==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE/IMMUNOSUPPRESSANT 06-APR-09 2WFJ . COMPND 2 MOLECULE: PEPTIDYL-PROLYL CIS-TRANS ISOMERASE G; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.M.STEGMANN,G.M.SHELDRICK,M.C.WAHL . 183 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8036.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 109 59.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 1.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 51 27.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 13 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 21 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 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 0 PARALLEL BRIDGES PER LADDER . 4 0 3 2 0 0 1 1 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 6 A Q 0 0 146 0, 0.0 24,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -15.2 35.0 38.8 10.3 2 7 A R - 0 0 100 1,-0.1 22,-0.1 22,-0.0 2,-0.0 -0.482 360.0-131.0 -73.5 129.1 32.6 41.4 11.5 3 8 A P - 0 0 21 0, 0.0 20,-2.6 0, 0.0 2,-0.4 -0.343 11.1-144.9 -73.6 159.4 34.2 44.5 13.0 4 9 A R E -A 22 0A 127 18,-0.2 168,-2.8 -2,-0.0 2,-0.3 -0.983 19.0-178.1-124.7 130.8 33.3 46.0 16.3 5 10 A C E -AB 21 171A 0 16,-2.0 16,-2.9 -2,-0.4 2,-0.3 -0.849 6.5-154.9-125.2 163.1 33.4 49.8 16.9 6 11 A F E -AB 20 170A 24 164,-2.4 164,-1.8 -2,-0.3 2,-0.4 -0.981 12.7-158.9-141.7 155.3 32.8 52.0 19.9 7 12 A F E -AB 19 169A 0 12,-2.5 12,-2.8 -2,-0.3 2,-0.6 -0.999 12.4-150.9-124.3 133.5 31.7 55.4 21.0 8 13 A D E -AB 18 168A 31 160,-3.0 159,-2.3 -2,-0.4 160,-1.1 -0.930 29.1-153.2 -96.6 122.6 32.5 56.8 24.5 9 14 A I E -AB 17 166A 1 8,-2.7 7,-3.1 -2,-0.6 8,-1.0 -0.763 18.4-171.0-104.5 143.1 29.6 59.3 25.1 10 15 A A E -AB 15 165A 0 155,-2.5 155,-2.4 -2,-0.3 2,-0.5 -0.968 10.1-155.9-124.0 149.5 29.4 62.4 27.3 11 16 A I E > S-AB 14 164A 15 3,-2.4 3,-1.4 -2,-0.4 153,-0.2 -0.984 88.6 -13.5-124.4 113.2 26.2 64.3 28.0 12 17 A N T 3 S- 0 0 106 151,-2.7 -1,-0.2 -2,-0.5 152,-0.1 0.924 130.9 -56.6 50.4 47.9 27.0 67.9 28.9 13 18 A N T 3 S+ 0 0 106 150,-0.5 -1,-0.2 1,-0.2 151,-0.1 0.491 112.8 121.8 65.9 11.9 30.6 66.8 29.3 14 19 A Q E < S-A 11 0A 140 -3,-1.4 -3,-2.4 2,-0.0 -1,-0.2 -0.881 71.0-114.3-102.0 118.4 29.7 64.2 31.8 15 20 A P E +A 10 0A 108 0, 0.0 -5,-0.3 0, 0.0 3,-0.1 -0.324 33.5 179.2 -56.6 134.2 30.8 60.7 30.7 16 21 A A E - 0 0 24 -7,-3.1 2,-0.2 1,-0.4 -6,-0.2 0.548 45.8 -96.3-110.2 -17.0 27.8 58.5 30.2 17 22 A G E -A 9 0A 33 -8,-1.0 -8,-2.7 128,-0.1 2,-0.4 -0.679 44.4 -56.3 123.4-180.0 29.5 55.2 29.1 18 23 A R E -A 8 0A 102 -10,-0.2 2,-0.5 -2,-0.2 -10,-0.2 -0.835 30.6-158.1-107.2 134.7 30.5 53.3 26.0 19 24 A V E -A 7 0A 1 -12,-2.8 -12,-2.5 -2,-0.4 2,-0.4 -0.949 13.7-162.8-106.2 128.5 28.3 52.0 23.1 20 25 A V E -AC 6 141A 12 121,-2.4 120,-3.0 -2,-0.5 121,-1.4 -0.951 4.7-164.7-114.9 137.1 29.7 49.1 21.2 21 26 A F E -AC 5 139A 0 -16,-2.9 -16,-2.0 -2,-0.4 2,-0.4 -0.901 14.7-147.5-117.9 144.1 28.5 48.2 17.7 22 27 A E E -AC 4 138A 39 116,-2.7 116,-2.1 -2,-0.4 2,-0.4 -0.946 22.5-144.9-103.2 134.4 28.9 45.1 15.5 23 28 A L E - C 0 137A 0 -20,-2.6 2,-2.1 -2,-0.4 114,-0.3 -0.865 10.2-134.1-106.3 132.7 29.0 46.0 11.8 24 29 A F >> + 0 0 16 112,-2.9 4,-2.7 -2,-0.4 3,-1.7 -0.423 39.4 160.4 -84.2 69.6 27.4 43.6 9.2 25 30 A S T 34 + 0 0 31 -2,-2.1 -1,-0.2 1,-0.3 8,-0.1 0.721 69.8 62.6 -67.5 -21.2 30.4 43.7 6.8 26 31 A D T 34 S+ 0 0 102 -3,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.658 113.4 34.8 -70.9 -24.7 29.2 40.5 5.2 27 32 A V T <4 S+ 0 0 47 -3,-1.7 -2,-0.2 109,-0.1 -1,-0.1 0.758 137.7 10.2 -99.0 -46.1 25.9 42.3 4.1 28 33 A C X + 0 0 0 -4,-2.7 4,-2.7 108,-0.2 5,-0.2 -0.548 67.3 167.3-143.0 79.2 27.0 45.8 3.4 29 34 A P H > S+ 0 0 68 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.859 76.0 51.9 -63.6 -40.2 30.7 46.1 3.3 30 35 A K H > S+ 0 0 100 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.902 113.0 46.7 -66.3 -38.2 31.1 49.5 1.7 31 36 A T H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.922 113.9 47.9 -66.7 -43.6 28.7 51.0 4.3 32 37 A C H X S+ 0 0 2 -4,-2.7 4,-2.9 1,-0.2 5,-0.2 0.905 108.8 53.4 -65.3 -40.4 30.5 49.3 7.2 33 38 A E H X S+ 0 0 68 -4,-2.5 4,-2.6 -5,-0.2 -1,-0.2 0.893 107.4 52.4 -64.4 -38.0 33.9 50.4 6.0 34 39 A N H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.958 113.2 43.0 -58.3 -52.5 32.8 54.0 5.9 35 40 A F H X S+ 0 0 0 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.923 113.3 52.1 -61.5 -45.2 31.5 53.9 9.5 36 41 A R H X S+ 0 0 27 -4,-2.9 4,-1.6 1,-0.2 -1,-0.2 0.931 111.8 46.2 -56.4 -48.6 34.5 51.9 