==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 10-JUN-13 2M9J . COMPND 2 MOLECULE: PEPTIDYL-PROLYL CIS-TRANS ISOMERASE NIMA-INTERACT . SOURCE 2 SYNTHETIC: YES; . AUTHOR S.ENCK,W.CHEN,J.L.PRICE,E.T.POWERS,C.WONG,H.J.DYSON,J.W.KELL . 34 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 2667.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 15 44.1 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 . 10 29.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 5.9 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 . 2 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 2 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 2 5.9 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 1 0 0 0 1 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 1 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 K 0 0 159 0, 0.0 32,-0.1 0, 0.0 30,-0.0 0.000 360.0 360.0 360.0 -86.4 -11.1 4.2 -0.1 2 2 A L - 0 0 72 1,-0.1 3,-0.1 3,-0.0 29,-0.0 -0.311 360.0 -72.3 -74.5 165.4 -9.9 0.9 -1.7 3 3 A P > - 0 0 78 0, 0.0 3,-2.1 0, 0.0 -1,-0.1 -0.048 48.6 -84.6 -65.3 159.9 -10.9 -2.5 -0.0 4 4 A P T 3 S+ 0 0 121 0, 0.0 3,-0.1 0, 0.0 19,-0.1 -0.288 112.5 57.0 -53.8 140.4 -9.9 -4.4 3.1 5 5 A G T 3 S+ 0 0 11 1,-0.5 17,-2.0 -3,-0.1 2,-0.2 -0.178 77.6 111.7 110.5 -35.8 -6.8 -6.4 2.3 6 6 A W E < +A 21 0A 44 -3,-2.1 -1,-0.5 15,-0.3 2,-0.3 -0.536 43.3 172.2 -69.6 139.3 -4.8 -3.3 1.2 7 7 A E E -A 20 0A 83 13,-2.0 13,-2.9 -2,-0.2 11,-0.1 -0.987 38.0 -90.3-147.4 145.8 -1.9 -2.5 3.7 8 8 A K E -A 19 0A 98 -2,-0.3 2,-0.3 11,-0.2 11,-0.3 -0.286 46.3-175.8 -63.8 143.3 1.1 -0.1 3.7 9 9 A R E -A 18 0A 65 9,-3.1 9,-2.9 20,-0.1 2,-0.4 -0.950 13.1-146.5-144.5 151.4 4.3 -1.4 2.2 10 10 A M E -A 17 0A 93 -2,-0.3 2,-1.1 7,-0.2 7,-0.3 -0.991 15.1-130.0-135.1 130.6 8.0 -0.2 1.8 11 11 A F E >>> -A 16 0A 62 5,-2.6 4,-2.9 -2,-0.4 3,-1.6 -0.640 25.8-148.3 -78.3 95.0 10.6 -0.6 -1.0 12 12 A R T 345S+ 0 0 184 -2,-1.1 4,-0.1 1,-0.2 -1,-0.0 -0.298 82.4 40.3 -58.7 150.4 13.9 -1.7 0.8 13 13 A S T 345S+ 0 0 136 1,-0.1 -1,-0.2 2,-0.0 -2,-0.0 0.043 130.1 30.0 80.9 -14.9 17.0 -0.5 -1.1 14 14 A N T <45S- 0 0 113 -3,-1.6 -2,-0.2 2,-0.1 -1,-0.1 0.536 96.9-126.1-136.6 -21.3 15.5 3.0 -1.8 15 15 A G T <5 + 0 0 49 -4,-2.9 -3,-0.2 1,-0.3 -2,-0.0 0.440 54.2 149.3 90.4 3.3 13.0 3.7 1.1 16 16 A T E < -A 11 0A 61 -5,-0.5 -5,-2.6 -6,-0.1 2,-0.3 -0.236 34.4-141.8 -62.8 158.8 9.9 4.4 -1.1 17 17 A V E +A 10 0A 61 -7,-0.3 -7,-0.2 12,-0.0 2,-0.2 -0.914 30.0 145.5-131.6 148.0 6.4 3.5 0.3 18 18 A Y E -A 9 0A 36 -9,-2.9 -9,-3.1 -2,-0.3 2,-0.3 -0.786 41.9 -94.2-156.6-167.6 3.3 2.1 -1.4 19 19 A Y E -AB 8 28A 11 9,-3.0 9,-2.5 -11,-0.3 2,-0.4 -0.964 26.1-161.5-129.4 150.5 0.3 -0.2 -0.5 20 20 A F E -AB 7 27A 52 -13,-2.9 -13,-2.0 -2,-0.3 2,-1.1 -0.998 17.1-137.9-135.5 127.6 -0.1 -4.0 -1.1 21 21 A N E > -A 6 0A 5 5,-2.7 4,-3.2 -2,-0.4 5,-0.3 -0.768 18.0-175.9 -86.9 97.3 -3.3 -6.0 -1.1 22 22 A H T 4 S+ 0 0 98 -17,-2.0 -1,-0.1 -2,-1.1 -16,-0.1 0.513 83.1 55.9 -76.2 1.3 -2.4 -9.2 0.8 23 23 A I T 4 S+ 0 0 121 -18,-0.2 -1,-0.2 3,-0.1 -18,-0.1 0.772 126.7 16.7 -94.5 -33.8 -5.9 -10.6 0.0 24 24 A T T 4 S- 0 0 87 -3,-0.3 -2,-0.2 2,-0.1 -19,-0.0 0.658 100.3-120.5-108.2 -21.1 -5.6 -10.2 -3.8 25 25 A N < + 0 0 124 -4,-3.2 -3,-0.2 1,-0.3 -20,-0.0 0.340 64.0 142.6 85.1 5.7 -1.8 -9.8 -4.2 26 26 A A - 0 0 36 -5,-0.3 -5,-2.7 -6,-0.1 2,-0.3 -0.203 36.4-153.3 -66.1 164.1 -2.2 -6.3 -5.9 27 27 A S E +B 20 0A 76 -7,-0.3 2,-0.3 -21,-0.1 -7,-0.2 -0.991 18.0 164.9-138.0 144.5 0.1 -3.2 -5.4 28 28 A Q E -B 19 0A 92 -9,-2.5 -9,-3.0 -2,-0.3 -2,-0.0 -0.965 32.5-142.3-154.3 146.7 -0.7 0.5 -5.7 29 29 A F S S+ 0 0 121 -2,-0.3 2,-0.2 -11,-0.3 -20,-0.1 0.827 82.6 80.7 -89.1 -32.1 1.2 3.6 -4.5 30 30 A E S S- 0 0 84 -11,-0.1 -11,-0.1 1,-0.1 4,-0.1 -0.515 89.3-115.2 -72.0 143.2 -1.9 5.7 -3.6 31 31 A R - 0 0 95 -2,-0.2 -2,-0.1 1,-0.1 -1,-0.1 -0.724 12.1-153.6 -90.5 116.6 -3.2 4.7 -0.1 32 32 A P S S+ 0 0 8 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.726 102.9 7.4 -53.6 -24.9 -6.7 3.0 0.4 33 33 A S 0 0 87 1,-0.2 -2,-0.1 -32,-0.1 -26,-0.0 0.566 360.0 360.0-114.1 -82.1 -6.5 4.5 3.9 34 34 A G 0 0 44 -4,-0.1 -1,-0.2 0, 0.0 -26,-0.1 -0.975 360.0 360.0-160.8 360.0 -3.5 6.9 4.4