" 0 1 131073 20 6 0.531962 "N5" "NC" 0 1 131073 21 7 -0.753252 "C10" "CB" 0 1 131072 22 6 0.410247 "O7" "OS" 0 1 131072 23 8 -0.418002 "P2" "P" 0 1 131072 24 15 1.277833 "O8" "O2" 0 1 131072 25 8 -0.807507 "O9" "O2" 0 1 131072 26 8 -0.807507 "O10" "OS" 0 1 131072 27 8 -0.590561 "C11" "CT" 0 1 131072 28 6 0.030900 "C12" "CT" 0 1 131072 29 6 0.099200 "O11" "OS" 0 1 131072 30 8 -0.369200 "C13" "CT" 0 1 131072 31 6 0.138200 "O12" "OH" 0 1 131072 32 8 -0.682600 "C14" "CT" 0 1 131072 33 6 0.124400 "O13" "OH" 0 1 131072 34 8 -0.641700 "C15" "CT" 0 1 131072 35 6 0.028100 "N6" "NF" 0 1 131072 36 7 0.097406 "C16" "CJ" 0 1 131072 37 6 -0.015928 "C17" "CF" 0 1 131072 38 6 -0.045985 "C18" "CE" 0 1 131072 39 6 0.645560 "O14" "OE" 0 1 131072 40 8 -0.550549 "N7" "NE" 0 1 131072 41 7 -0.787937 "C19" "CI" 0 1 131072 42 6 -0.036230 "C20" "CF" 0 1 131072 43 6 -0.130438 "C21" "CJ" 0 1 131072 44 6 0.086229 "H51" "H1" 0 1 131072 45 1 0.057653 "H52" "H1" 0 1 131072 46 1 0.057653 "H53" "H1" 0 1 131072 47 1 0.163921 "H54" "H1" 0 1 131072 48 1 0.147030 "H55" "HO" 0 1 131072 49 1 0.446050 "H56" "H1" 0 1 131072 50 1 0.058324 "H57" "HO" 0 1 131072 51 1 0.409390 "H58" "H2" 0 1 131072 52 1 0.169012 "H60" "H5" 0 1 131072 53 1 0.222942 "H64" "H" 0 1 131073 54 1 0.390845 "H65" "H" 0 1 131073 55 1 0.390845 "H67" "H5" 0 1 131073 56 1 0.078343 "H73" "H1" 0 1 131072 57 1 0.110331 "H74" "H1" 0 1 131072 58 1 0.110331 "H75" "H1" 0 1 131072 59 1 0.079368 "H76" "H1" 0 1 131072 60 1 0.123780 "H77" "HO" 0 1 131072 61 1 0.447120 "H78" "H1" 0 1 131072 62 1 0.168179 "H79" "HO" 0 1 131072 63 1 0.430437 "H80" "H2" 0 1 131072 64 1 0.179115 "H92" "HI" 0 1 131072 65 1 0.147976 "H86" "HE" 0 1 131072 66 1 0.379646 "H87" "HE" 0 1 131072 67 1 0.379646 "H90" "HI" 0 1 131072 68 1 0.187624 "H89" "HI" 0 1 131072 69 1 0.183325 "H81" "HI" 0 1 131072 70 1 0.227144 !entry.NDP.unit.atomspertinfo table str pname str ptype int ptypex int pelmnt dbl pchg "P1" "P" 0 -1 0.0 "O1" "O2" 0 -1 0.0 "O2" "O2" 0 -1 0.0 "O3" "OS" 0 -1 0.0 "C1" "CT" 0 -1 0.0 "C2" "CT" 0 -1 0.0 "O4" "OS" 0 -1 0.0 "C3" "CT" 0 -1 0.0 "O5" "OH" 0 -1 0.0 "C4" "CT" 0 -1 0.0 "O6" "OH" 0 -1 0.0 "C5" "CT" 0 -1 0.0 "N1" "N*" 0 -1 0.0 "C6" "CK" 0 -1 0.0 "N2" "NB" 0 -1 0.0 "C7" "CB" 0 -1 0.0 "C8" "CA" 0 -1 0.0 "N3" "N2" 0 -1 0.0 "N4" "NC" 0 -1 0.0 "C9" "CQ" 0 -1 0.0 "N5" "NC" 0 -1 0.0 "C10" "CB" 0 -1 0.0 "O7" "OS" 0 -1 0.0 "P2" "P" 0 -1 0.0 "O8" "O2" 0 -1 0.0 "O9" "O2" 0 -1 0.0 "O10" "OS" 0 -1 0.0 "C11" "CT" 0 -1 0.0 "C12" "CT" 0 -1 0.0 "O11" "OS" 0 -1 0.0 "C13" "CT" 0 -1 0.0 "O12" "OH" 