==== 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 11-JAN-08 3BX9 . COMPND 2 MOLECULE: FAR-RED FLUORESCENT PROTEIN MKATE; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTACMAEA QUADRICOLOR; . AUTHOR S.PLETNEV,N.PLETNEVA,V.PLETNEV . 448 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20250.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 323 72.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 27 6.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 204 45.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 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 . 36 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 12 2.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.3 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 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 . 0 2 0 0 0 0 0 0 1 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 2 0 0 4 0 2 2 4 2 6 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 S 0 0 164 0, 0.0 2,-0.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -37.5 -1.4 26.5 -2.7 2 3 A E - 0 0 117 1,-0.2 3,-0.1 0, 0.0 0, 0.0 -0.835 360.0-178.3 -87.6 120.2 -0.5 22.9 -2.0 3 4 A L + 0 0 70 -2,-0.7 2,-0.7 1,-0.2 -1,-0.2 0.738 67.0 61.9 -93.1 -26.5 1.9 23.1 0.9 4 5 A I S S- 0 0 1 74,-0.1 -1,-0.2 77,-0.1 2,-0.1 -0.910 76.5-174.5-104.0 108.2 2.8 19.4 1.3 5 6 A T - 0 0 69 -2,-0.7 29,-0.2 2,-0.2 -2,-0.1 -0.292 42.0 -88.0-100.5-179.1 4.4 18.4 -2.0 6 7 A E S S+ 0 0 129 1,-0.2 2,-0.4 26,-0.1 28,-0.3 0.807 117.9 34.7 -60.6 -34.1 5.6 15.0 -3.4 7 8 A N S S+ 0 0 67 25,-0.2 2,-0.3 26,-0.1 -2,-0.2 -0.992 74.4 179.6-122.5 132.4 9.0 15.4 -1.8 8 9 A M E -A 31 0A 7 23,-2.4 23,-2.0 -2,-0.4 2,-0.3 -0.970 16.9-144.8-132.3 145.9 9.5 17.1 1.7 9 10 A H E -Ab 30 111A 67 101,-0.5 103,-2.4 -2,-0.3 2,-0.3 -0.745 17.2-159.4-103.1 152.7 12.6 17.9 3.8 10 11 A M E -Ab 29 112A 0 19,-2.5 19,-2.0 -2,-0.3 2,-0.4 -0.989 11.9-168.3-133.2 146.9 12.5 17.8 7.6 11 12 A K E -Ab 28 113A 65 101,-2.5 103,-2.8 -2,-0.3 2,-0.4 -0.998 15.0-168.5-129.5 137.5 14.7 19.2 10.4 12 13 A L E -Ab 27 114A 1 15,-2.6 15,-1.9 -2,-0.4 2,-0.4 -0.963 14.9-166.5-129.0 145.0 14.3 18.1 14.0 13 14 A Y E -Ab 26 115A 111 101,-2.4 103,-3.0 -2,-0.4 2,-0.4 -1.000 16.4-176.4-124.1 129.5 15.5 19.3 17.4 14 15 A M E +Ab 25 116A 6 11,-2.8 11,-2.2 -2,-0.4 2,-0.4 -0.987 7.3 172.2-128.4 135.7 15.2 16.9 20.4 15 16 A E E +Ab 24 117A 84 101,-2.5 103,-2.4 -2,-0.4 2,-0.3 -0.999 20.5 107.4-134.9 144.1 15.9 17.4 24.1 16 17 A G E -Ab 23 118A 7 7,-2.2 7,-2.3 -2,-0.4 2,-0.3 -0.998 47.3-103.4 177.1-163.0 15.3 15.3 27.2 17 18 A T E -Ab 22 119A 22 101,-1.8 103,-2.5 -2,-0.3 2,-0.4 -0.999 15.7-166.1-145.8 132.2 16.3 13.1 30.0 18 19 A V E > S-Ab 21 120A 0 3,-2.0 