==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 05-AUG-05 2ALF . COMPND 2 MOLECULE: PEPTIDYL-PROLYL CIS-TRANS ISOMERASE A; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR H.HU,C.-Q.HUANG,H.-L.LIU,Y.HAN,M.-E.CHEN,L.YU,R.-C.BI . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7632.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 112 68.3 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 . 50 30.5 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 . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 1.2 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 . 16 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 20 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 1 0 0 0 1 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 . 3 0 3 2 0 0 0 2 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 1 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 2 A V 0 0 183 0, 0.0 24,-0.0 0, 0.0 23,-0.0 0.000 360.0 360.0 360.0 153.2 43.7 2.1 60.7 2 3 A N - 0 0 24 1,-0.1 22,-0.1 22,-0.1 0, 0.0 -0.544 360.0-129.0 -71.5 121.2 41.9 4.8 58.8 3 4 A P - 0 0 20 0, 0.0 20,-2.7 0, 0.0 2,-0.4 -0.251 14.1-137.8 -68.7 157.8 39.0 3.4 56.8 4 5 A T E -AB 22 163A 3 159,-0.7 159,-3.2 18,-0.2 2,-0.3 -0.974 18.3-171.7-121.8 132.4 38.5 4.1 53.1 5 6 A V E -AB 21 162A 0 16,-2.0 16,-2.9 -2,-0.4 2,-0.3 -0.858 5.4-154.3-121.1 155.1 35.1 4.9 51.6 6 7 A F E -AB 20 161A 17 155,-2.3 155,-1.5 -2,-0.3 2,-0.4 -0.956 5.9-161.1-131.4 152.1 34.0 5.3 47.9 7 8 A F E -AB 19 160A 0 12,-2.8 12,-2.8 -2,-0.3 2,-0.8 -0.989 12.0-149.2-126.8 134.9 31.2 7.1 46.1 8 9 A D E -AB 18 159A 38 151,-3.0 150,-1.5 -2,-0.4 151,-0.9 -0.920 25.5-151.4-106.7 104.9 30.2 6.2 42.5 9 10 A I E -AB 17 157A 2 8,-2.6 7,-3.3 -2,-0.8 8,-1.3 -0.566 14.6-172.9 -82.6 138.4 29.1 9.5 41.1 10 11 A A E -AB 15 156A 3 146,-2.1 146,-2.3 5,-0.3 2,-0.6 -0.966 17.8-145.6-132.1 147.0 26.4 9.8 38.3 11 12 A V E > S-AB 14 155A 20 3,-3.0 3,-2.1 -2,-0.3 144,-0.2 -0.957 88.6 -19.7-113.1 115.2 25.1 12.7 36.2 12 13 A D T 3 S- 0 0 77 142,-2.9 -1,-0.2 -2,-0.6 143,-0.1 0.901 132.2 -48.9 52.0 42.4 21.4 12.4 35.4 13 14 A G T 3 S+ 0 0 63 141,-0.4 -1,-0.3 1,-0.2 142,-0.1 0.324 115.4 116.6 83.7 -8.7 21.7 8.7 36.2 14 15 A E E < S-A 11 0A 141 -3,-2.1 -3,-3.0 1,-0.1 -1,-0.2 -0.795 72.8-105.5 -98.1 135.1 24.8 8.1 34.0 15 16 A P E +A 10 0A 126 0, 0.0 -5,-0.3 0, 0.0 