0 -1 0.0 "C14" "CT" 0 -1 0.0 "O13" "OH" 0 -1 0.0 "C15" "CT" 0 -1 0.0 "N6" "NF" 0 -1 0.0 "C16" "CJ" 0 -1 0.0 "C17" "CF" 0 -1 0.0 "C18" "CE" 0 -1 0.0 "O14" "OE" 0 -1 0.0 "N7" "NE" 0 -1 0.0 "C19" "CI" 0 -1 0.0 "C20" "CF" 0 -1 0.0 "C21" "CJ" 0 -1 0.0 "H51" "H1" 0 -1 0.0 "H52" "H1" 0 -1 0.0 "H53" "H1" 0 -1 0.0 "H54" "H1" 0 -1 0.0 "H55" "HO" 0 -1 0.0 "H56" "H1" 0 -1 0.0 "H57" "HO" 0 -1 0.0 "H58" "H2" 0 -1 0.0 "H60" "H5" 0 -1 0.0 "H64" "H" 0 -1 0.0 "H65" "H" 0 -1 0.0 "H67" "H5" 0 -1 0.0 "H73" "H1" 0 -1 0.0 "H74" "H1" 0 -1 0.0 "H75" "H1" 0 -1 0.0 "H76" "H1" 0 -1 0.0 "H77" "HO" 0 -1 0.0 "H78" "H1" 0 -1 0.0 "H79" "HO" 0 -1 0.0 "H80" "H2" 0 -1 0.0 "H92" "HI" 0 -1 0.0 "H86" "HE" 0 -1 0.0 "H87" "HE" 0 -1 0.0 "H90" "HI" 0 -1 0.0 "H89" "HI" 0 -1 0.0 "H81" "HI" 0 -1 0.0 !entry.NDP.unit.boundbox array dbl -1.000000 0.0 0.0 0.0 0.0 !entry.NDP.unit.childsequence single int 2 !entry.NDP.unit.connect array int 0 0 !entry.NDP.unit.connectivity table int atom1x int atom2x int flags 1 23 1 1 2 1 1 3 1 1 4 1 4 5 1 5 6 1 5 45 1 5 46 1 6 8 1 6 7 1 6 47 1 7 12 1 8 10 1 8 9 1 8 48 1 9 49 1 10 12 1 10 50 1 10 11 1 11 51 1 12 52 1 12 13 1 13 14 1 13 22 1 14 53 1 14 15 1 15 16 1 16 22 1 16 17 1 17 19 1 17 18 1 18 54 1 18 55 1 19 20 1 20 21 1 20 56 1 21 22 1 23 24 1 24 27 1 24 25 1 24 26 1 27 28 1 28 29 1 28 58 1 28 57 1 29 30 1 29 31 1 29 59 1 30 35 1 31 33 1 31 32 1 31 60 1 32 61 1 33 35 1 33 34 1 33 62 1 34 63 1 35 36 1 35 64 1 36 44 1 36 37 1 37 38 1 37 65 1 38 39 1 38 42 1 39 41 1 39 40 1 41 66 1 41 67 1 42 43 1 42 68 1 43 44 1 43 69 1 44 70 1 !entry.NDP.unit.hierarchy table str abovetype int abovex str belowtype int belowx "U" 0 "R" 1 "R" 1 "A" 1 "R" 1 "A" 2 "R" 1 "A" 3 "R" 1 "A" 4 "R" 1 "A" 5 "R" 1 "A" 6 "R" 1 "A" 7 "R" 1 "A" 8 "R" 1 "A" 9 "R" 1 "A" 10 "R" 1 "A" 11 "R" 1 "A" 12 "R" 1 "A" 13 "R" 1 "A" 14 "R" 1 "A" 15 "R" 1 "A" 16 "R" 1 "A" 17 "R" 1 "A" 18 "R" 1 "A" 19 "R" 1 "A" 20 "R" 1 "A" 21 "R" 1 "A" 22 "R" 1 "A" 23 "R" 1 "A" 24 "R" 1 "A" 25 "R" 1 "A" 26 "R" 1 "A" 27 "R" 1 "A" 28 "R" 1 "A" 29 "R" 1 "A" 30 "R" 1 "A" 31 "R" 1 "A" 32 "R" 1 "A" 33 "R" 1 "A" 34 "R" 1 "A" 35 "R" 1 "A" 36 "R" 1 "A" 37 "R" 1 "A" 38 "R" 1 "A" 39 "R" 1 "A" 40 "R" 1 "A" 41 "R" 1 "A" 42 "R" 1 "A" 43 "R" 1 "A" 44 "R" 1 "A" 45 "R" 1 "A" 46 "R" 1 "A" 47 "R" 1 "A" 48 "R" 1 "A" 49 "R" 1 "A" 50 "R" 1 "A" 51 "R" 1 "A" 52 "R" 1 "A" 53 "R" 1 "A" 54 "R" 1 "A" 55 "R" 1 "A" 56 "R" 1 "A" 57 "R" 1 "A" 58 "R" 1 "A" 59 "R" 1 "A" 60 "R" 1 "A" 61 "R" 1 "A" 62 "R" 1 "A" 63 "R" 1 "A" 64 "R" 1 "A" 65 "R" 1 "A" 66 "R" 1 "A" 67 "R" 1 "A" 68 "R" 1 "A" 