==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 15-NOV-04 1Y0O . COMPND 2 MOLECULE: FKBP-TYPE PEPTIDYL-PROLYL CIS-TRANS ISOMERASE 3; . SOURCE 2 ORGANISM_SCIENTIFIC: ARABIDOPSIS THALIANA; . AUTHOR G.GAYATHRI,K.SWAMINATHAN . 625 5 5 5 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30849.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 443 70.9 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 . 225 36.0 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 . 10 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 1.3 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 . 62 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 61 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 39 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 2.2 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 2 0 0 0 5 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 . 12 6 7 5 5 5 0 3 2 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 . 3 0 0 0 0 5 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 5 A C 0 0 95 0, 0.0 2,-0.5 0, 0.0 14,-0.0 0.000 360.0 360.0 360.0 79.5 71.0 9.6 7.4 2 6 A E - 0 0 183 1,-0.0 2,-0.1 0, 0.0 10,-0.0 -0.785 360.0-132.8 -88.8 129.0 73.5 11.3 5.2 3 7 A F - 0 0 52 -2,-0.5 2,-0.6 10,-0.1 10,-0.2 -0.428 3.0-132.4 -82.6 156.2 73.5 15.0 5.7 4 8 A S E -A 12 0A 58 8,-2.5 8,-2.0 -2,-0.1 2,-0.6 -0.949 30.1-144.1-102.3 119.2 73.4 17.8 3.2 5 9 A V E -A 11 0A 100 -2,-0.6 6,-0.2 6,-0.2 5,-0.1 -0.797 8.9-148.9 -94.8 119.9 76.2 20.1 4.3 6 10 A S > - 0 0 6 4,-2.8 3,-1.9 -2,-0.6 69,-0.2 -0.292 34.8 -95.9 -77.9 168.1 75.5 23.8 3.8 7 11 A P T 3 S+ 0 0 114 0, 0.0 -1,-0.1 0, 0.0 68,-0.1 0.772 124.2 54.4 -53.9 -29.5 78.3 26.3 3.2 8 12 A S T 3 S- 0 0 54 66,-0.3 3,-0.1 2,-0.2 85,-0.1 0.558 119.9-105.0 -84.1 -8.6 78.4 27.2 6.9 9 13 A G S < S+ 0 0 26 -3,-1.9 2,-0.3 1,-0.4 79,-0.1 0.145 79.9 134.1 103.2 -20.4 78.9 23.7 8.1 10 14 A L - 0 0 0 79,-0.1 -4,-2.8 -5,-0.1 -1,-0.4 -0.504 38.6-169.2 -64.5 122.3 75.3 23.5 9.2 11 15 A A E -AB 5 88A 3 77,-2.5 77,-2.8 -2,-0.3 2,-0.3 -0.894 8.8-178.9-120.5 151.0 74.1 