!!index array str "HEP" !entry.HEP.unit.atoms table str name str type int typex int resx int flags int seq int elmnt dbl chg "N" "N" 0 1 131072 1 7 -0.376902 "H" "H" 0 1 131072 2 1 0.239482 "CA" "CT" 0 1 131072 3 6 0.064440 "HA" "H1" 0 1 131072 4 1 0.076346 "CB" "CT" 0 1 131072 5 6 -0.087121 "HB2" "HC" 0 1 131072 6 1 0.047861 "HB3" "HC" 0 1 131072 7 1 0.047861 "CG" "CT" 0 1 131072 8 6 -0.011948 "HG2" "HC" 0 1 131072 9 1 0.026140 "HG3" "HC" 0 1 131072 10 1 0.026140 "CD" "CT" 0 1 131072 11 6 -0.032848 "HD2" "HC" 0 1 131072 12 1 0.027298 "HD3" "HC" 0 1 131072 13 1 0.027298 "CE" "CT" 0 1 131072 14 6 -0.033281 "HE2" "HC" 0 1 131072 15 1 0.040312 "HE3" "HC" 0 1 131072 16 1 0.040312 "CZ" "CT" 0 1 131072 17 6 0.065361 "HZ2" "HP" 0 1 131072 18 1 0.086410 "HZ3" "HP" 0 1 131072 19 1 0.086410 "NH" "N3" 0 1 131072 20 7 -0.312193 "HH1" "H" 0 1 131072 21 1 0.310497 "HH2" "H" 0 1 131072 22 1 0.310497 "H23" "H" 0 1 131072 23 1 0.310497 "C" "C" 0 1 131072 24 6 0.567475 "O" "O" 0 1 131072 25 8 -0.546343 !entry.HEP.unit.atomspertinfo table str pname str ptype int ptypex int pelmnt dbl pchg "N" "N" 0 -1 0.0 "H" "H" 0 -1 0.0 "CA" "CT" 0 -1 0.0 "HA" "H1" 0 -1 0.0 "CB" "CT" 0 -1 0.0 "HB2" "HC" 0 -1 0.0 "HB3" "HC" 0 -1 0.0 "CG" "CT" 0 -1 0.0 "HG2" "HC" 0 -1 0.0 "HG3" "HC" 0 -1 0.0 "CD" "CT" 0 -1 0.0 "HD2" "HC" 0 -1 0.0 "HD3" "HC" 0 -1 0.0 "CE" "CT" 0 -1 0.0 "HE2" "HC" 0 -1 0.0 "HE3" "HC" 0 -1 0.0 "CZ" "CT" 0 -1 0.0 "HZ2" "HP" 0 -1 0.0 "HZ3" "HP" 0 -1 0.0 "NH" "N3" 0 -1 0.0 "HH1" "H" 0 -1 0.0 "HH2" "H" 0 -1 0.0 "H23" "H" 0 -1 0.0 "C" "C" 0 -1 0.0 "O" "O" 0 -1 0.0 !entry.HEP.unit.boundbox array dbl -1.000000 0.0 0.0 0.0 0.0 !entry.HEP.unit.childsequence single int 2 !entry.HEP.unit.connect array int 1 24 !entry.HEP.unit.connectivity table int atom1x int atom2x int flags 1 3 1 1 2 1 3 5 1 3 24 1 3 4 1 5 6 1 5 8 1 5 7 1 8 11 1 8 9 1 8 10 1 11 12 1 11 14 1 11 13 1 14 17 1 14 15 1 14 16 1 17 18 1 17 20 1 17 19 1 20 21 1 20 22 1 20 23 1 24 25 1 !entry.HEP.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 !entry.HEP.unit.name single str "HEP" !entry.HEP.unit.positions table dbl x dbl y dbl z -2.459675 -0.768954 -0.313925 -2.856377 -0.555971 -1.203110 -1.314861 0.009964 0.121183 -1.224499 -0.170421 1.185525 -0.006488 -0.417583 -0.560216 -0.028689 -1.497959 -0.654415 0.032749 0.001033 -1.560964 1.242841 -0.014265 0.225271 1.237795 1.055831 0.384578 1.215860 -0.493210 1.202001 2.531878 -0.414897 -0.494875 2.552015 -1.490693 -0.652004 2.556852 0.050257 -1.477019 3.775675 0.008572 0.295863 3.750503 1.083572 0.456524 3.764768 -0.466279 1.274065 5.054475 -0.366225 -0.437812 5.160030 -1.433189 -0.569511 5.137310 0.120207 -1.398722 6.267845 0.079472 0.362639 6.282817 -0.354405 1.275596 7.136069 -0.154749 -0.099430 6.261213 1.079941 0.507922 -1.589279 1.509381 -0.047688 -0.714131 2.271761 -0.369431 !entry.HEP.unit.residueconnect table int c1x int c2x int c3x int c4x int c5x int c6x 0 0 0 0 0 0 !entry.HEP.unit.residues table str name int seq int childseq int startatomx str restype int imagingx "HEP" 1 26 1 "?" 0 !entry.HEP.unit.residuesPdbSequenceNumber array int 0 !entry.HEP.unit.solventcap array dbl -1.000000 0.0 0.0 0.0 0.0 !entry.HEP.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