==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER FLUORESCENT PROTEIN 11-MAR-09 3GL4 . COMPND 2 MOLECULE: KILLERRED; . SOURCE 2 ORGANISM_SCIENTIFIC: ANTHOMEDUSAE SP. DC-2005; . AUTHOR S.PLETNEV,N.V.PLETNEVA,V.Z.PLETNEV . 458 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19269.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 335 73.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 5.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 188 41.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.7 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 . 59 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 14 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 3 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 . 2 0 0 0 0 0 0 1 0 1 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 1 3 1 4 1 5 2 3 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 0 0 0 0 0 2 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 E 0 0 102 0, 0.0 185,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -8.6 14.4 -10.2 9.3 2 3 A G > + 0 0 42 82,-0.0 4,-0.6 1,-0.0 79,-0.1 0.714 360.0 116.0 72.9 26.6 14.9 -9.4 5.5 3 4 A G H >> S+ 0 0 0 2,-0.2 4,-1.1 1,-0.1 3,-0.6 0.894 76.6 50.4 -83.3 -52.5 12.6 -6.3 5.1 4 5 A P H 34 S+ 0 0 36 0, 0.0 4,-0.3 0, 0.0 -1,-0.1 0.750 102.2 65.1 -55.2 -26.9 15.4 -3.8 4.2 5 6 A A H >4 S+ 0 0 57 1,-0.2 3,-1.6 2,-0.2 -2,-0.2 0.950 99.2 52.6 -58.6 -47.3 16.6 -6.4 1.7 6 7 A L H X< S+ 0 0 60 -3,-0.6 3,-1.1 -4,-0.6 -1,-0.2 0.869 102.8 56.7 -53.8 -43.8 13.3 -5.8 -0.2 7 8 A F T 3< S+ 0 0 3 -4,-1.1 -1,-0.3 1,-0.3 -2,-0.2 0.483 80.6 90.7 -74.8 -2.1 13.7 -2.0 -0.3 8 9 A Q T < S+ 0 0 129 -3,-1.6 -1,-0.3 -4,-0.3 2,-0.2 0.508 81.8 65.7 -72.6 -7.0 17.1 -2.4 -2.1 9 10 A S S < S- 0 0 50 -3,-1.1 2,-0.6 -4,-0.1 0, 0.0 -0.586 102.0 -88.2-101.7 171.3 15.2 -2.2 -5.5 10 11 A D - 0 0 71 -2,-0.2 25,-0.2 25,-0.1 2,-0.2 -0.749 53.9-170.3 -83.4 121.4 13.3 0.6 -7.0 11 12 A M E -A 34 0A 3 23,-1.4 23,-2.0 -2,-0.6 2,-0.3 -0.501 16.7-146.9-109.9 172.5 9.7 0.5 -5.9 12 13 A T E -Ab 33 113A 61 100,-2.5 102,-2.1 21,-0.2 2,-0.3 -0.789 13.6-151.0-124.8 176.5 6.3 2.2 -6.6 13 14 A F E -Ab 32 114A 4 19,-2.3 19,-2.0 -2,-0.3 2,-0.4 -0.996 8.7-161.2-153.9 152.4 3.4 3.0 -4.4 14 15 A K E -Ab 31 115A 85 100,-2.7 102,-3.6 -2,-0.3 2,-0.4 -0.995 12.4-164.7-135.2 134.1 -0.3 3.5 -4.6 15 16 A I E -Ab 30 116A 0 15,-3.1 15,-2.7 -2,-0.4 2,-0.5 -0.975 9.3-170.4-130.6 131.3 -2.4 5.3 -2.0 16 17 A F E -Ab 29 117A 65 100,-2.6 102,-3.2 -2,-0.4 2,-0.5 -0.972 10.7-171.6-122.4 117.1 -6.2 5.4 -1.4 17 18 A I E -Ab 28 118A 2 11,-3.2 11,-1.7 -2,-0.5 2,-0.6 -0.925 10.5-165.1-111.5 130.6 -7.5 8.0 1.0 18 19 A D E +Ab 27 119A 90 100,-3.2 102,-2.5 -2,-0.5 2,-0.3 -0.944 29.3 179.8-114.2 109.2 -11.1 8.0 2.3 19 20 A G E -Ab 26 120A 2 7,-3.6 7,-2.5 -2,-0.6 2,-0.3 -0.752 26.2-171.4-116.6 156.8 -11.6 11.4 3.8 20 21 A E E -Ab 25 121A 35 100,-1.5 102,-4.0 -2,-0.3 2,-0.4 -0.979 3.3-178.2-141.3 143.4 -14.1 13.6 5.5 21 22 A V E > S-Ab 24 122A 0 3,-2.4 3,-1.4 -2,-0.3 102,-0.2 -0.940 76.2 -18.4-137.0 117.0 -14.0 17.2 6.4 22 23 A N T 3 S- 0 0 67 100,-1.8 101,-0.1 -2,-0.4 3,-0.1 0.880 129.2 -52.3 55.9 38.2 -16.8 19.1 8.3 23 24 A G T 3 S+ 0 0 55 99,-0.3 2,-0.6 1,-0.2 -1,-0.3 0.499 113.3 119.6 80.9 3.4 -19.1 16.2 7.3 24 25 A Q E < -A 21 0A 111 -3,-1.4 -3,-2.4 29,-0.0 -1,-0.2 -0.928 58.4-135.3-107.7 119.3 -18.2 16.4 3.6 25 26 A K E +A 20 0A 140 -2,-0.6 2,-0.3 -5,-0.2 -5,-0.2 -0.458 26.3 176.1 -74.1 142.1 -16.7 13.2 2.1 26 27 A F E -A 19 0A 0 -7,-2.5 -7,-3.6 -2,-0.2 2,-0.4 -0.997 15.6-152.6-142.9 157.2 -13.8 13.3 -0.2 27 28 A T E -A 18 0A 31 -2,-0.3 21,-2.2 -9,-0.2 22,-1.0 -0.979 8.3-174.0-130.7 135.2 -11.6 10.7 -1.9 28 29 A I E -AC 17 47A 0 -11,-1.7 -11,-3.2 -2,-0.4 2,-0.4 -0.989 2.6-169.1-125.7 132.7 -8.0 11.0 -3.0 29 30 A V E +AC 16 46A 35 17,-2.7 17,-2.4 -2,-0.4 2,-0.3 -0.962 13.5 179.1-115.1 142.6 -6.0 8.4 -5.0 30 31 A A E +AC 15 45A 0 -15,-2.7 -15,-3.1 -2,-0.4 2,-0.3 -0.960 13.0 178.8-140.3 152.0 -2.3 8.7 -5.5 31 32 A D E +AC 14 44A 78 13,-2.1 13,-3.5 -2,-0.3 2,-0.3 -0.991 15.4 142.3-140.9 159.5 0.7 6.9 -7.1 32 33 A G E -AC 13 43A 15 -19,-2.0 -19,-2.3 -2,-0.3 2,-0.3 -0.967 32.9-108.9-171.3-169.1 4.4 7.5 -7.4 33 34 A S E -AC 12 42A 60 9,-1.1 9,-1.2 -2,-0.3 2,-0.2 -0.946 8.8-166.5-138.4 150.2 7.8 6.1 -7.5 34 35 A S E -A 11 0A 2 -23,-2.0 -23,-1.4 -2,-0.3 2,-0.2 -0.760 15.7-158.0-140.6 93.3 11.0 6.0 -5.3 35 36 A K > - 0 0 156 -2,-0.2 3,-3.6 -25,-0.2 5,-0.2 -0.501 41.6 -64.6 -67.1 130.9 14.3 4.8 -7.0 36 37 A F T 3 S+ 0 0 116 1,-0.4 -1,-0.1 -2,-0.2 -26,-0.1 -0.245 127.6 37.7 -43.4 136.7 17.1 3.4 -4.8 37 38 A P T 3 S- 0 0 72 0, 0.0 -1,-0.4 0, 0.0 -2,-0.1 -0.939 95.4-170.0 -85.6 22.1 18.6 4.9 -2.8 38 39 A H < + 0 0 12 -3,-3.6 31,-0.1 1,-0.1 30,-0.1 -0.181 44.3 114.2 69.1-165.2 