20.1 7.9 12 16 A F E -AB 4 87A 22 -8,-2.0 -8,-2.5 -2,-0.3 2,-0.3 -0.967 19.7-164.3-146.7 162.7 70.6 18.6 7.7 13 17 A C E - B 0 86A 26 73,-1.8 73,-2.7 -2,-0.3 2,-1.2 -0.946 20.4-141.7-146.5 119.4 68.6 15.6 6.7 14 18 A D E + B 0 85A 55 -2,-0.3 3,-0.2 71,-0.2 71,-0.2 -0.727 21.7 177.5 -85.1 97.4 64.8 15.8 6.3 15 19 A K E S+ 0 0 85 -2,-1.2 2,-0.3 69,-0.9 366,-0.3 0.809 78.9 14.5 -70.7 -29.7 63.7 12.4 7.7 16 20 A V E S- B 0 84A 14 68,-2.0 68,-2.6 -3,-0.1 -1,-0.3 -0.937 83.1-135.8-145.7 117.7 60.1 13.3 7.2 17 21 A V - 0 0 85 -2,-0.3 62,-0.1 -3,-0.2 68,-0.0 -0.599 31.7-108.7 -77.3 136.6 59.1 16.2 4.9 18 22 A G - 0 0 11 -2,-0.3 64,-0.2 1,-0.1 63,-0.2 -0.139 13.1-148.1 -61.5 158.0 56.4 18.4 6.4 19 23 A Y S S+ 0 0 66 62,-1.5 63,-0.2 61,-0.1 -1,-0.1 0.570 76.6 53.9-102.4 -14.4 52.9 18.4 4.9 20 24 A G S S- 0 0 21 61,-2.2 2,-0.0 1,-0.2 103,-0.0 -0.060 97.2 -43.8-103.6-157.8 52.2 22.1 5.7 21 25 A P - 0 0 93 0, 0.0 60,-2.7 0, 0.0 -1,-0.2 -0.279 59.1-101.4 -70.6 154.1 53.7 25.6 5.2 22 26 A E B -G 80 0B 115 58,-0.2 58,-0.2 1,-0.1 49,-0.1 -0.343 47.1 -91.7 -74.2 157.8 57.3 26.6 5.6 23 27 A A - 0 0 4 56,-1.6 2,-0.4 47,-0.4 -1,-0.1 -0.346 40.5-148.0 -67.5 152.4 58.4 28.4 8.8 24 28 A V > - 0 0 31 539,-0.1 3,-1.8 -3,-0.1 33,-0.3 -0.982 22.3-100.6-127.2 139.5 58.3 32.2 8.8 25 29 A K T 3 S+ 0 0 122 -2,-0.4 33,-0.2 1,-0.2 3,-0.1 -0.246 105.5 20.0 -57.1 137.1 60.6 34.6 10.6 26 30 A G T 3 S+ 0 0 0 31,-2.8 -1,-0.2 1,-0.3 2,-0.2 0.254 91.1 134.5 88.6 -12.1 59.2 36.1 13.8 27 31 A Q < - 0 0 23 -3,-1.8 30,-2.4 30,-0.2 2,-0.6 -0.480 57.8-128.2 -75.9 137.7 56.6 33.4 14.2 28 32 A L E +C 56 0A 62 535,-0.5 97,-2.8 28,-0.2 2,-0.3 -0.770 42.7 177.2 -82.8 120.7 56.0 31.7 17.6 29 33 A I E -CD 55 124A 1 26,-3.2 26,-1.9 -2,-0.6 2,-0.4 -0.826 28.8-125.6-127.8 167.0 56.2 28.0 16.9 30 34 A K E +CD 54 123A 47 93,-3.3 92,-1.8 -2,-0.3 93,-1.2 -0.935 29.9 171.7-113.8 132.4 56.1 24.7 18.7 31 35 A A E -CD 53 121A 0 22,-1.8 22,-3.2 -2,-0.4 2,-0.3 -0.999 22.6-155.5-143.1 140.8 58.8 22.0 18.5 32 36 A H E + D 0 120A 0 88,-1.9 88,-2.9 -2,-0.4 2,-0.3 -0.826 32.2 166.8-104.7 150.5 59.6 