3,-1.7 -2,-0.3 103,-0.2 -0.989 82.9 -18.4-126.2 122.5 15.9 9.3 30.6 19 20 A N T 3 S- 0 0 43 101,-2.8 -1,-0.2 -2,-0.4 102,-0.1 0.931 131.4 -51.1 48.3 48.1 16.6 7.9 34.1 20 21 A N T 3 S+ 0 0 57 100,-0.4 2,-0.7 1,-0.2 -1,-0.3 0.595 108.3 126.6 66.8 12.8 18.4 11.2 34.8 21 22 A H E < -A 18 0A 56 -3,-1.7 -3,-2.0 2,-0.0 2,-0.2 -0.919 50.1-148.6-100.1 115.5 20.7 11.1 31.7 22 23 A H E +A 17 0A 63 -2,-0.7 2,-0.3 -5,-0.2 -5,-0.2 -0.550 26.1 160.6 -82.9 144.3 20.4 14.3 29.8 23 24 A F E -A 16 0A 0 -7,-2.3 -7,-2.2 -2,-0.2 2,-0.3 -0.980 24.7-155.4-153.7 158.9 20.8 14.3 26.0 24 25 A K E -AC 15 46A 84 22,-1.9 21,-1.9 -2,-0.3 22,-1.7 -0.986 12.9-174.9-135.0 146.4 20.1 16.3 22.9 25 26 A C E -AC 14 44A 1 -11,-2.2 -11,-2.8 -2,-0.3 2,-0.3 -0.963 7.0-165.2-128.9 159.6 19.7 15.1 19.3 26 27 A T E -AC 13 43A 49 17,-2.2 17,-2.7 -2,-0.3 2,-0.3 -0.930 11.8-173.4-129.8 154.1 19.2 16.8 15.9 27 28 A S E -AC 12 42A 6 -15,-1.9 -15,-2.6 -2,-0.3 2,-0.4 -0.996 16.1-162.3-144.9 164.0 18.2 15.3 12.7 28 29 A E E +AC 11 41A 74 13,-2.0 13,-3.2 -2,-0.3 2,-0.3 -0.988 27.5 149.3-131.5 139.3 17.7 16.0 8.9 29 30 A G E -AC 10 40A 3 -19,-2.0 -19,-2.5 -2,-0.4 2,-0.3 -0.948 31.1-136.7-156.8-175.7 15.7 13.8 6.6 30 31 A E E +AC 9 39A 86 9,-1.6 9,-2.7 -2,-0.3 2,-0.3 -0.927 23.3 171.4-142.4 156.2 13.5 13.6 3.5 31 32 A G E -AC 8 38A 4 -23,-2.0 -23,-2.4 -2,-0.3 7,-0.3 -0.990 37.9-118.5-159.0 172.2 10.3 11.8 2.7 32 33 A K E >>> - C 0 37A 59 5,-2.6 5,-1.7 -2,-0.3 4,-1.3 -0.887 26.7-164.9-117.8 97.1 7.5 11.2 0.3 33 34 A P T 345S+ 0 0 0 0, 0.0 34,-0.2 0, 0.0 -1,-0.1 0.752 85.7 45.8 -57.9 -31.7 4.5 12.3 2.2 34 35 A Y T 345S+ 0 0 101 -28,-0.3 -28,-0.1 1,-0.2 -27,-0.1 0.687 113.8 49.4 -88.8 -19.6 1.9 10.6 -0.1 35 36 A E T <45S- 0 0 99 -3,-0.8 33,-0.3 -29,-0.2 -1,-0.2 0.550 108.7-127.0 -78.2 -22.6 3.8 7.4 -0.3 36 37 A G T <5 + 0 0 0 -4,-1.3 178,-2.0 1,-0.2 2,-0.4 0.772 64.9 129.2 73.9 28.8 4.2 7.3 3.5 37 38 A T E < +CD 32 213A 31 -5,-1.7 -5,-2.6 176,-0.2 2,-0.3 -0.913 25.7 159.9-119.4 151.1 7.9 6.9 3.4 38 39 A Q E -CD 31 212A 11 174,-1.8 174,-2.1 -2,-0.4 2,-0.4 -0.988 19.0-159.3-162.4 147.6 10.7 8.9 5.2 39 40 A T E -CD 30 211A 38 -9,-2.7 -9,-1.6 -2,-0.3 2,-0.4 -0.991 10.1-166.8-131.1 142.8 14.3 8.6 6.2 40 41 A M E -CD 29 210A 7 170,-2.5 170,-2.3 -2,-0.4 2,-0.6 -0.993 15.2-152.1-126.8 142.1 16.1 10.5 8.9 41 42 A R E -CD 28 209A 155 -13,-3.2 -13,-2.0 -2,-0.4 2,-0.3 -0.960 27.9-168.1-110.1 117.8 19.8 10.9 9.7 42 43 A I E -CD 27 208A 3 166,-3.4 166,-2.2 -2,-0.6 2,-0.4 -0.828 11.7-166.1-113.7 142.8 20.0 11.6 13.4 43 44 A K E -CD 26 207A 113 -17,-2.7 -17,-2.2 -2,-0.3 2,-0.7 -0.995 21.5-134.7-128.9 134.7 23.0 12.8 15.6 44 45 A V E +C 25 0A 18 162,-2.7 -19,-0.3 -2,-0.4 4,-0.1 -0.801 28.8 177.3 -83.1 114.9 