15.2 6.5 -2.2 39 40 A G S S+ 0 0 0 29,-2.5 178,-1.7 177,-0.1 -1,-0.1 0.437 77.8 63.8 77.0 -1.2 14.8 9.6 0.1 40 41 A D E S+ D 0 216A 68 176,-0.2 2,-0.3 -5,-0.2 176,-0.2 -0.452 72.2 153.5-148.2 74.0 13.7 11.9 -2.7 41 42 A F E - D 0 215A 7 174,-1.5 174,-2.8 27,-0.1 2,-0.3 -0.743 28.4-146.8-108.7 154.6 10.4 10.5 -4.0 42 43 A N E -CD 33 214A 47 -9,-1.2 -9,-1.1 -2,-0.3 2,-0.4 -0.859 7.0-163.5-118.7 155.5 7.4 12.0 -5.8 43 44 A V E -CD 32 213A 7 170,-1.7 170,-2.3 -2,-0.3 2,-0.6 -0.982 14.4-145.2-139.0 139.7 3.7 11.3 -5.9 44 45 A H E -CD 31 212A 40 -13,-3.5 -13,-2.1 -2,-0.4 2,-0.4 -0.963 25.3-167.4-105.8 120.6 1.0 12.3 -8.1 45 46 A A E -CD 30 211A 0 166,-3.5 166,-2.2 -2,-0.6 2,-0.4 -0.925 7.4-175.7-114.0 137.6 -2.3 12.9 -6.1 46 47 A V E -CD 29 210A 15 -17,-2.4 -17,-2.7 -2,-0.4 2,-0.8 -0.995 25.5-133.0-134.4 133.4 -5.8 13.2 -7.5 47 48 A C E > -C 28 0A 6 162,-2.6 3,-0.9 -2,-0.4 162,-0.3 -0.794 17.5-163.3 -83.5 110.8 -9.1 14.1 -5.7 48 49 A E T 3 S+ 0 0 130 -21,-2.2 -20,-0.2 -2,-0.8 -1,-0.1 0.665 80.5 66.8 -75.0 -15.5 -11.5 11.4 -7.1 49 50 A T T 3 S- 0 0 69 -22,-1.0 2,-1.3 1,-0.1 -1,-0.3 -0.073 112.5-107.2 -98.0 33.5 -14.6 13.4 -5.9 50 51 A G S < S+ 0 0 51 -3,-0.9 159,-0.5 -23,-0.1 2,-0.4 -0.667 91.6 23.0 96.1 -91.4 -14.1 16.3 -8.3 51 52 A K S S- 0 0 145 -2,-1.3 -3,-0.0 157,-0.1 157,-0.0 -0.948 77.8-125.3-117.5 124.0 -12.9 19.3 -6.3 52 53 A L - 0 0 4 -2,-0.4 4,-0.1 1,-0.1 -26,-0.1 -0.500 15.4-146.1 -67.7 134.5 -11.1 19.0 -2.9 53 54 A P S S+ 0 0 26 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.324 75.1 41.5 -90.7 15.7 -12.9 21.0 -0.3 54 55 A M S S- 0 0 7 79,-0.1 78,-0.2 80,-0.0 77,-0.1 -0.914 102.1 -68.9-145.6 172.3 -9.9 22.0 1.7 55 56 A S - 0 0 0 76,-1.9 4,-0.3 -2,-0.3 76,-0.0 -0.323 35.9-138.9 -57.4 141.3 -6.3 23.2 1.0 56 57 A W S > S+ 0 0 19 1,-0.2 3,-1.2 80,-0.1 4,-0.5 0.723 90.3 81.7 -70.1 -18.8 -4.1 20.4 -0.4 57 58 A K G > S+ 0 0 19 1,-0.3 3,-2.2 2,-0.2 4,-0.2 0.935 87.6 49.3 -57.0 -50.1 -1.2 21.5 1.8 58 59 A P G 3 S+ 0 0 0 0, 0.0 3,-0.3 0, 0.0 -1,-0.3 0.649 100.3 68.1 -65.9 -13.1 -2.3 19.7 5.0 59 60 A I G X> S+ 0 0 0 -3,-1.2 3,-2.6 -4,-0.3 4,-1.5 0.663 74.8 97.5 -73.9 -17.1 -2.8 16.5 2.9 60 61 A C G X4 S+ 0 0 5 -3,-2.2 3,-0.5 -4,-0.5 -1,-0.2 0.871 79.3 46.4 -43.8 -59.3 1.0 16.4 2.5 61 62 A H G 34 S+ 0 0 25 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.630 108.4 61.2 -62.3 -7.2 1.9 13.9 5.3 62 63 A L G <4 0 0 0 -3,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.884 360.0 360.0 -87.8 -42.5 -1.0 11.6 4.0 63 64 A I << 0 0 6 -4,-1.5 -2,-0.2 -3,-0.5 -1,-0.2 0.395 360.0 360.0 -91.5 360.0 0.4 11.1 0.6 64 ! 