18.8 20.2 33 37 A Y E - D 0 119A 10 -2,-0.3 13,-2.4 86,-0.2 14,-0.6 -0.996 35.2-149.0-162.8 161.4 63.3 17.8 20.1 34 38 A V E -ED 45 118A 14 84,-1.3 84,-2.1 -2,-0.3 2,-0.5 -0.996 19.7-158.9-134.7 126.7 66.1 15.6 21.4 35 39 A G E +ED 44 117A 0 9,-3.2 8,-2.3 -2,-0.4 9,-1.3 -0.952 15.3 175.9-113.7 128.0 69.6 17.0 21.5 36 40 A K E -ED 42 116A 92 80,-3.0 80,-2.6 -2,-0.5 6,-0.2 -0.935 27.6-126.9-129.8 153.4 72.6 14.7 21.6 37 41 A L E > - D 0 115A 20 4,-2.4 3,-2.4 -2,-0.3 78,-0.1 -0.490 46.7 -94.2 -87.1 166.9 76.4 15.1 21.5 38 42 A E T 3 S+ 0 0 88 76,-0.5 -1,-0.1 1,-0.3 77,-0.1 0.529 124.2 62.3 -62.4 -6.2 78.3 13.1 18.9 39 43 A N T 3 S- 0 0 126 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.395 122.2-103.5 -98.6 3.4 78.9 10.2 21.3 40 44 A G S < S+ 0 0 47 -3,-2.4 2,-0.5 1,-0.3 -2,-0.1 0.430 72.9 144.2 93.1 -0.8 75.1 9.7 21.6 41 45 A K - 0 0 99 1,-0.1 -4,-2.4 -4,-0.0 2,-0.5 -0.615 47.4-135.0 -76.8 123.3 74.6 11.3 25.0 42 46 A V E +E 36 0A 73 -2,-0.5 -6,-0.3 -6,-0.2 3,-0.1 -0.660 25.7 177.1 -77.9 122.3 71.3 13.1 25.2 43 47 A F E - 0 0 19 -8,-2.3 2,-0.3 -2,-0.5 -7,-0.2 0.578 64.8 -4.6-101.6 -13.2 71.9 16.5 26.8 44 48 A D E +E 35 0A 35 -9,-1.3 -9,-3.2 5,-0.0 -1,-0.3 -0.932 58.5 177.1-174.0 150.2 68.4 17.9 26.6 45 49 A S E > -E 34 0A 10 -2,-0.3 4,-1.3 -11,-0.2 -11,-0.2 -0.973 37.5-129.5-161.4 148.0 65.0 17.1 25.2 46 50 A S T 4>S+ 0 0 1 -13,-2.4 5,-1.7 -2,-0.3 4,-0.4 0.904 112.3 59.2 -62.1 -39.7 61.5 18.5 25.1 47 51 A Y T >45S+ 0 0 22 -14,-0.6 3,-1.0 1,-0.3 -1,-0.2 0.864 102.9 49.8 -56.4 -42.1 60.3 15.1 26.3 48 52 A N T 345S+ 0 0 136 1,-0.3 -1,-0.3 2,-0.1 -2,-0.2 0.826 111.0 50.6 -68.2 -29.8 62.4 15.2 29.4 49 53 A R T 3<5S- 0 0 144 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.453 110.5-127.5 -86.6 -1.2 60.9 18.7 30.1 50 54 A G T < 5S+ 0 0 39 -3,-1.0 -3,-0.2 -4,-0.4 -2,-0.1 0.644 77.9 62.7 65.1 17.0 57.4 17.3 29.6 51 55 A K S -C 28 0A 32 -2,-0.3 3,-0.6 -28,-0.3 5,-0.5 -0.774 44.2-139.0 -91.2 124.2 59.9 32.7 18.3 57 61 A I T 3 S+ 0 0 0 -30,-2.4 -31,-2.8 -2,-0.5 -30,-0.2 -0.564 73.3 15.3 -87.9 149.5 62.0 31.6 15.3 58 62 A G T 