REAL*4 X(3),W(3),RM(3,3),A,B INTEGER I,J,K,I1,I2,I3,IRES,IATM CHARACTER*40 FNAME,matname CHARACTER*4 ATOM RES CHARACTER*1 CHAIN character*80 astring CHAIN=' ' 40 FORMAT (A40) 49 format (a80) c DO 47 I=1,3 c47 read(5,49) astring write(6,*)'REMARK occupancy and B collumns contain AAREA and CAREA fr surface' C KEY INDEX IC IF ATM RES NUM X Y Z VDW COV AAREA CAREA FRCT C12345678901234567890123456789012345678901234567890123456789012345678901234567890 C 0 1466 0 1 OD1 ASP 190 -13.958 170.695 98.851 1.40 0.66 21.8 5.4 0.00 50 format (3x,I6,7x,A4,A3,I5,3f8.3,2F5.2,2F6.1) 55 read(5,50,END=501) IATM, ATOM, RES, IRES, (x(i),i=1,3),I1,I2,A,B c write(6,*) IATM, ATOM, RES, IRES, (x(i),i=1,3),I1,I2,A,B c12345678901234567890123456789012345678901234567890123456789012345678901234567890 cATOM 478 N ALA C 6 -9.539 4.454 64.244 1.00 26.78 1ZAA 538 51 format ('ATOM',I7,2x,A4,A4,A1,I4,4x,3f8.3,2f6.2) write(6,51) IATM,ATOM,RES,CHAIN,IRES,(x(i),i=1,3),a,b goto 55 501 CONTINUE END