3,-0.1 -0.276 39.3 169.6 -58.4 133.4 28.1 7.0 35.6 16 17 A L E - 0 0 61 -7,-3.3 2,-0.3 1,-0.3 -6,-0.2 0.758 53.7 -67.7-108.9 -52.6 30.8 9.7 35.8 17 18 A G E -A 9 0A 22 -8,-1.3 -8,-2.6 120,-0.0 2,-0.4 -0.950 44.9 -82.7 171.2 171.0 33.4 8.1 38.0 18 19 A R E -A 8 0A 114 -2,-0.3 2,-0.4 -10,-0.2 -10,-0.2 -0.771 28.4-166.0-100.9 140.6 34.4 6.9 41.5 19 20 A V E -A 7 0A 1 -12,-2.8 -12,-2.8 -2,-0.4 2,-0.3 -0.992 8.0-167.9-124.3 128.9 35.7 9.0 44.3 20 21 A S E -AC 6 133A 8 113,-2.7 112,-3.2 -2,-0.4 113,-0.9 -0.895 1.1-163.8-118.4 150.4 37.4 7.5 47.4 21 22 A F E -AC 5 131A 0 -16,-2.9 -16,-2.0 -2,-0.3 2,-0.5 -0.948 17.9-137.5-132.5 151.6 38.3 9.0 50.7 22 23 A E E -AC 4 130A 72 108,-2.3 108,-1.7 -2,-0.3 2,-0.6 -0.905 24.4-145.3-103.3 135.2 40.5 8.2 53.6 23 24 A L E - C 0 129A 0 -20,-2.7 2,-2.5 -2,-0.5 3,-0.3 -0.929 9.8-135.3-106.0 122.6 38.7 8.9 56.9 24 25 A F >> + 0 0 37 104,-2.2 4,-2.7 -2,-0.6 3,-1.7 -0.355 42.6 155.6 -77.1 64.9 41.0 10.2 59.7 25 26 A A T 34 + 0 0 28 -2,-2.5 -1,-0.2 1,-0.3 5,-0.1 0.747 67.5 68.0 -60.8 -24.3 39.5 8.0 62.4 26 27 A D T 34 S+ 0 0 97 -3,-0.3 -1,-0.3 2,-0.2 -2,-0.1 0.750 115.6 24.2 -69.2 -22.3 42.9 8.3 64.2 27 28 A K T <4 S+ 0 0 86 -3,-1.7 -2,-0.2 101,-0.1 -1,-0.2 0.683 140.6 20.7-112.4 -30.7 42.1 12.0 64.8 28 29 A V X + 0 0 0 -4,-2.7 4,-2.7 100,-0.1 5,-0.2 -0.505 67.3 164.9-139.7 68.2 38.3 12.2 64.7 29 30 A P H > S+ 0 0 68 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.870 75.3 49.1 -52.8 -47.3 36.9 8.7 65.3 30 31 A K H > S+ 0 0 73 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.915 116.1 42.5 -62.6 -44.3 33.3 9.7 66.1 31 32 A T H > S+ 0 0 0 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.895 116.0 48.6 -70.1 -40.4 33.0 11.9 63.0 32 33 A A H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.917 110.3 52.1 -64.6 -43.4 34.8 9.4 60.8 33 34 A E H X S+ 0 0 70 -4,-2.8 4,-2.6 -5,-0.2 5,-0.2 0.857 106.6 53.6 -61.7 -38.2 32.6 6.5 62.0 34 35 A N H X S+ 0 0 0 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.958 112.3 43.4 -62.0 -50.9 29.4 8.5 61.3 35 36 A F H X S+ 0 0 0 -4,-1.9 4,-1.4 2,-0.2 -2,-0.2 0.902 114.0 51.8 -62.5 -41.7 30.5 9.0 57.7 36 37 A R H X S+ 0 0 30 -4,-2.6 4,-1.7 1,-0.2 3,-0.4 0.947 111.3 45.4 -60.8 -51.1 31.7 5.4 57.3 37 38 A A H X>S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 5,-0.8 0.874 111.4 52.9 -61.8 -38.8 28.5 3.9 58.5 38 