==== 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 ISOMERASE/IMMUNOSUPPRESSANT 07-JAN-94 2RMA . COMPND 2 MOLECULE: PEPTIDYL-PROLYL CIS-TRANS ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR H.KE,D.MAYROSE . 1760 20 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 60981.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1108 63.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 20 1.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 489 27.8 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 . 11 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 20 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 4 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 7 0.4 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 . 156 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 159 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 195 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 10 0 0 0 10 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 10 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 . 34 0 34 16 0 0 11 9 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 2 3 0 0 0 0 10 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 M 0 0 87 0, 0.0 2,-0.3 0, 0.0 295,-0.1 0.000 360.0 360.0 360.0-161.1 51.7 22.5 48.2 2 2 A V - 0 0 122 163,-0.1 24,-0.0 24,-0.0 163,-0.0 -0.855 360.0-106.8-110.0 147.7 53.2 22.1 51.7 3 3 A N - 0 0 29 -2,-0.3 22,-0.1 1,-0.1 162,-0.0 -0.655 39.3-131.5 -74.3 119.4 51.0 21.7 54.8 4 4 A P - 0 0 14 0, 0.0 20,-2.3 0, 0.0 2,-0.4 -0.227 11.6-147.2 -69.6 155.7 51.1 25.0 56.8 5 5 A T E -A 23 0A 2 18,-0.2 159,-3.1 32,-0.0 160,-1.0 -0.995 15.6-172.7-124.8 127.3 51.8 25.1 60.6 6 6 A V E -AB 22 163A 0 16,-1.6 16,-2.8 -2,-0.4 2,-0.3 -0.746 8.2-146.8-113.3 164.6 50.1 27.8 62.8 7 7 A F E -AB 21 162A 25 155,-2.4 155,-1.5 14,-0.3 2,-0.4 -0.956 6.2-160.4-133.4 154.4 50.6 28.7 66.4 8 8 A F E -AB 20 161A 0 12,-2.4 12,-2.5 -2,-0.3 2,-0.7 -0.989 10.9-150.3-128.8 131.8 48.5 30.0 69.3 9 9 A D E -AB 19 160A 41 151,-2.8 150,-2.7 -2,-0.4 151,-1.0 -0.955 23.9-149.5-105.5 115.5 50.0 31.6 72.4 10 10 A I E -AB 18 158A 5 8,-3.1 7,-3.0 -2,-0.7 8,-1.5 -0.691 14.2-170.2 -90.4 141.1 47.5 30.8 75.1 11 11 A A E -AB 16 157A 5 146,-2.1 146,-2.8 -2,-0.3 2,-0.5 -0.998 13.5-150.6-133.5 131.3 46.9 33.1 78.1 12 12 A V E > S-AB 15 156A 18 3,-2.6 3,-2.1 -2,-0.4 144,-0.2 -0.907 86.0 -25.5-102.0 122.1 45.0 32.3 81.3 13 13 A D T 3 S- 0 0 96 142,-2.2 -1,-0.2 -2,-0.5 143,-0.1 