10.7 37 42 A C H X>S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 5,-0.5 0.842 107.8 56.0 -67.1 -33.5 36.9 54.5 9.2 38 43 A L H <5S+ 0 0 0 -4,-2.1 17,-2.7 1,-0.2 18,-0.4 0.838 106.9 52.8 -66.3 -29.2 34.8 57.4 10.6 39 44 A C H <5S+ 0 0 0 -4,-1.9 -2,-0.2 15,-0.2 -1,-0.2 0.882 118.0 34.5 -69.5 -38.0 35.4 55.8 14.0 40 45 A T H <5S- 0 0 44 -4,-1.6 -2,-0.2 130,-0.2 -1,-0.2 0.730 93.8-137.7 -88.2 -23.2 39.2 55.6 13.6 41 46 A G T ><5 + 0 0 19 -4,-2.4 3,-1.7 12,-0.2 12,-0.2 0.523 57.9 138.0 77.3 6.8 39.7 58.8 11.6 42 47 A E T 3 < + 0 0 105 -5,-0.5 -4,-0.1 1,-0.3 12,-0.1 0.643 56.4 62.9 -66.5 -17.9 42.2 56.9 9.4 43 48 A K T 3 S- 0 0 109 -6,-0.4 2,-0.3 10,-0.4 -1,-0.3 0.456 92.5-147.5 -90.7 1.1 41.0 58.3 6.1 44 49 A G < + 0 0 38 -3,-1.7 9,-3.2 9,-0.2 2,-0.3 -0.534 51.6 10.3 80.3-132.5 42.0 61.9 6.9 45 50 A T B S-I 52 0B 80 -2,-0.3 2,-0.1 7,-0.3 5,-0.0 -0.695 72.0-114.1-102.5 142.4 40.1 64.9 5.6 46 51 A G > - 0 0 0 5,-3.1 4,-1.9 -2,-0.3 39,-0.1 -0.376 21.9-134.2 -69.6 138.2 36.8 64.9 3.8 47 52 A K T 4 S+ 0 0 162 37,-0.3 -1,-0.1 2,-0.2 38,-0.1 0.956 99.6 25.3 -65.5 -51.7 37.1 66.0 0.1 48 53 A S T 4 S+ 0 0 86 1,-0.2 -1,-0.2 3,-0.0 -2,-0.1 0.839 129.0 43.3 -80.6 -34.9 34.1 68.4 0.0 49 54 A T T 4 S- 0 0 30 2,-0.2 -2,-0.2 39,-0.0 -1,-0.2 0.750 86.0-148.7 -83.8 -26.3 34.0 69.3 3.7 50 55 A Q < + 0 0 132 -4,-1.9 -3,-0.1 1,-0.2 -5,-0.1 0.784 62.0 112.2 56.8 33.0 37.7 69.7 4.2 51 56 A K S S- 0 0 104 -5,-0.1 -5,-3.1 -7,-0.0 -1,-0.2 -0.901 81.3 -75.9-126.8 161.1 37.2 68.5 7.8 52 57 A P B -I 45 0B 84 0, 0.0 2,-2.0 0, 0.0 -7,-0.3 -0.305 34.3-129.8 -62.3 135.2 38.4 65.3 9.4 53 58 A L S S+ 0 0 6 -9,-3.2 -10,-0.4 -12,-0.2 2,-0.3 -0.567 71.9 117.0 -77.2 78.6 36.5 62.2 8.5 54 59 A H - 0 0 52 -2,-2.0 -15,-0.2 2,-0.1 -16,-0.1 -0.973 64.2-148.7-158.6 133.2 36.2 61.4 12.1 55 60 A Y > + 0 0 0 -17,-2.7 3,-2.5 -2,-0.3 111,-0.3 0.493 61.2 122.4 -81.9 -5.6 33.4 61.0 14.7 56 61 A K T 3 S+ 0 0 107 -18,-0.4 111,-0.2 1,-0.3 3,-0.1 -0.408 87.7 5.7 -65.6 129.0 35.6 62.2 17.5 57 62 A S T 3 S+ 0 0 64 109,-3.2 -1,-0.3 1,-0.3 2,-0.1 0.429 99.6 141.1 77.6 2.6 33.9 65.2 19.1 58 63 A C < - 0 0 7 -3,-2.5 108,-2.7 108,-0.2 -1,-0.3 -0.428 43.7-130.1 -76.2 149.0 30.8 64.7 16.9 59 64 A L B -D 165 0A 31 14,-0.3 13,-1.3 106,-0.2 2,-0.8 -0.582 13.1-126.5 -92.8 