3 S+ 0 0 16 -33,-0.2 -1,-0.2 -2,-0.2 -33,-0.1 0.573 98.7 92.0 71.3 13.9 64.6 33.6 13.4 59 63 A V S < S- 0 0 47 -3,-0.6 -2,-0.1 -34,-0.0 -1,-0.1 0.234 104.8 -94.1-122.8 14.5 65.0 36.3 16.0 60 64 A G S S+ 0 0 58 3,-0.1 4,-0.1 -4,-0.1 -3,-0.1 0.712 86.6 125.2 83.3 21.7 67.9 35.0 18.1 61 65 A E S S+ 0 0 116 -5,-0.5 2,-0.2 2,-0.1 -4,-0.1 0.685 78.9 27.1 -83.9 -18.7 65.8 33.3 20.8 62 66 A V S S- 0 0 33 1,-0.2 5,-0.1 -6,-0.1 -2,-0.1 -0.777 110.5 -61.0-131.8 174.4 67.7 30.0 20.2 63 67 A I >> - 0 0 17 -2,-0.2 4,-1.7 1,-0.1 3,-1.4 -0.194 52.1-111.2 -58.2 152.6 71.2 29.1 18.9 64 68 A K H 3> S+ 0 0 131 30,-0.3 4,-3.1 1,-0.3 5,-0.4 0.856 116.3 63.0 -52.9 -39.0 71.9 30.3 15.3 65 69 A G H 3> S+ 0 0 0 28,-2.7 4,-1.8 1,-0.2 -1,-0.3 0.795 104.4 47.4 -59.0 -29.7 71.9 26.7 14.1 66 70 A W H <> S+ 0 0 10 -3,-1.4 4,-1.6 27,-0.3 5,-0.4 0.932 112.5 47.5 -77.7 -45.9 68.2 26.4 15.1 67 71 A D H X S+ 0 0 19 -4,-1.7 4,-2.2 1,-0.2 5,-0.4 0.940 122.2 35.8 -58.8 -48.3 67.2 29.7 13.4 68 72 A Q H X S+ 0 0 49 -4,-3.1 4,-1.5 1,-0.2 -1,-0.2 0.887 117.4 52.7 -73.1 -39.1 69.1 28.8 10.3 69 73 A G H < S+ 0 0 0 -4,-1.8 -1,-0.2 -5,-0.4 -2,-0.2 0.642 120.8 31.4 -72.7 -16.7 68.3 25.1 10.4 70 74 A I H < S+ 0 0 2 -4,-1.6 9,-2.6 -3,-0.2 -47,-0.4 0.757 128.5 35.5-106.8 -43.9 64.5 25.6 10.8 71 75 A L H < S- 0 0 37 -4,-2.2 -3,-0.2 -5,-0.4 -2,-0.2 0.763 111.8-124.5 -80.7 -26.5 64.0 28.8 8.8 72 76 A G < - 0 0 19 -4,-1.5 2,-0.3 -5,-0.4 -1,-0.2 -0.223 29.6-164.4 102.2 165.1 66.6 27.9 6.3 73 77 A S B > -H 76 0C 54 3,-2.1 3,-3.2 -4,-0.1 2,-0.0 -0.903 52.5 -31.1-167.1-175.8 69.7 29.7 5.0 74 78 A D T 3 S+ 0 0 131 1,-0.3 -66,-0.3 -2,-0.3 -2,-0.1 -0.344 138.0 6.4 -52.7 124.3 72.1 29.5 2.1 75 79 A G T 3 S+ 0 0 49 -69,-0.2 -1,-0.3 1,-0.1 -3,-0.0 0.453 116.7 94.2 79.8 -2.0 72.2 25.8 1.2 76 80 A I B < -H 73 0C 8 -3,-3.2 -3,-2.1 -65,-0.1 -1,-0.1 -0.937 62.1-150.6-131.5 113.8 69.4 25.0 3.7 77 81 A P - 0 0 66 0, 0.0 -5,-0.2 0, 0.0 -3,-0.0 -0.403 35.1 -97.4 -73.4 152.7 65.7 24.8 2.7 78 82 A P - 0 0 34 0, 0.0 -7,-0.2 0, 0.0 2,-0.2 -0.307 35.8-110.3 -70.4 157.0 63.1 25.7 5.4 79 83 A M - 0 0 2 -9,-2.6 -56,-1.6 -62,-0.1 2,-0.3 -0.534 33.1-134.1 -79.1 154.2 61.4 23.0 7.5 80 84 A L B > -G 22 0B 53 -58,-0.2 3,-1.8 -2,-0.2 -58,-0.2 -0.841 33.4 -81.3-111.5 151.3 57.7 22.6 6.7 81 85 A T T 3 S+ 0 0 24 -60,-2.7 -61,-2.2 -2,-0.3 -62,-1.5 -0.209 118.5 19.5 -49.5 127.0 54.9 22.3 9.3 82 86 A G T 3 S+ 0 0 10 39,-2.7 -1,-0.3 1,-0.3 40,-0.2 0.587 95.9 136.6 87.8 10.2 54.8 18.7 10.5 83 87 A G < - 0 0 2 -3,-1.8 38,-1.7 38,-0.5 2,-0.5 -0.465 46.4-144.8 -91.8 162.7 58.3 17.8 9.4 84 88 A K E +BF 16 120A 33 -68,-2.6 -68,-2.0 36,-0.2 -69,-0.9 -0.995 25.9 176.0-124.9 123.8 61.0 15.9 11.2 85 89 A R E -BF 14 119A 0 34,-2.6 34,-3.6 -2,-0.5 2,-0.5 -0.980 24.5-146.5-134.8 142.1 64.5 17.0 10.6 86 90 A T E -BF 13 118A 7 -73,-2.7 -73,-1.8 -2,-0.4 2,-0.4 -0.911 21.3-164.7-105.5 132.0 68.0 16.1 11.9 87 91 A L E -BF 12 117A 0 30,-2.7 30,-2.1 -2,-0.5 2,-0.6 -0.933 14.8-158.5-118.8 142.0 70.5 18.9 12.2 88 92 A R E -BF 11 116A 87 -77,-2.8 -77,-2.5 -2,-0.4 28,-0.2 -0.982 20.6-167.4-116.9 115.1 74.2 18.7 12.7 89 93 A I E - F 0 115A 0 26,-3.1 26,-2.8 -2,-0.6 -79,-0.1 -0.918 14.1-139.5-115.5 117.6 75.4 22.0 14.2 90 94 A P > - 0 0 31 0, 0.0 3,-2.1 0, 0.0 6,-0.2 -0.344 33.3-107.1 -66.9 152.9 79.0 23.1 14.3 91 95 A P G > >S+ 0 0 26 0, 0.0 5,-2.5 0, 0.0 3,-2.4 0.824 116.6 65.8 -48.9 -40.4 80.0 24.9 17.6 92 96 A E G 3 5S+ 0 0 169 1,-0.3 -28,-0.1 3,-0.2 5,-0.1 0.739 107.5 41.0 -58.8 -22.8 80.2 28.3 15.9 93 97 A L G < 5S+ 0 0 17 -3,-2.1 -28,-2.7 -29,-0.1 -1,-0.3 0.148 127.1 33.0-108.2 15.4 76.5 28.1 15.3 94 98 A A T < 5S- 0 0 13 -3,-2.4 -30,-0.3 -30,-0.2 20,-0.1 0.089 128.8 -33.8-132.4-114.0 75.8 26.7 18.8 95 99 A Y T >>5S- 0 0 69 18,-0.3 4,-2.0 1,-0.2 3,-1.0 0.302 73.1-164.1-104.8 8.8 77.6 27.3 22.1 96 100 A G T 34< - 0 0 21 -5,-2.5 16,-3.1 1,-0.2 17,-0.5 -0.018 58.9 -23.2 49.6-143.2 81.1 27.7 20.7 97 101 A D T 34 S+ 0 0 141 14,-0.3 -1,-0.2 1,-0.2 -5,-0.0 0.612 133.2 63.9 -78.1 -12.0 84.2 27.6 23.0 98 102 A R T <4 S- 0 0 170 -3,-1.0 -2,-0.2 1,-0.1 -1,-0.2 0.908 85.8-161.9 -77.5 -45.7 82.1 28.5 26.0 99 103 A G < - 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