0.577 128.4 -50.0 46.1 16.8 43.4 35.5 82.7 14 14 A G T 3 S+ 0 0 55 1,-0.5 -1,-0.3 141,-0.3 142,-0.0 -0.070 114.3 115.7 116.5 -31.3 46.2 37.5 81.0 15 15 A E E < S-A 12 0A 145 -3,-2.1 -3,-2.6 1,-0.1 -1,-0.5 -0.511 75.3-110.2 -71.3 127.1 49.1 35.4 82.3 16 16 A P E +A 11 0A 114 0, 0.0 -5,-0.3 0, 0.0 -1,-0.1 -0.423 37.1 175.6 -54.3 122.5 51.0 33.5 79.5 17 17 A L E - 0 0 55 -7,-3.0 2,-0.3 1,-0.3 -6,-0.2 0.796 49.3 -86.6 -97.8 -43.5 50.4 29.8 79.7 18 18 A G E -A 10 0A 23 -8,-1.5 -8,-3.1 2,-0.0 2,-0.3 -0.891 40.0 -71.6 155.2 176.8 52.3 28.6 76.6 19 19 A R E -A 9 0A 113 -2,-0.3 2,-0.4 -10,-0.2 -10,-0.2 -0.796 26.9-166.9-108.1 142.8 52.3 28.0 72.8 20 20 A V E -A 8 0A 1 -12,-2.5 -12,-2.4 -2,-0.3 2,-0.4 -0.988 9.6-164.3-121.5 129.8 50.5 25.3 70.9 21 21 A S E -AC 7 134A 13 113,-2.9 112,-2.4 -2,-0.4 113,-1.1 -0.906 6.1-160.8-115.0 152.6 51.4 24.8 67.2 22 22 A F E -AC 6 132A 0 -16,-2.8 -16,-1.6 -2,-0.4 2,-0.5 -0.962 16.8-138.1-133.6 144.7 49.3 22.8 64.7 23 23 A E E -AC 5 131A 58 108,-3.0 108,-2.1 -2,-0.4 2,-0.5 -0.879 23.3-149.9 -97.2 135.3 49.9 21.1 61.4 24 24 A L E - C 0 130A 0 -20,-2.3 2,-2.1 -2,-0.5 106,-0.3 -0.930 12.5-132.0-110.5 128.2 46.9 21.8 59.0 25 25 A F >> + 0 0 36 104,-2.2 4,-2.7 -2,-0.5 3,-1.5 -0.443 41.7 156.8 -84.5 72.5 46.2 19.1 56.5 26 26 A A T 34 + 0 0 20 -2,-2.1 -1,-0.2 1,-0.3 8,-0.1 0.741 69.9 68.1 -67.5 -20.7 45.9 21.1 53.4 27 27 A D T 34 S+ 0 0 62 -3,-0.2 272,-0.4 2,-0.2 271,-0.3 0.627 115.3 25.2 -73.6 -12.8 46.7 17.9 51.4 28 28 A K T <4 S+ 0 0 41 -3,-1.5 -2,-0.2 270,-0.1 61,-0.1 0.712 140.0 18.1-113.5 -47.6 43.4 16.5 52.5 29 29 A V X + 0 0 0 -4,-2.7 4,-2.6 1,-0.1 5,-0.2 -0.625 67.0 167.9-128.3 71.0 41.1 19.4 53.2 30 30 A P H > S+ 0 0 6 0, 0.0 4,-2.0 0, 0.0 -1,-0.1 0.830 76.6 47.2 -55.7 -37.1 42.6 22.5 51.5 31 31 A K H > S+ 0 0 13 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.909 115.1 45.5 -76.1 -40.1 39.6 24.9 51.8 32 32 A T H > S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.931 115.5 48.5 -66.6 -43.4 39.0 24.1 55.5 33 33 A A H X S+ 0 0 0 -4,-2.6 4,-2.5 -8,-0.2 -2,-0.2 0.899 108.8 51.6 -67.1 -38.6 42.7 24.4 56.2 34 34 A E H X S+ 0 0 25 -4,-2.0 4,-3.1 -5,-0.2 5,-0.3 0.922 107.6 54.8 -65.5 -39.1 43.1 27.8 54.4 35 35 A N H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 5,-0.2 0.969 111.5 42.0 -54.9 -57.7 40.2 29.2 56.4 36 36 A F H X S+ 0 0 0 -4,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.929 116.2 51.1 -58.4 -43.7 41.8 28.3 59.8 37 37 A R H X S+ 0 0 18 -4,-2.5 4,-2.3 1,-0.2 5,-0.2 0.907 111.6 45.1 -63.6 -44.2 45.2 29.5 58.5 38 38 A A H X>S+ 0 0 0 -4,-3.1 4,-1.7 1,-0.2 5,-0.6 0.838 112.2 52.6 -70.5 -30.0 44.0 32.9 57.2 39 39 A L H <5S+ 0 0 0 -4,-2.3 9,-2.2 -5,-0.3 10,-0.4 0.822 109.0 51.2 -74.6 -28.4 42.0 33.4 60.5 40 40 A S H <5S+ 0 0 2 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.924 114.9 40.4 -73.1 -42.5 45.2 32.7 62.5 41 41 A T H <5S- 0 0 49 -4,-2.3 -2,-0.2 121,-0.2 -1,-0.2 0.813 98.1-140.5 -73.6 -27.8 47.3 35.2 60.5 42 42 A G T ><5 + 0 0 30 -4,-1.7 3,-2.2 -5,-0.2 -3,-0.2 0.614 52.8 143.8 78.4 15.2 44.4 37.7 60.5 43 43 A E T 3 < + 0 0 99 -5,-0.6 -4,-0.1 1,-0.3 4,-0.1 0.629 64.9 56.4 -65.4 -17.4 45.4 38.6 56.9 44 44 A K T 3 S- 0 0 91 -6,-0.6 -1,-0.3 2,-0.5 3,-0.1 0.300 125.5 -99.3 -95.5 9.5 41.7 39.1 55.8 45 45 A G S < S+ 0 0 71 -3,-2.2 2,-0.3 1,-0.2 -2,-0.2 0.585 99.1 59.9 90.9 10.0 41.3 41.7 58.6 46 46 A F + 0 0 60 -8,-0.2 -2,-0.5 -4,-0.1 2,-0.3 -0.960 61.0 116.1-157.5 160.1 39.5 39.5 61.2 47 47 A G - 0 0 17 -2,-0.3 -7,-0.2 2,-0.2 -8,-0.1 -0.996 65.6 -45.7 167.0-161.4 40.6 36.3 63.0 48 48 A Y S > S+ 0 0 0 -9,-2.2 3,-2.2 -2,-0.3 110,-0.3 0.637 78.8 115.3 -83.3 -20.5 41.4 34.4 66.1 49 49 A K T 3 S+ 0 0 121 -10,-0.4 110,-0.2 1,-0.3 -2,-0.2 -0.323 88.7 12.5 -56.6 125.7 43.8 36.8 68.0 50 50 A G T 3 S+ 0 0 39 108,-3.2 -1,-0.3 1,-0.3 109,-0.1 0.198 99.1 121.2 95.1 -15.0 42.1 37.9 71.2 51 51 A S < - 0 0 2 -3,-2.2 107,-2.3 107,-0.2 -1,-0.3 -0.128 50.7-134.2 -77.4 175.2 39.3 35.3 71.2 52 52 A C B -D 157 0A 15 14,-0.4 2,-0.7 105,-0.2 13,-0.6 -0.805 18.1-108.9-125.9 168.7 38.7 32.8 73.9 53 53 A F E -E 64 0A 2 103,-1.6 103,-0.5 -2,-0.3 11,-0.3 -0.895 35.9-175.5 -93.9 114.9 37.9 29.1 74.3 54 54 A H E + 0 0 34 9,-0.9 2,-0.4 -2,-0.7 98,-0.3 0.656 65.1 34.6 -94.0 -13.5 34.3 29.3 75.5 55 55 A R E +E 63 0A 20 8,-1.4 8,-3.3 96,-0.1 2,-0.4 -0.970 60.5 170.6-145.7 117.0 33.6 25.7 76.2 56 56 A I E -E 62 0A 0 94,-2.3 91,-1.7 -2,-0.4 94,-0.3 -0.989 8.0-173.6-131.1 120.4 36.2 23.2 77.6 57 57 A I E >> -E 61 0A 6 4,-2.8 3,-1.7 -2,-0.4 4,-1.7 -0.972 30.2-122.0-118.7 115.0 35.1 19.8 78.8 58 58 A P T 34 S+ 0 0 45 0, 0.0 82,-0.0 0, 0.0 86,-0.0 -0.264 95.5 16.3 -59.5 133.0 37.9 17.9 80.5 59 59 A G T 34 S+ 0 0 18 1,-0.1 56,-0.0 654,-0.1 84,-0.0 0.658 128.3 53.6 76.9 15.4 38.7 14.5 78.8 60 60 A F T <4 S- 0 0 1 -3,-1.7 56,-2.5 1,-0.1 57,-0.7 0.382 105.7 -56.3-137.4 -70.4 36.8 15.5 75.6 61 61 A M E < -EF 57 115A 0 -4,-1.7 -4,-2.8 54,-0.3 2,-0.4 -0.992 27.6-116.6-172.8 