==== 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 FLUORESCENT PROTEIN 21-OCT-09 3KCS . COMPND 2 MOLECULE: PAMCHERRY1 PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: DISCOSOMA SP.; . AUTHOR V.N.MALASHKEVICH,F.V.SUBACH,W.D.ZENCHECK,H.XIAO,G.S.FILONOV, . 214 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10194.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 154 72.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 5.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 100 46.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.4 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 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 5 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 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 RESIDUES PER ALPHA HELIX . 1 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 PARALLEL BRIDGES PER LADDER . 0 1 1 0 3 0 1 1 2 1 2 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 1 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 A 0 0 95 0, 0.0 2,-0.3 0, 0.0 105,-0.0 0.000 360.0 360.0 360.0 14.6 -4.3 -9.0 -13.7 2 7 A I - 0 0 124 79,-0.1 2,-1.0 78,-0.0 0, 0.0 -0.781 360.0-107.5-108.5 165.4 -4.7 -9.4 -17.5 3 8 A I - 0 0 18 -2,-0.3 4,-0.1 77,-0.1 2,-0.0 -0.792 40.3-158.7 -93.4 105.1 -5.6 -12.5 -19.4 4 9 A K - 0 0 132 -2,-1.0 29,-0.1 2,-0.2 3,-0.0 -0.284 33.3-103.4 -77.5 164.8 -2.4 -13.6 -21.2 5 10 A E S S+ 0 0 125 1,-0.1 2,-0.4 26,-0.1 28,-0.3 0.707 116.7 39.2 -61.1 -23.2 -2.2 -15.8 -24.3 6 11 A F S S+ 0 0 76 25,-0.2 2,-0.3 26,-0.1 -2,-0.2 -0.998 77.7 171.9-125.4 128.5 -1.1 -18.7 -21.9 7 12 A M E -A 30 0A 6 23,-2.2 23,-1.9 -2,-0.4 2,-0.3 -0.998 19.6-148.2-139.2 141.9 -2.8 -18.9 -18.4 8 13 A R E -A 29 0A 117 101,-0.5 103,-2.4 -2,-0.3 2,-0.3 -0.688 14.9-164.6 -96.8 158.9 -2.7 -21.5 -15.6 9 14 A F E -Ab 28 111A 1 19,-2.5 19,-3.0 -2,-0.3 2,-0.4 -0.961 11.1-150.6-138.0 155.6 -5.5 -22.2 -13.2 10 15 A K E -Ab 27 112A 63 101,-2.2 103,-3.0 -2,-0.3 2,-0.4 -0.982 18.0-169.2-123.4 141.4 -6.0 -24.0 -9.9 11 16 A V E -Ab 26 113A 7 15,-2.2 15,-2.5 -2,-0.4 2,-0.4 -0.981 13.4-172.9-133.2 142.4 -9.1 -25.7 -8.9 12 17 A H E -Ab 25 114A 45 101,-1.8 103,-3.0 -2,-0.4 2,-0.4 -0.998 9.2-168.9-130.0 129.3 -10.6 -27.2 -5.8 13 18 A M E -Ab 24 115A 0 11,-2.7 11,-2.0 -2,-0.4 