61 Atom(
int serial,
string name,
string resName,
int numInRes,
int resSeq,
62 double xInit,
double yInit,
double zInit,
64 double occupancy,
double tempFactor,
string element);
83 string GetElementName();
85 double GetVanDerWaalsRadius();
string fResName
Residue name.
int fSerial
its serial number
double fZ
Z orthogonal coordinates in Angstroms.
int fNumInRes
its number in residue sequence
string fElement
Element symbol extracted from 'atom name'.
int fResSeq
Residue sequence number.
double fTempFactor
Temperature factor for the Atom.
double fOccupancy
Occupancy for the Atom.
double fX
X orthogonal coordinates in Angstroms.
double fY
Y orthogonal coordinates in Angstroms.
Atom * fpNext
Pointer to the next Atom.