168.1 37.8 18.8 74.0 62 62 A C E -EF 56 114A 0 52,-2.0 52,-2.1 -2,-0.3 2,-0.4 -0.993 32.7-158.5-118.9 124.1 38.4 22.6 74.1 63 63 A Q E +EF 55 113A 0 -8,-3.3 -8,-1.4 -2,-0.4 -9,-0.9 -0.867 26.6 135.0-109.1 140.3 36.2 24.6 71.8 64 64 A G E +EF 53 112A 0 48,-2.4 48,-2.0 -2,-0.4 -11,-0.2 -0.779 20.0 104.7-155.7-163.8 36.9 28.1 70.5 65 65 A G + 0 0 0 -13,-0.6 2,-1.6 46,-0.3 11,-0.3 0.406 45.4 126.5 96.9 -3.3 36.9 30.3 67.4 66 66 A D + 0 0 1 -14,-0.5 -14,-0.4 1,-0.2 4,-0.4 -0.690 23.2 160.7 -87.4 90.3 33.9 32.4 68.1 67 67 A F + 0 0 28 -2,-1.6 -1,-0.2 -16,-0.1 -20,-0.1 0.592 67.0 48.4 -87.6 -4.8 35.5 35.7 67.6 68 68 A T S S+ 0 0 39 -3,-0.2 -1,-0.1 1,-0.0 -2,-0.1 0.863 127.6 14.3-102.1 -43.0 32.2 37.7 67.1 69 69 A R S S- 0 0 158 0, 0.0 -2,-0.1 0, 0.0 -3,-0.1 0.514 83.2-148.9-108.3 -10.9 29.8 36.6 69.9 70 70 A H S S+ 0 0 92 -4,-0.4 -4,-0.1 1,-0.2 -3,-0.1 0.540 80.4 73.9 56.8 14.2 32.4 34.9 72.1 71 71 A N S S- 0 0 82 -7,-0.0 -1,-0.2 -16,-0.0 102,-0.1 0.539 116.0 -82.5-133.2 -15.7 29.9 32.5 73.5 72 72 A G S S+ 0 0 1 100,-0.1 39,-0.1 -6,-0.0 -2,-0.1 0.257 107.6 88.4 129.9 -8.6 29.2 29.9 70.7 73 73 A T S S+ 0 0 31 99,-0.1 992,-0.4 100,-0.1 2,-0.1 0.475 87.0 42.1 -98.5 -1.1 26.6 31.6 68.5 74 74 A G + 0 0 11 990,-0.1 36,-0.3 2,-0.0 37,-0.2 -0.266 48.5 113.0-122.8-147.9 29.0 33.4 66.2 75 75 A G - 0 0 17 -9,-0.1 2,-0.3 34,-0.1 -9,-0.1 -0.254 38.8-150.3 95.1 169.9 32.2 33.3 64.1 76 76 A K - 0 0 74 -11,-0.3 5,-0.2 -2,-0.1 33,-0.2 -0.953 11.3-114.7-167.5 157.7 32.4 33.4 60.3 77 77 A S B > -I 80 0B 1 3,-2.3 3,-0.8 -2,-0.3 33,-0.1 -0.484 27.9-112.3 -97.1 172.9 34.7 32.1 57.6 78 78 A I T 3 S+ 0 0 37 1,-0.2 3,-0.1 31,-0.2 -1,-0.1 0.562 121.0 55.6 -73.8 -6.5 36.9 33.8 55.1 79 79 A Y T 3 S- 0 0 16 1,-0.4 1070,-1.7 30,-0.1 1071,-0.3 0.529 122.0 -92.2-101.7 -9.5 34.4 32.5 52.5 80 80 A G B < S-IJ 771148B 18 -3,-0.8 -3,-2.3 1068,-0.2 -1,-0.4 -0.909 74.4 -17.8 135.2-159.3 31.3 34.1 54.1 81 81 A E S S- 0 0 36 1066,-1.9 2,-0.3 -2,-0.3 -1,-0.2 0.868 123.3 -20.7 -43.4 -53.0 28.6 33.2 56.7 82 82 A K - 0 0 41 1065,-0.3 2,-0.3 -3,-0.1 27,-0.2 -0.898 63.5-149.6-153.4 163.4 29.2 29.5 56.5 83 83 A F B -L 108 0C 8 25,-1.5 25,-1.9 -2,-0.3 3,-0.1 -0.967 30.1 -82.6-146.1 161.6 30.8 27.0 54.0 84 84 A E - 0 0 59 -2,-0.3 2,-0.7 23,-0.2 3,-0.1 -0.079 43.6 -99.1 -58.5 151.8 30.3 23.3 53.1 85 85 A D - 0 0 25 1,-0.2 -1,-0.1 41,-0.0 3,-0.1 -0.688 38.9-153.7 -72.9 111.6 31.6 20.2 54.7 86 86 A E - 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