2,-0.5 -0.971 10.2-166.0-117.0 133.5 -13.9 -29.2 -5.7 14 19 A E E +Ab 23 116A 83 101,-2.3 103,-2.4 -2,-0.4 2,-0.3 -0.986 31.3 167.2-108.3 125.2 -15.8 -30.3 -2.6 15 20 A G E -Ab 22 117A 8 7,-2.7 7,-2.7 -2,-0.5 2,-0.3 -0.922 32.1-169.3-139.1 159.0 -18.4 -32.9 -3.7 16 21 A S E -Ab 21 118A 22 101,-1.3 103,-3.0 -2,-0.3 2,-0.5 -0.936 10.8-174.2-143.1 131.0 -20.8 -35.5 -2.6 17 22 A V E > S-Ab 20 119A 0 3,-2.1 3,-2.3 -2,-0.3 103,-0.2 -0.979 77.6 -19.9-131.3 119.2 -22.5 -38.0 -5.0 18 23 A N T 3 S- 0 0 66 101,-2.5 102,-0.1 -2,-0.5 3,-0.1 0.810 131.9 -50.4 52.8 31.0 -25.1 -40.4 -3.7 19 24 A G T 3 S+ 0 0 58 100,-0.5 2,-0.7 1,-0.3 -1,-0.3 0.379 106.6 130.9 95.1 -12.4 -23.6 -39.7 -0.3 20 25 A H E < -A 17 0A 59 -3,-2.3 -3,-2.1 30,-0.0 2,-0.4 -0.765 47.2-151.3 -81.2 117.7 -20.0 -40.4 -1.3 21 26 A V E +A 16 0A 106 -2,-0.7 2,-0.3 -5,-0.2 -5,-0.2 -0.747 28.7 146.6 -99.0 128.0 -18.0 -37.4 0.0 22 27 A F E -A 15 0A 1 -7,-2.7 -7,-2.7 -2,-0.4 2,-0.3 -0.955 32.6-142.4-151.5 168.0 -14.8 -36.4 -1.7 23 28 A E E -AC 14 45A 36 22,-2.1 22,-1.7 -2,-0.3 21,-1.6 -0.976 9.8-163.5-139.5 152.4 -12.5 -33.5 -2.8 24 29 A I E -AC 13 43A 0 -11,-2.0 -11,-2.7 -2,-0.3 2,-0.4 -0.989 1.8-169.9-132.6 134.9 -10.5 -32.9 -5.9 25 30 A E E +AC 12 42A 100 17,-2.3 17,-2.5 -2,-0.4 2,-0.3 -0.990 18.6 173.7-123.1 142.5 -7.6 -30.5 -6.4 26 31 A G E -AC 11 41A 7 -15,-2.5 -15,-2.2 -2,-0.4 2,-0.4 -0.944 29.2-140.5-147.4 165.1 -6.2 -29.8 -9.8 27 32 A E E +AC 10 40A 123 13,-2.1 13,-2.8 -2,-0.3 2,-0.3 -0.999 27.8 178.7-126.1 124.1 -3.9 -27.7 -12.0 28 33 A G E +AC 9 39A 2 -19,-3.0 -19,-2.5 -2,-0.4 2,-0.3 -0.796 8.6 177.5-120.3 170.5 -4.9 -26.5 -15.4 29 34 A E E +AC 8 38A 82 9,-2.3 9,-2.9 -21,-0.3 2,-0.3 -0.984 12.4 138.7-162.9 159.7 -3.5 -24.5 -18.2 30 35 A G E -AC 7 37A 7 -23,-1.9 -23,-2.2 -2,-0.3 7,-0.2 -0.982 53.2 -82.6 179.4-170.4 -4.4 -23.4 -21.6 31 36 A R E >>> - C 0 36A 86 5,-2.6 3,-1.7 -2,-0.3 5,-1.2 -0.904 35.6-165.2-124.3 92.1 -4.6 -20.7 -24.3 32 37 A P T 345S+ 0 0 0 0, 0.0 -1,-0.1 0, 0.0 -27,-0.1 0.754 85.7 46.0 -65.9 -26.3 -7.7 -18.7 -23.5 33 38 A Y T 345S+ 0 0 107 -28,-0.3 35,-0.1 1,-0.2 -28,-0.1 0.595 113.2 50.4 -85.7 -13.8 -8.0 -16.9 -26.9 34 39 A E T <45S- 0 0 80 -3,-1.7 33,-0.2 -29,-0.2 -1,-0.2 0.519 107.6-123.9 -96.3 -10.6 -7.5 -20.1 -28.8 35 40 A G T <5 + 0 0 1 -4,-1.2 