39 A L H <5S+ 0 0 1 -4,-2.1 9,-2.0 -5,-0.2 10,-0.5 0.794 109.0 51.5 -67.3 -26.5 26.4 6.2 56.4 39 40 A S H <5S+ 0 0 1 -4,-1.4 -2,-0.2 -3,-0.4 -1,-0.2 0.812 111.6 44.3 -79.4 -33.6 28.4 5.1 53.4 40 41 A T H <5S- 0 0 48 -4,-1.7 -2,-0.2 121,-0.2 -1,-0.2 0.821 97.9-139.2 -79.4 -31.4 27.9 1.4 54.0 41 42 A G T ><5 + 0 0 33 -4,-2.2 3,-1.5 -5,-0.2 -3,-0.2 0.661 54.9 141.8 80.5 17.7 24.2 1.9 54.7 42 43 A E T 3 < + 0 0 102 -5,-0.8 -4,-0.1 1,-0.3 4,-0.1 0.696 64.6 58.6 -65.3 -20.3 24.5 -0.6 57.5 43 44 A K T 3 S- 0 0 111 -6,-0.5 -1,-0.3 2,-0.5 3,-0.1 0.523 121.2-103.0 -87.2 -6.6 22.1 1.4 59.7 44 45 A G S < S+ 0 0 71 -3,-1.5 2,-0.3 1,-0.2 -2,-0.1 0.521 99.6 60.6 96.8 4.9 19.3 1.2 57.1 45 46 A F + 0 0 60 0, 0.0 -2,-0.5 0, 0.0 2,-0.3 -0.973 61.5 106.3-158.0 151.3 19.8 4.7 55.9 46 47 A G S S- 0 0 12 -2,-0.3 -7,-0.2 2,-0.2 -8,-0.1 -0.986 71.6 -40.4 171.0-157.9 22.7 6.6 54.3 47 48 A Y S > S+ 0 0 0 -9,-2.0 3,-2.8 -2,-0.3 110,-0.3 0.701 81.9 116.4 -75.5 -23.9 24.3 8.3 51.3 48 49 A K T 3 S+ 0 0 135 -10,-0.5 -2,-0.2 1,-0.3 110,-0.2 -0.269 91.1 6.2 -53.5 118.5 23.4 5.7 48.7 49 50 A G T 3 S+ 0 0 51 108,-3.3 -1,-0.3 1,-0.3 109,-0.1 0.302 100.8 123.7 92.5 -10.7 21.1 7.4 46.2 50 51 A S < - 0 0 2 -3,-2.8 107,-2.6 107,-0.3 -1,-0.3 -0.201 51.0-131.0 -75.8 175.0 21.4 10.9 47.7 51 52 A C B -D 156 0A 30 14,-0.3 2,-1.0 105,-0.2 13,-0.5 -0.804 16.0-112.5-127.5 166.9 22.6 13.9 45.6 52 53 A F + 0 0 2 103,-3.0 103,-0.4 -2,-0.3 11,-0.2 -0.876 37.8 177.0 -97.2 101.7 25.0 16.8 45.7 53 54 A H + 0 0 35 -2,-1.0 2,-0.4 9,-0.3 98,-0.4 0.628 64.1 46.5 -83.4 -15.5 22.5 19.6 46.0 54 55 A R E +E 62 0A 93 8,-1.5 8,-3.2 96,-0.1 2,-0.5 -0.887 60.6 166.0-136.1 104.6 25.0 22.4 46.3 55 56 A I E -E 61 0A 0 94,-2.8 91,-2.5 -2,-0.4 94,-0.4 -0.967 7.8-178.4-122.3 117.4 28.0 22.7 44.0 56 57 A I E >> -E 60 0A 22 4,-2.5 3,-2.2 -2,-0.5 4,-1.3 -0.914 28.1-127.6-118.7 103.6 30.0 25.9 43.8 57 58 A P T 34 S+ 0 0 62 0, 0.0 82,-0.0 0, 0.0 92,-0.0 -0.153 93.7 17.1 -49.0 136.7 32.9 25.9 41.3 58 59 A G T 34 S+ 0 0 54 1,-0.1 56,-0.0 57,-0.1 81,-0.0 0.450 128.7 53.1 79.1 -0.3 36.2 27.0 42.9 59 60 A F T <4 S- 0 0 44 -3,-2.2 56,-2.6 1,-0.2 57,-0.4 0.560 106.0 -55.3-126.4 -74.8 34.8 26.4 46.4 60 61 A M E < -EF 56 114A 1 -4,-1.3 -4,-2.5 54,-0.3 2,-0.5 -0.993 29.5-115.3-169.5 167.2 33.3 23.0 47.2 61 62 A C E -EF 55 113A 0 52,-2.2 52,-2.8 -2,-0.3 2,-0.4 -0.975 34.4-161.7-113.8 