158.6 27.3 65.2 18.3 60 65 A F + 0 0 2 104,-2.3 104,-0.4 11,-0.2 11,-0.3 -0.925 40.0 179.1 -90.0 100.9 24.1 63.2 18.4 61 66 A H + 0 0 8 -2,-0.8 2,-0.4 9,-0.5 10,-0.2 0.527 55.0 43.1 -90.5 -8.0 22.2 66.2 17.0 62 67 A R E +E 70 0A 11 8,-1.7 8,-3.1 97,-0.2 2,-0.4 -0.976 58.6 174.5-146.4 126.1 18.7 64.8 16.7 63 68 A V E -E 69 0A 4 95,-2.6 2,-0.4 -2,-0.4 6,-0.2 -1.000 5.9-179.1-133.2 131.8 16.8 62.6 19.2 64 69 A V E >> -E 68 0A 39 4,-2.6 3,-1.9 -2,-0.4 4,-1.4 -0.947 30.3-125.9-133.7 110.6 13.2 61.5 19.1 65 70 A K T 34 S+ 0 0 100 -2,-0.4 86,-0.1 1,-0.3 82,-0.0 -0.248 95.0 14.2 -57.2 137.5 11.9 59.4 22.0 66 71 A D T 34 S+ 0 0 94 1,-0.1 -1,-0.3 57,-0.1 56,-0.0 0.606 128.9 57.1 70.0 18.2 10.4 56.1 20.9 67 72 A F T <4 S- 0 0 5 -3,-1.9 56,-2.5 1,-0.2 57,-0.8 0.489 103.5 -59.1-134.2 -78.0 11.9 56.5 17.5 68 73 A M E < -EF 64 122A 0 -4,-1.4 -4,-2.6 54,-0.3 2,-0.4 -0.981 28.8-119.0-165.6 169.3 15.7 56.9 17.1 69 74 A V E -EF 63 121A 0 52,-1.9 52,-2.6 -2,-0.3 2,-0.4 -0.988 31.6-160.3-122.5 141.7 18.8 58.9 18.0 70 75 A Q E +EF 62 120A 0 -8,-3.1 -8,-1.7 -2,-0.4 -9,-0.5 -0.940 21.7 138.1-129.6 139.0 20.9 60.4 15.1 71 76 A G E + F 0 119A 0 48,-2.2 48,-2.0 -2,-0.4 -11,-0.2 -0.821 23.1 103.5-154.1-166.9 24.4 61.7 14.8 72 77 A G + 0 0 0 -13,-1.3 2,-1.7 46,-0.2 3,-0.1 0.475 39.4 134.3 100.4 2.2 27.5 61.8 12.6 73 78 A D > + 0 0 3 -14,-0.5 4,-1.4 1,-0.2 -14,-0.3 -0.625 22.6 167.7 -85.4 84.7 27.4 65.3 11.2 74 79 A F T 4 + 0 0 31 -2,-1.7 -1,-0.2 1,-0.2 -2,-0.0 0.684 69.1 47.2 -73.6 -18.8 31.0 66.0 11.8 75 80 A S T 4 S+ 0 0 22 -3,-0.1 -1,-0.2 -24,-0.1 -2,-0.1 0.791 130.8 9.7 -96.3 -32.0 31.1 69.2 9.7 76 81 A E T 4 S- 0 0 104 0, 0.0 -2,-0.2 0, 0.0 -3,-0.1 0.529 79.0-142.0-124.3 -16.8 28.0 71.1 10.8 77 82 A G S < S+ 0 0 14 -4,-1.4 -3,-0.1 1,-0.1 -5,-0.0 0.660 84.1 77.2 65.8 18.8 26.7 69.3 13.9 78 83 A N S S- 0 0 63 -7,-0.0 102,-0.2 81,-0.0 -1,-0.1 0.377 111.4 -91.0-143.5 4.0 23.1 69.9 12.9 79 84 A G S S+ 0 0 0 100,-0.1 102,-0.1 -6,-0.0 39,-0.1 0.116 107.4 89.4 100.6 -18.5 22.1 67.4 10.1 80 85 A R S S+ 0 0 157 100,-0.1 99,-0.1 99,-0.1 101,-0.0 0.757 84.6 51.9 -81.2 -23.5 23.1 69.6 7.1 81 86 A G + 0 0 3 -8,-0.1 36,-0.2 2,-0.0 37,-0.2 0.087 58.4 99.7 -99.8-158.3 26.7 68.4 6.9 82 87 A G - 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