==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNOSUPPRESSANT 24-FEB-92 1CYB . COMPND 2 MOLECULE: CYCLOSPORIN A; . SOURCE 2 SYNTHETIC: YES; . AUTHOR S.W.FESIK . 11 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 1226.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 1 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A X 0 0 75 0, 0.0 8,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-156.5 -2.2 -5.5 -3.8 2 2 A X + 0 0 180 9,-0.2 9,-0.1 2,-0.0 7,-0.0 -0.137 360.0 153.5-133.0 43.9 0.8 -6.2 -1.5 3 3 A X - 0 0 87 7,-0.4 2,-0.2 8,-0.4 6,-0.0 0.235 49.2-126.3 -79.5-176.8 2.7 -2.9 -1.6 4 4 A X + 0 0 153 2,-0.1 2,-0.4 5,-0.0 -1,-0.1 -0.713 55.3 132.7-119.5 87.1 5.0 -0.9 0.5 5 5 A X - 0 0 136 -2,-0.2 2,-0.2 5,-0.1 -2,-0.0 -0.974 47.9-125.0-116.0 148.6 3.5 2.6 0.9 6 6 A X S S+ 0 0 105 -2,-0.4 2,-0.5 1,-0.1 -2,-0.1 -0.534 79.9 32.6 -41.3 136.3 2.8 5.0 3.5 7 7 A X S S+ 0 0 79 -2,-0.2 2,-0.3 2,-0.1 -1,-0.1 -0.655 123.8 5.2 136.4 -47.0 -0.4 6.4 4.1 8 8 A X S S- 0 0 131 -2,-0.5 2,-0.4 0, 0.0 -3,-0.0 -0.709 72.1-140.5-100.3 175.5 -3.0 4.1 3.4 9 9 A V - 0 0 91 -2,-0.3 -2,-0.1 -5,-0.1 -3,-0.0 -0.968 29.9-161.5-117.9 115.1 -1.8 0.7 2.4 10 10 A X 0 0 97 -2,-0.4 -7,-0.4 1,-0.2 -5,-0.1 -0.172 360.0 360.0 -93.8-179.2 -4.1 -0.4 -0.5 11 11 A A 0 0 92 -9,-0.1 -8,-0.4 -2,-0.0 -9,-0.2 0.014 360.0 360.0 -50.2 360.0 -5.0 -3.8 -2.1