69 "R" 1 "A" 70 !entry.NDP.unit.name single str "" !entry.NDP.unit.positions table dbl x dbl y dbl z -2.698000 4.180000 -1.104000 -3.659000 4.658000 -0.119000 -2.527000 5.021000 -2.282000 -3.244000 2.642000 -1.213000 -2.991000 1.674000 -2.208000 -4.248000 0.896000 -2.593000 -4.693000 -0.075000 -1.649000 -5.474000 1.777000 -2.860000 -5.757000 1.925000 -4.253000 -6.644000 1.018000 -2.238000 -7.878000 1.077000 -2.973000 -6.019000 -0.349000 -2.115000 -6.768000 -1.302000 -1.281000 -7.182000 -1.144000 -0.011000 -7.710000 -2.288000 0.458000 -7.598000 -3.121000 -0.564000 -7.979000 -4.453000 -0.540000 -8.549000 -5.017000 0.523000 -7.743000 -5.119000 -1.679000 -7.195000 -4.567000 -2.767000 -6.838000 -3.286000 -2.782000 -7.028000 -2.545000 -1.671000 -1.318000 4.025000 -0.411000 0.189000 4.189000 -0.810000 0.674000 5.512000 -0.420000 0.447000 3.748000 -2.197000 0.816000 3.189000 0.321000 0.476000 1.787000 0.337000 0.977000 1.069000 1.585000 2.405000 1.179000 1.506000 0.578000 1.718000 2.905000 0.352000 0.796000 3.988000 1.780000 2.582000 3.237000 1.825000 2.996000 4.608000 2.866000 1.651000 2.780000 4.185000 2.238000 2.573000 5.315000 1.540000 2.990000 6.589000 2.021000 2.703000 7.834000 1.261000 3.117000 8.888000 1.861000 3.172000 7.740000 -0.022000 3.392000 6.716000 3.222000 2.009000 5.582000 3.927000 1.602000 4.305000 3.500000 1.969000 -2.218000 0.986000 -1.868000 -2.632000 2.192000 -3.097000 -4.030000 0.355000 -3.514000 -5.365000 2.752000 -2.385000 -6.558000 2.446000 -4.348000 -6.812000 1.404000 -1.233000 -8.536000 0.557000 -2.506000 -5.939000 -0.771000 -3.116000 -7.112000 -0.223000 0.549000 -8.711000 -4.470000 1.358000 -8.810000 -5.993000 0.497000 -7.048000 -5.168000 -3.650000 0.898000 1.307000 -0.546000 -0.609000 1.694000 0.300000 0.668000 0.025000 1.569000 -0.309000 2.337000 2.769000 0.149000 1.300000 4.780000 1.776000 3.460000 2.591000 2.620000 3.516000 4.743000 2.936000 0.816000 3.477000 5.200000 0.596000 3.543000 6.869000 -0.202000 3.849000 8.494000 -0.290000 3.992000 7.717000 3.622000 1.789000 5.696000 4.835000 0.992000 3.420000 4.126000 1.782000 !entry.NDP.unit.residueconnect table int c1x int c2x int c3x int c4x int c5x int c6x 0 0 0 0 0 0 !entry.NDP.unit.residues table str name int seq int childseq int startatomx str restype int imagingx "NDP" 1 73 1 "?" 0 !entry.NDP.unit.residuesPdbSequenceNumber array int 1 !entry.NDP.unit.solventcap array dbl -1.000000 0.0 0.0 0.0 0.0 !entry.NDP.unit.velocities table dbl x dbl y dbl z 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0