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Dssprec_ Struct Reference

Dssprec_ : this struct stores the DSSP entry for a given residue. More...

#include <dsspread.h>

Collaboration diagram for Dssprec_:

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List of all members.

Public Attributes

int Resno
 residue no.

char Chain
 chain identifier , <SPACE> if 1 chain only.

char Res
 AA code, 1-letter.

char Disulf
 S-S bond code or ' ' (Res set to 'C' for these).

char Secstruct
 secondary structure code, see ref.

char Turns3
char Turns4
char Turns5
 helix turn labels.

char Bend
 geometrical bend.

char Chir
 chirality: '+' or '-'.

char Bridge1
char Bridge2
 beta labels: CAPS if antiparallel, lowercase if parallel.

int Beta1
int Beta2
 partner resnums in beta-bridges.

char Sheet
 beta-sheet label (always caps).

int Access
 solvent accessibility, see ref.

Hbondrec_ Nho [2]
Hbondrec_ Ohn [2]
 H-bonds NH(i)->O and O(i)->NH.

double Tco
 CO(i):CO(i-1) torsion cosine.

double Kappa
 CA(i-2):CA(i):CA(i+2) angle.

double Alpha
 C-alpha dihedral angle (360 if n/a).

double Phi
double Psi
 Ramachandran angles.

double Ca [3]
 C-alpha coordinates.


Detailed Description

Dssprec_ : this struct stores the DSSP entry for a given residue.

Definition at line 40 of file dsspread.h.


Member Data Documentation

int Dssprec_::Resno
 

residue no.

Definition at line 42 of file dsspread.h.

char Dssprec_::Chain
 

chain identifier , <SPACE> if 1 chain only.

Definition at line 43 of file dsspread.h.

char Dssprec_::Res
 

AA code, 1-letter.

Definition at line 44 of file dsspread.h.

char Dssprec_::Disulf
 

S-S bond code or ' ' (Res set to 'C' for these).

Definition at line 45 of file dsspread.h.

char Dssprec_::Secstruct
 

secondary structure code, see ref.

Definition at line 46 of file dsspread.h.

char Dssprec_::Turns3
 

Definition at line 47 of file dsspread.h.

char Dssprec_::Turns4
 

Definition at line 47 of file dsspread.h.

char Dssprec_::Turns5
 

helix turn labels.

Definition at line 47 of file dsspread.h.

char Dssprec_::Bend
 

geometrical bend.

Definition at line 48 of file dsspread.h.

char Dssprec_::Chir
 

chirality: '+' or '-'.

Definition at line 49 of file dsspread.h.

char Dssprec_::Bridge1
 

Definition at line 50 of file dsspread.h.

char Dssprec_::Bridge2
 

beta labels: CAPS if antiparallel, lowercase if parallel.

Definition at line 50 of file dsspread.h.

int Dssprec_::Beta1
 

Definition at line 51 of file dsspread.h.

int Dssprec_::Beta2
 

partner resnums in beta-bridges.

Definition at line 51 of file dsspread.h.

char Dssprec_::Sheet
 

beta-sheet label (always caps).

Definition at line 52 of file dsspread.h.

int Dssprec_::Access
 

solvent accessibility, see ref.

Definition at line 53 of file dsspread.h.

Hbondrec_ Dssprec_::Nho[2]
 

Definition at line 54 of file dsspread.h.

Hbondrec_ Dssprec_::Ohn
 

H-bonds NH(i)->O and O(i)->NH.

Definition at line 54 of file dsspread.h.

double Dssprec_::Tco
 

CO(i):CO(i-1) torsion cosine.

Definition at line 55 of file dsspread.h.

double Dssprec_::Kappa
 

CA(i-2):CA(i):CA(i+2) angle.

Definition at line 56 of file dsspread.h.

double Dssprec_::Alpha
 

C-alpha dihedral angle (360 if n/a).

Definition at line 57 of file dsspread.h.

double Dssprec_::Phi
 

Definition at line 58 of file dsspread.h.

double Dssprec_::Psi
 

Ramachandran angles.

Definition at line 58 of file dsspread.h.

double Dssprec_::Ca
 

C-alpha coordinates.

Definition at line 59 of file dsspread.h.


The documentation for this struct was generated from the following file:
Generated at Wed Aug 21 09:33:32 2002 for The Razorback C Library: Bioinformatics by doxygen1.2.6 written by Dimitri van Heesch, © 1997-2001