175,-2.7 1,-0.2 2,-0.4 0.795 68.0 122.7 73.7 31.9 -10.2 -22.1 -26.9 36 41 A T E < +CD 31 209A 20 -5,-1.2 -5,-2.6 173,-0.2 2,-0.3 -0.954 28.1 156.8-124.7 141.0 -7.9 -24.9 -25.7 37 42 A Q E -CD 30 208A 10 171,-1.7 171,-2.5 -2,-0.4 2,-0.3 -0.988 18.7-162.0-157.9 154.3 -7.1 -26.1 -22.2 38 43 A T E -CD 29 207A 60 -9,-2.9 -9,-2.3 -2,-0.3 2,-0.3 -0.924 7.1-167.0-130.9 157.1 -6.0 -29.1 -20.2 39 44 A A E -CD 28 206A 8 167,-2.4 167,-2.4 -2,-0.3 2,-0.6 -0.991 15.7-150.1-144.8 152.3 -6.1 -30.1 -16.6 40 45 A K E -CD 27 205A 73 -13,-2.8 -13,-2.1 -2,-0.3 2,-0.4 -0.971 25.7-169.3-117.6 117.0 -4.6 -32.6 -14.2 41 46 A L E -CD 26 204A 0 163,-3.6 163,-2.3 -2,-0.6 2,-0.4 -0.836 9.5-165.8-112.2 140.6 -6.9 -33.5 -11.4 42 47 A K E -CD 25 203A 108 -17,-2.5 -17,-2.3 -2,-0.4 2,-0.8 -0.992 23.1-131.9-124.0 132.8 -6.2 -35.5 -8.2 43 48 A V E +C 24 0A 19 159,-2.7 -19,-0.3 -2,-0.4 4,-0.1 -0.705 31.3 175.7 -81.5 109.5 -8.8 -37.0 -5.9 44 49 A T E + 0 0 65 -21,-1.6 2,-0.4 -2,-0.8 -20,-0.2 0.670 62.8 28.9 -95.2 -20.4 -7.4 -35.8 -2.6 45 50 A K E S+C 23 0A 121 -22,-1.7 -22,-2.1 1,-0.0 -1,-0.3 -0.994 121.5 13.8-138.0 139.1 -10.2 -37.0 -0.2 46 51 A G S S- 0 0 33 -2,-0.4 -2,-0.1 1,-0.2 -22,-0.0 0.490 87.0-170.5 84.2 3.8 -12.5 -39.9 -0.6 47 52 A G + 0 0 39 -4,-0.1 -1,-0.2 -24,-0.1 2,-0.1 -0.444 57.0 50.2 -77.8 155.1 -10.7 -41.8 -3.5 48 53 A P S S- 0 0 76 0, 0.0 153,-0.1 0, 0.0 154,-0.1 0.557 83.0-143.4 -78.3 148.3 -11.4 -44.0 -5.2 49 54 A L - 0 0 12 151,-0.4 2,-0.3 152,-0.1 -2,-0.1 -0.526 6.2-139.6 -80.2 137.5 -14.8 -42.7 -6.2 50 55 A P S S+ 0 0 56 0, 0.0 2,-0.3 0, 0.0 81,-0.1 -0.058 79.6 53.0 -88.0 39.2 -17.6 -45.2 -6.7 51 56 A F S S- 0 0 5 -2,-0.3 78,-0.2 79,-0.1 -2,-0.1 -0.967 95.9 -66.6-164.0 166.8 -19.0 -43.5 -9.8 52 57 A T > - 0 0 10 76,-2.0 3,-1.0 -2,-0.3 4,-0.2 -0.322 26.3-139.2 -67.7 140.6 -17.9 -42.2 -13.2 53 58 A W G >> S+ 0 0 7 1,-0.2 4,-2.3 2,-0.1 3,-2.0 0.721 91.9 85.0 -62.3 -20.5 -15.6 -39.3 -13.7 54 59 A D G 34 S+ 0 0 8 1,-0.3 -1,-0.2 2,-0.2 82,-0.0 0.765 84.2 53.8 -64.6 -22.6 -17.8 -38.2 -16.5 55 60 A I G <4 S+ 0 0 2 -3,-1.0 -1,-0.3 1,-0.1 -2,-0.1 0.661 114.1 42.9 -79.3 -12.8 -20.1 -36.3 -14.2 56 61 A L T X4 S+ 0 0 0 -3,-2.0 3,-2.3 -4,-0.2 4,-0.4 0.771 94.5 77.5 -97.8 -31.5 -17.2 -34.4 -12.7 57 62 A S G >< S+ 0 0 4 -4,-2.3 3,-1.2 1,-0.3 -2,-0.1 0.807 