101 lines
2.8 KiB
C
101 lines
2.8 KiB
C
|
#include "stride.h"
|
||
|
|
||
|
int Process_SHEET(BUFFER Buffer, CHAIN **Chain, int *ChainNumber, COMMAND *Cmd)
|
||
|
{
|
||
|
int CC, SC, STC;
|
||
|
char *Field[MAX_FIELD];
|
||
|
BUFFER Tmp;
|
||
|
static char PreviousChain, PreviousSheetId[RES_FIELD];
|
||
|
|
||
|
if( Cmd->NActive && !ChInStr(Cmd->Active,SpaceToDash(Buffer[21])) )
|
||
|
return(SUCCESS);
|
||
|
|
||
|
for( CC=0; CC < *ChainNumber && Chain[CC]->Id != Buffer[21]; CC++ );
|
||
|
|
||
|
if( CC == *ChainNumber ) {
|
||
|
InitChain(&Chain[CC]);
|
||
|
Chain[CC]->Id = Buffer[21];
|
||
|
(*ChainNumber)++;
|
||
|
}
|
||
|
|
||
|
if( Chain[CC]->NSheet == -1 ) {
|
||
|
PreviousChain = '*';
|
||
|
strcpy(PreviousSheetId,"*");
|
||
|
}
|
||
|
|
||
|
SplitString(Buffer+7,Field,2);
|
||
|
|
||
|
if( atoi(Field[0]) == 1 || Buffer[21] != PreviousChain ) {
|
||
|
if( Buffer[21] == PreviousChain && !strcmp(PreviousSheetId,Field[1]) )
|
||
|
return(FAILURE);
|
||
|
/* die("Here it is! -> %s%c\n", Chain[CC]->File,Chain[CC]->Id);*/
|
||
|
Chain[CC]->NSheet++;
|
||
|
SC = Chain[CC]->NSheet;
|
||
|
Chain[CC]->Sheet[SC] = (SHEET *)ckalloc(sizeof(SHEET));
|
||
|
Chain[CC]->Sheet[SC]->NStrand = 0;
|
||
|
STC = Chain[CC]->Sheet[SC]->NStrand;
|
||
|
strcpy(Chain[CC]->Sheet[SC]->SheetId,Field[1]);
|
||
|
}
|
||
|
else
|
||
|
{
|
||
|
SC = Chain[CC]->NSheet;
|
||
|
STC = Chain[CC]->Sheet[SC]->NStrand;
|
||
|
}
|
||
|
|
||
|
SplitString(Buffer+17,Field,1);
|
||
|
strcpy(Chain[CC]->Sheet[SC]->ResType1[STC],Field[0]);
|
||
|
|
||
|
SplitString(Buffer+28,Field,1);
|
||
|
strcpy(Chain[CC]->Sheet[SC]->ResType2[STC],Field[0]);
|
||
|
|
||
|
strcpy(Tmp,Buffer);
|
||
|
Tmp[27] = ' ';
|
||
|
Tmp[38] = ' ';
|
||
|
SplitString(Tmp+22,Field,1);
|
||
|
strcpy(Chain[CC]->Sheet[SC]->PDB_ResNumb1[STC],Field[0]);
|
||
|
SplitString(Tmp+33,Field,1);
|
||
|
strcpy(Chain[CC]->Sheet[SC]->PDB_ResNumb2[STC],Field[0]);
|
||
|
|
||
|
Chain[CC]->Sheet[SC]->InsCode1[STC] = Buffer[26];
|
||
|
Chain[CC]->Sheet[SC]->InsCode2[STC] = Buffer[37];
|
||
|
|
||
|
SplitString(Buffer+38,Field,1);
|
||
|
Chain[CC]->Sheet[SC]->Sence[STC] = atoi(Field[0]);
|
||
|
|
||
|
if( Buffer[45] != ' ' ) {
|
||
|
Chain[CC]->Sheet[SC]->RegYN[STC] = 1;
|
||
|
SplitString(Buffer+45,Field,1);
|
||
|
strcpy(Chain[CC]->Sheet[SC]->ResTypeReg1[STC],Field[0]);
|
||
|
SplitString(Buffer+60,Field,1);
|
||
|
strcpy(Chain[CC]->Sheet[SC]->ResTypeReg2[STC],Field[0]);
|
||
|
|
||
|
Tmp[55] = ' ';
|
||
|
Tmp[70] = ' ';
|
||
|
SplitString(Tmp+50,Field,1);
|
||
|
strcpy(Chain[CC]->Sheet[SC]->PDB_ResNumbReg1[STC],Field[0]);
|
||
|
SplitString(Tmp+66,Field,1);
|
||
|
strcpy(Chain[CC]->Sheet[SC]->PDB_ResNumbReg2[STC],Field[0]);
|
||
|
|
||
|
Chain[CC]->Sheet[SC]->InsCodeReg1[STC] = Buffer[54];
|
||
|
Chain[CC]->Sheet[SC]->InsCodeReg2[STC] = Buffer[69];
|
||
|
|
||
|
Tmp[45] = ' ';
|
||
|
Tmp[60] = ' ';
|
||
|
SplitString(Tmp+41,Field,1);
|
||
|
strcpy(Chain[CC]->Sheet[SC]->AtomNameReg1[STC],Field[0]);
|
||
|
SplitString(Tmp+56,Field,1);
|
||
|
strcpy(Chain[CC]->Sheet[SC]->AtomNameReg2[STC],Field[0]);
|
||
|
}
|
||
|
else Chain[CC]->Sheet[SC]->RegYN[STC] = 0;
|
||
|
|
||
|
strcpy(PreviousSheetId,Chain[CC]->Sheet[SC]->SheetId);
|
||
|
PreviousChain = Buffer[21];
|
||
|
Chain[CC]->Sheet[SC]->NStrand++;
|
||
|
|
||
|
return(SUCCESS);
|
||
|
}
|
||
|
|
||
|
|
||
|
|
||
|
|