/* * Copyright (c) 1993 The Regents of the University of California. * All rights reserved. * * Redistribution and use in source and binary forms are permitted * provided that the above copyright notice and this paragraph are * duplicated in all such forms and that any documentation, * advertising materials, and other materials related to such * distribution and use acknowledge that the software was developed * by the University of California, San Francisco. The name of the * University may not be used to endorse or promote products derived * from this software without specific prior written permission. * THIS SOFTWARE IS PROVIDED ``AS IS'' AND WITHOUT ANY EXPRESS OR * IMPLIED WARRANTIES, INCLUDING, WITHOUT LIMITATION, THE IMPLIED * WARRANTIES OF MERCHANTIBILITY AND FITNESS FOR A PARTICULAR PURPOSE. * * $Id: write_format.i,v 7.0 1999/03/10 18:20:26 case Exp $ */ "UNKNOWN: ??%-6.6s??", "ANISOU%5d %-4s%c%-4s%c%4d%c %7d%7d%7d%7d%7d%7d", /* SIGUIJ */ "ATOM %5d %-4s%c%-4s%c%4d%c %8.3f%8.3f%8.3f%6.2f%6.2f %3D", /* HETATM, SIGATM */ "AUTHOR %c%-60s", /* COMPND, EXPDTA, JRNL, SOURCE */ "COMPND %c%-60s", /* AUTHOR */ "CONECT%5d%5D%5D%5D%5D%5D%5D%5D%5D%5D%5D", "CRYST1%9.3f%9.3f%9.3f%7.2f%7.2f%7.2f %-11s%4d", "END", "FORMUL %2D %-4s%2D%c%-51s", "FTNOTE %3D %-59s", /* REMARK */ "HEADER %-40s%-11s%c%-4s", "HELIX %3D %3s %-4s%c %4d%c %-4s%c %4d%c%2D%-30s", "HET %-4s %c%4d%c %5d %-40s", "HETATM%5d %-4s%c%-4s%c%4d%c %8.3f%8.3f%8.3f%6.2f%6.2f %3D", "JRNL %c%-60s", /* AUTHOR */ "MASTER %5d%5d%5d%5d%5d%5d%5d%5d%5d%5d%5d%5d", "MTRIX%1d %3d%10.6f%10.6f%10.6f %10.5f %2D", "OBSLTE %2D %-9s %-10s%-5s%-5s%-5s%-5s%-5s%-5s%-5s%-4s", "ORIGX%1d %10.6f%10.6f%10.6f %10.5f", /* SCALE */ "REMARK %3D %-59s", "REVDAT %3D%2D %-9s %-7s %c %-31s", "SCALE%1d %10.6f%10.6f%10.6f %10.5f", /* ORIGX */ "SEQRES%4d %c %4d %-4s%-4s%-4s%-4s%-4s%-4s%-4s%-4s%-4s%-4s%-4s%-4s%-4s", "SHEET %4D %3s%2d %-4s%c%4d%c %-4s%c%4d%c%2d %-4s%-4s%c%4D%c %-4s%-4s%c%4D%c", "SIGATM%5d %-4s%c%-4s%c%4d%c %8.3f%8.3f%8.3f%6.2f%6.2f %3D", "SIGUIJ%5d %-4s%c%-4s%c%4d%c %7D%7D%7D%7D%7D%7D", /* ANISOU */ "SITE %3d %3s %2d %-4s%c%4D%c %-4s%c%4D%c %-4s%c%4D%c %-4s%c%4D%c", "SOURCE %c%-60s", /* AUTHOR */ "SPRSDE %2D %-9s %-10s%-5s%-5s%-5s%-5s%-5s%-5s%-5s%-4s", "SSBOND %3D %-4s%c %4d%c %-4s%c %4D%c %-30s", "TER %5d %-4s%c%4d%c", "TURN %3D %3s %-4s%c%4d%c %-4s%c%4d%c %-30s", "TVECT %3D%10.5f%10.5f%10.5f%-30s", "USER%-2s%-66s", "MODEL %5d", "ENDMDL", "EXPDTA %c%-60s", /* AUTHOR */ "SYMDES %3d %59s", /* FTNOTE */ "SYMOP%1d %3d%10.6f%10.6f%10.6f %10.5f", "MTXDES %3d %59s", /* FTNOTE */ "CMPDES %3d %59s", /* FTNOTE */ "CMPONT %3d %4s%c %4d%c %4s%c %4d%c", "TRNSFM %3d %3d %3d", "AGRDES %3d %59s", /* FTNOTE */ "AGGRGT %3d %3d %3d %3d %3d %3d %3d %3d %3d %3d %3d %3d %3d %3d %3d %3d",