88.9 55.9 -55.8 -34.7 -15.3 -33.6 -15.9 58 63 A P G 3 S+ 0 0 31 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.560 98.8 64.9 -74.8 -2.8 -17.6 -30.7 -17.1 59 64 A Q G < 0 0 1 -3,-2.3 -2,-0.2 1,-0.2 -3,-0.1 0.520 360.0 360.0 -98.8 -2.5 -17.1 -28.9 -13.7 60 65 A F < 0 0 11 -3,-1.2 -1,-0.2 -4,-0.4 -3,-0.1 0.304 360.0 360.0-103.3 360.0 -13.4 -28.2 -14.2 61 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 62 69 A S > 0 0 13 0, 0.0 3,-1.7 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 62.0 -13.6 -23.1 -17.4 63 70 A N G > + 0 0 5 1,-0.3 3,-1.1 2,-0.1 14,-0.2 0.545 360.0 82.4 -74.2 -3.7 -15.2 -20.6 -19.8 64 71 A A G 3 S+ 0 0 0 1,-0.3 -1,-0.3 12,-0.2 -29,-0.1 0.745 90.6 59.6 -62.9 -18.6 -12.4 -18.0 -19.7 65 72 A Y G < S+ 0 0 0 -3,-1.7 2,-0.5 -30,-0.1 145,-0.4 -0.188 75.5 115.2-107.4 36.6 -10.8 -20.4 -22.3 66 73 A V < - 0 0 0 -3,-1.1 2,-0.6 143,-0.1 145,-0.2 -0.921 67.1-125.8-100.2 133.2 -13.4 -20.3 -25.0 67 74 A K B -e 211 0A 80 143,-2.4 145,-3.3 -2,-0.5 -34,-0.1 -0.651 32.4-164.8 -74.1 119.6 -12.4 -18.8 -28.3 68 75 A H - 0 0 23 -2,-0.6 6,-0.1 143,-0.2 145,-0.1 -0.799 25.8-101.3-107.5 146.5 -14.9 -16.1 -29.1 69 76 A P > - 0 0 31 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 -0.316 37.6-113.7 -59.4 148.5 -15.6 -14.4 -32.4 70 77 A A T 3 S+ 0 0 116 1,-0.3 4,-0.1 3,-0.0 -2,-0.0 0.821 113.7 49.4 -58.5 -31.0 -13.9 -10.9 -32.6 71 78 A D T 3 S+ 0 0 119 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.374 92.4 85.9 -95.6 9.5 -17.3 -9.2 -32.7 72 79 A I S < S- 0 0 16 -3,-1.8 140,-0.1 111,-0.1 -4,-0.0 -0.921 84.4-115.2-110.2 124.8 -19.0 -10.9 -29.8 73 80 A P - 0 0 46 0, 0.0 2,-1.1 0, 0.0 3,-0.1 -0.326 25.5-136.4 -53.6 131.3 -18.5 -9.5 -26.2 74 81 A D > - 0 0 23 1,-0.2 4,-3.1 -4,-0.1 5,-0.2 -0.810 20.7-172.1 -96.3 92.3 -16.7 -12.2 -24.3 75 82 A Y H > S+ 0 0 8 -2,-1.1 4,-1.1 1,-0.2 -1,-0.2 0.876 81.3 49.8 -57.2 -41.1 -18.6 -12.1 -21.0 76 83 A F H >4 S+ 0 0 0 2,-0.2 3,-0.5 1,-0.2 4,-0.4 0.950 114.9 41.3 -65.6 -50.9 -16.2 -14.5 -19.3 77 84 A K H >4 S+ 0 0 24 1,-0.2 3,-1.4 -14,-0.2 -2,-0.2 0.913 111.9 56.2 -67.6 -36.3 -13.1 -12.6 -20.2 78 85 A L H 3< S+ 0 0 80 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.768 96.7 66.6 -63.3 -22.6 -14.7 -9.2 -19.6 79 86 A S T - 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