121.5 30.8 20.3 46.4 62 63 A Q E +EF 54 112A 19 -8,-3.2 -8,-1.5 -2,-0.5 -9,-0.3 -0.880 24.4 133.7-111.9 137.8 28.2 19.7 49.2 63 64 A G E + F 0 111A 0 48,-2.7 48,-2.2 -2,-0.4 -11,-0.2 -0.750 19.4 107.2-152.8-161.8 26.0 16.6 49.7 64 65 A G + 0 0 0 -13,-0.5 2,-1.7 46,-0.3 11,-0.3 0.336 42.9 126.0 100.3 -10.1 24.7 14.3 52.4 65 66 A D > + 0 0 0 -14,-0.4 4,-1.0 1,-0.2 -14,-0.3 -0.605 22.7 159.4 -84.8 83.6 21.1 15.4 52.8 66 67 A F T 4 + 0 0 28 -2,-1.7 -1,-0.2 1,-0.2 -20,-0.1 0.442 67.9 51.7 -85.7 1.4 19.5 12.0 52.3 67 68 A T T 4 S+ 0 0 42 -3,-0.1 -1,-0.2 -17,-0.0 -2,-0.1 0.793 130.8 6.7-103.8 -37.9 16.3 12.9 54.0 68 69 A R T 4 S- 0 0 145 0, 0.0 -2,-0.1 0, 0.0 -3,-0.1 0.488 80.3-145.2-122.1 -10.3 15.2 16.2 52.3 69 70 A H S < S+ 0 0 94 -4,-1.0 -3,-0.1 1,-0.1 -4,-0.0 0.667 82.2 80.5 53.2 22.2 17.8 16.4 49.5 70 71 A N S S- 0 0 89 -7,-0.0 -1,-0.1 -16,-0.0 -4,-0.1 0.358 111.9 -92.9-135.6 1.4 17.9 20.2 49.7 71 72 A G S S+ 0 0 28 -6,-0.1 39,-0.1 -17,-0.0 -2,-0.1 0.327 106.3 93.3 102.3 -8.2 20.1 21.0 52.7 72 73 A T S S+ 0 0 110 -7,-0.1 2,-0.1 -4,-0.0 -3,-0.0 0.584 87.2 38.1 -92.0 -11.8 17.4 21.1 55.3 73 74 A G + 0 0 11 -8,-0.0 36,-0.3 2,-0.0 37,-0.3 -0.137 52.7 112.2-118.5-148.7 17.7 17.5 56.4 74 75 A G - 0 0 1 -9,-0.1 2,-0.3 34,-0.1 -9,-0.1 0.061 38.6-145.8 92.5 153.2 20.0 14.6 57.0 75 76 A K - 0 0 71 -11,-0.3 5,-0.2 33,-0.2 6,-0.2 -0.982 7.7-124.2-151.6 157.8 20.8 12.9 60.3 76 77 A S B > -I 79 0B 3 3,-1.6 3,-0.5 4,-0.4 33,-0.1 -0.344 30.3-110.3 -95.1 179.7 23.8 11.2 62.1 77 78 A I T 3 S+ 0 0 38 31,-0.2 3,-0.1 1,-0.2 -1,-0.1 0.457 117.2 57.4 -88.5 -1.7 24.0 7.7 63.5 78 79 A Y T 3 S- 0 0 83 1,-0.5 2,-0.3 30,-0.1 -1,-0.2 0.317 126.8 -69.4-107.4 2.6 24.1 9.3 67.0 79 80 A G B < S-I 76 0B 36 -3,-0.5 -3,-1.6 1,-0.2 -1,-0.5 -0.853 79.6 -41.4 135.4-171.1 20.8 11.2 66.7 80 81 A E S S- 0 0 123 -2,-0.3 -4,-0.4 -5,-0.2 2,-0.3 0.925 124.4 -5.4 -55.4 -47.8 19.6 14.2 64.7 81 82 A K - 0 0 91 -3,-0.2 2,-0.3 -6,-0.2 27,-0.2 -0.922 66.2-155.2-142.6 165.7 22.9 16.0 65.3 82 83 A F B -J 107 0C 9 25,-2.1 25,-1.9 -2,-0.3 3,-0.1 -0.938 29.1 -79.9-142.3 166.9 26.2 15.6 67.2 83 84 A E - 0 0 84 -2,-0.3 2,-1.0 23,-0.1 3,-0.1 -0.068 45.0 -98.4 -65.0 160.8 29.0 17.7 68.7 84 85 A D - 0 0 28 1,-0.2 -1,-0.1 41,-0.0 3,-0.1 -0.737 36.6-157.7 -78.8 106.0 32.0 19.2 67.0 85 86 A E - 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