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 65 68 A E > 0 0 14 0, 0.0 3,-1.9 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 77.5 5.8 6.8 2.8 66 69 A P G > + 0 0 23 0, 0.0 3,-1.2 0, 0.0 13,-0.2 0.674 360.0 67.3 -64.1 -17.5 8.2 6.5 5.7 67 70 A F G 3 S+ 0 0 0 1,-0.3 10,-0.0 12,-0.2 13,-0.0 0.552 94.2 60.6 -82.8 -5.7 9.8 3.4 4.1 68 71 A F G < S+ 0 0 0 -3,-1.9 -29,-2.5 -30,-0.1 2,-0.6 0.297 76.8 109.1-101.9 5.9 11.0 5.7 1.4 69 72 A A S < S- 0 0 5 -3,-1.2 2,-0.7 -31,-0.1 149,-0.2 -0.745 77.1-121.7 -76.0 125.7 13.0 7.9 3.8 70 73 A R B -e 218 0A 90 147,-1.8 149,-1.9 -2,-0.6 -32,-0.1 -0.624 32.2-167.0 -67.8 112.8 16.7 7.2 3.2 71 74 A Y - 0 0 38 -2,-0.7 2,-0.3 147,-0.2 149,-0.1 -0.574 12.8-134.0 -89.6 159.0 18.3 6.0 6.3 72 75 A P > - 0 0 58 0, 0.0 3,-1.3 0, 0.0 148,-0.0 -0.789 39.5 -84.5-102.3 160.2 22.1 5.7 6.9 73 76 A D T 3 S+ 0 0 171 -2,-0.3 3,-0.1 1,-0.2 0, 0.0 -0.296 111.9 47.7 -63.9 147.4 23.7 2.6 8.5 74 77 A G T 3 S+ 0 0 89 1,-0.2 2,-0.5 -3,-0.0 -1,-0.2 0.219 95.9 82.5 102.5 -15.8 23.6 2.5 12.3 75 78 A I S < S- 0 0 22 -3,-1.3 2,-0.3 114,-0.1 -1,-0.2 -0.987 84.0-123.9-116.0 122.0 20.0 3.4 12.6 76 79 A S - 0 0 13 -2,-0.5 2,-1.5 1,-0.1 3,-0.1 -0.500 16.3-139.9 -61.3 126.9 17.4 0.7 12.2 77 80 A H >> - 0 0 14 -2,-0.3 3,-2.6 1,-0.2 4,-1.3 -0.557 25.8-176.3 -89.0 71.8 15.0 1.7 9.4 78 81 A F H 3> S+ 0 0 3 -2,-1.5 4,-0.7 1,-0.3 -1,-0.2 0.665 73.5 56.7 -40.2 -43.1 11.9 0.4 11.2 79 82 A A H 34 S+ 0 0 4 1,-0.2 -1,-0.3 -13,-0.2 -12,-0.2 0.649 111.7 47.8 -70.4 -12.1 9.3 1.0 8.5 80 83 A Q H X4 S+ 0 0 23 -3,-2.6 3,-1.4 2,-0.1 -2,-0.2 0.849 104.4 54.9 -96.3 -39.7 11.4 -1.1 6.3 81 84 A E H 3< S+ 0 0 22 -4,-1.3 -2,-0.2 1,-0.2 -3,-0.1 0.666 92.0 83.9 -58.6 -15.6 11.9 -4.0 8.7 82 85 A C T 3X S+ 0 0 0 -4,-0.7 4,-2.8 -5,-0.3 -1,-0.2 0.744 80.0 115.5 -70.8 -23.7 8.1 -4.0 8.8 83 86 A F T <4 + 0 0 0 -3,-1.4 -77,-0.1 2,-0.3 25,-0.0 -0.511 48.7 33.8 -90.6 167.1 7.7 -6.1 5.7 84 87 A P T 4 S+ 0 0 82 0, 0.0 25,-0.5 0, 0.0 -1,-0.2 -0.953 131.2 40.1 -73.3 -22.2 6.9 -8.4 4.3 85 88 A E T 4 S- 0 0 69 1,-0.1 24,-0.3 23,-0.1 -2,-0.3 0.965 104.2-141.7 -48.9 -74.6 4.2 -8.5 6.9 86 89 A G < - 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