!!index array str "U01" !entry.U01.unit.atoms table str name str type int typex int resx int flags int seq int elmnt dbl chg "C15" "c" 0 1 131075 7 6 0.635534 "O3" "o" 0 1 131075 8 8 -0.565955 "C1" "c3" 0 1 131075 9 6 -0.047631 "H1" "h1" 0 1 131075 10 1 0.101429 "N4" "ns" 0 1 131075 11 7 -0.514435 "H30" "hn" 0 1 131075 18 1 0.314611 "C2" "c3" 0 1 131075 19 6 -0.172074 "H2" "hc" 0 1 131075 20 1 0.097895 "H3" "hc" 0 1 131075 21 1 0.097895 "C3" "cc" 0 1 131075 22 6 0.438664 "C4" "cd" 0 1 131075 23 6 -0.443249 "H4" "h4" 0 1 131075 24 1 0.212231 "N1" "nc" 0 1 131075 25 7 -0.696969 "C5" "cd" 0 1 131075 26 6 0.256055 "H5" "h5" 0 1 131075 27 1 0.141296 "N2" "na" 0 1 131075 28 7 -0.031507 "C6" "c3" 0 1 131075 29 6 0.158221 "H6" "h1" 0 1 131075 30 1 0.077892 "C8" "c3" 0 1 131075 31 6 -0.236038 "H8" "hc" 0 1 131075 32 1 0.079342 "H9" "hc" 0 1 131075 33 1 0.079342 "C9" "c3" 0 1 131075 34 6 0.529093 "O1" "os" 0 1 131075 35 8 -0.531623 "H10" "h2" 0 1 131075 36 1 0.029469 "O2" "oh" 0 1 131075 37 8 -0.742994 "H11" "ho" 0 1 131075 38 1 0.462957 "C7" "c3" 0 1 131075 39 6 0.286277 "H7" "h1" 0 1 131075 40 1 0.000702 "C10" "c3" 0 1 131075 41 6 -0.145712 "H12" "hc" 0 1 131075 42 1 0.023477 "H13" "hc" 0 1 131075 43 1 0.023477 "C11" "c3" 0 1 131075 44 6 0.114157 "H14" "hc" 0 1 131075 45 1 -0.013233 "H15" "hc" 0 1 131075 46 1 -0.013233 "C12" "c3" 0 1 131075 47 6 -0.051889 "H16" "hc" 0 1 131075 48 1 0.016315 "H17" "hc" 0 1 131075 49 1 0.016315 "C13" "c3" 0 1 131075 50 6 0.106467 "H18" "hc" 0 1 131075 51 1 -0.015315 "H19" "hc" 0 1 131075 52 1 -0.015315 "C14" "c3" 0 1 131075 53 6 -0.188866 "H20" "hc" 0 1 131075 54 1 0.042308 "H21" "hc" 0 1 131075 55 1 0.042308 "H22" "hc" 0 1 131075 56 1 0.042308 !entry.U01.unit.atomspertinfo table str pname str ptype int ptypex int pelmnt dbl pchg "C15" "c" 0 -1 0.0 "O3" "o" 0 -1 0.0 "C1" "c3" 0 -1 0.0 "H1" "h1" 0 -1 0.0 "N4" "ns" 0 -1 0.0 "H30" "hn" 0 -1 0.0 "C2" "c3" 0 -1 0.0 "H2" "hc" 0 -1 0.0 "H3" "hc" 0 -1 0.0 "C3" "cc" 0 -1 0.0 "C4" "cd" 0 -1 0.0 "H4" "h4" 0 -1 0.0 "N1" "nc" 0 -1 0.0 "C5" "cd" 0 -1 0.0 "H5" "h5" 0 -1 0.0 "N2" "na" 0 -1 0.0 "C6" "c3" 0 -1 0.0 "H6" "h1" 0 -1 0.0 "C8" "c3" 0 -1 0.0 "H8" "hc" 0 -1 0.0 "H9" "hc" 0 -1 0.0 "C9" "c3" 0 -1 0.0 "O1" "os" 0 -1 0.0 "H10" "h2" 0 -1 0.0 "O2" "oh" 0 -1 0.0 "H11" "ho" 0 -1 0.0 "C7" "c3" 0 -1 0.0 "H7" "h1" 0 -1 0.0 "C10" "c3" 0 -1 0.0 "H12" "hc" 0 -1 0.0 "H13" "hc" 0 -1 0.0 "C11" "c3" 0 -1 0.0 "H14" "hc" 0 -1 0.0 "H15" "hc" 0 -1 0.0 "C12" "c3" 0 -1 0.0 "H16" "hc" 0 -1 0.0 "H17" "hc" 0 -1 0.0 "C13" "c3" 0 -1 0.0 "H18" "hc" 0 -1 0.0 "H19" "hc" 0 -1 0.0 "C14" "c3" 0 -1 0.0 "H20" "hc" 0 -1 0.0 "H21" "hc" 0 -1 0.0 "H22" "hc" 0 -1 0.0 !entry.U01.unit.boundbox array dbl -1.000000 0.0 0.0 0.0 0.0 !entry.U01.unit.childsequence single int 2 !entry.U01.unit.connect array int 5 1 !entry.U01.unit.connectivity table int atom1x int atom2x int flags 1 2 1 1 3 1 3 4 1 3 5 1 3 7 1 5 6 1 7 8 1 7 9 1 7 10 1 10 11 1 10 13 1 11 12 1 11 16 1 13 14 1 14 15 1 14 16 1 16 17 1 17 18 1 17 19 1 17 27 1 19 20 1 19 21 1 19 22 1 22 23 1 22 24 1 22 25 1 23 27 1 25 26 1 27 28 1 27 29 1 29 30 1 29 31 1 29 32 1 32 33 1 32 34 1 32 35 1 35 36 1 35 37 1 35 38 1 38 39 1 38 40 1 38 41 1 41 42 1 41 43 1 41 44 1 !entry.U01.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 !entry.U01.unit.name single str "U01" !entry.U01.unit.positions table dbl x dbl y dbl z 5.049583 2.611420 1.493773 5.848598 2.809398 0.613771 5.309665 3.115528 2.920117 6.025537 3.919328 2.820147 4.094477 3.589637 3.560232 3.787466 3.117645 4.384230 5.909525 2.019719 3.818947 5.923537 2.408644 4.831748 5.242509 1.162756 3.828953 7.304702 1.558626 3.502905 8.124762 1.798624 2.453852 7.982743 2.351809 1.552572 7.938574 0.746745 4.410751 9.104345 0.509759 3.911837 9.863139 -0.095095 4.362707 9.289378 1.117837 2.719694 10.474118 1.101814 1.883850 10.184068 1.579906 0.958723 11.042900 -0.302768 1.587922 10.422673 -1.101022 1.968063 11.158904 -0.437798 0.519652 12.415115 -0.273811 2.248010 12.797180 1.059294 2.223011 13.173784 -0.833604 1.719223 12.281137 -0.742753 3.551777 13.097113 -0.599788 4.014750 11.670112 1.862735 2.510825 11.530120 1.906716 3.585857 11.888182 3.261852 1.963796 10.969910 3.827077 2.108851 12.053189 3.191843 0.890662 13.056310 3.999857 2.620855 12.883392 4.058838 3.694420 13.965597 3.421624 2.485802 13.255327 5.410555 2.062981 13.424358 5.351544 0.988799 12.340205 5.985688 2.196007 14.419432 6.157537 2.717029 15.334597 5.584373 2.583987 14.250421 6.218538 3.790090 14.616486 7.564338 2.154124 15.447283 8.068153 2.637002 14.821515 7.535343 1.087029 13.729227 8.174601 2.302179 !entry.U01.unit.residueconnect table int c1x int c2x int c3x int c4x int c5x int c6x 0 41 0 0 0 0 !entry.U01.unit.residues table str name int seq int childseq int startatomx str restype int imagingx "U01" 1 57 1 "?" 0 !entry.U01.unit.residuesPdbSequenceNumber array int 0 !entry.U01.unit.solventcap array dbl -1.000000 0.0 0.0 0.0 0.0 !entry.U01.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