23.3 12.7 19.3 45 46 A V E + 0 0 82 -21,-1.9 2,-0.3 -2,-0.7 -20,-0.2 0.649 61.0 22.3-102.0 -18.1 24.7 16.2 20.0 46 47 A E E S+C 24 0A 81 -22,-1.7 -22,-1.9 1,-0.1 -1,-0.2 -0.993 116.7 23.0-146.2 147.3 24.9 16.2 23.7 47 48 A G S S- 0 0 24 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.1 0.666 91.4-168.8 78.2 20.2 25.0 13.6 26.4 48 49 A G + 0 0 41 2,-0.1 -1,-0.2 -4,-0.1 2,-0.1 -0.590 56.0 47.4 -96.0 159.3 26.5 10.9 24.1 49 50 A P S S- 0 0 78 0, 0.0 156,-0.1 0, 0.0 155,-0.1 0.599 90.2-128.5 -72.0 149.0 27.0 8.0 23.9 50 51 A L - 0 0 6 154,-0.6 4,-0.1 1,-0.1 -2,-0.1 -0.444 7.9-149.4 -67.3 131.5 23.5 7.3 25.2 51 52 A P S S+ 0 0 57 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.041 78.2 57.2 -90.3 28.3 23.6 4.9 28.1 52 53 A F S S- 0 0 2 79,-0.1 2,-0.2 80,-0.1 78,-0.2 -0.932 104.0 -70.7-148.3 166.6 20.2 3.5 27.2 53 54 A A > - 0 0 4 76,-1.7 3,-1.5 -2,-0.3 4,-0.2 -0.447 30.6-145.9 -72.7 128.0 18.7 1.9 24.1 54 55 A F G > S+ 0 0 6 1,-0.3 3,-2.9 -2,-0.2 4,-0.4 0.830 90.8 79.7 -58.1 -29.7 18.2 4.3 21.2 55 56 A D G > S+ 0 0 5 1,-0.3 3,-1.2 2,-0.2 4,-0.4 0.739 80.0 66.6 -51.4 -31.0 15.0 2.4 20.3 56 57 A I G < S+ 0 0 2 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.652 102.7 47.1 -68.0 -14.2 13.1 4.1 23.0 57 58 A L G X> S+ 0 0 0 -3,-2.9 3,-2.2 -4,-0.2 4,-0.7 0.529 84.7 96.5 -97.0 -5.7 13.4 7.4 21.1 58 59 A A G X4 S+ 0 0 4 -3,-1.2 3,-1.0 -4,-0.4 -2,-0.1 0.845 81.7 48.8 -61.7 -39.1 12.5 6.0 17.7 59 60 A T G 34 S+ 0 0 32 -4,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.475 102.8 64.0 -79.7 -1.0 8.8 7.0 17.8 60 61 A S G <4 0 0 1 -3,-2.2 -1,-0.2 1,-0.1 -2,-0.2 0.649 360.0 360.0 -95.7 -18.5 9.6 10.5 18.8 61 62 A F << 0 0 9 -3,-1.0 -2,-0.2 -4,-0.7 -1,-0.1 0.748 360.0 360.0 -75.3 360.0 11.5 11.3 15.6 62 ! 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 63 66 A S > 0 0 15 0, 0.0 3,-1.6 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0 68.2 6.4 12.5 11.8 64 67 A K T 3 + 0 0 13 1,-0.3 3,-0.5 2,-0.1 14,-0.2 0.477 360.0 77.5 -78.5 -10.7 2.7 12.1 11.0 65 68 A T T 3 S+ 0 0 0 1,-0.2 2,-0.8 12,-0.1 -1,-0.3 0.768 86.9 66.3 -67.0 -23.0 2.8 14.2 7.8 66 69 A F S < S+ 0 0 0 -3,-1.6 2,-0.4 -30,-0.1 148,-0.3 -0.408 72.1 115.6-102.0 55.4 4.4 11.2 6.0 67 70 A I - 0 0 3 -2,-0.8 2,-1.0 -3,-0.5 148,-0.2 -0.998 66.6-128.2-118.3 128.6 1.5 8.7 6.2 68 71 A N E -e 215 0A 48 146,-2.5 148,-3.3 -2,-0.4 2,-1.0 -0.601 23.4-156.7 -71.3 99.9 -0.2 7.5 3.0 69 72 A H E -e 216 0A 27 -2,-1.0 3,-0.3 146,-0.2 148,-0.1 -0.717 18.6-176.1 -84.7 105.2 -3.8 8.1 3.7 70 73 A T > + 0 0 42 146,-1.9 3,-2.1 -2,-1.0 145,-0.0 -0.332 55.6 37.7 -92.1 179.2 -5.8 5.7 1.4 71 74 A Q T 3 S- 0 0 97 1,-0.3 -1,-0.2 -2,-0.1 146,-0.1 0.737 126.5 -71.5 54.5 28.6 -9.5 5.3 0.7 72 75 A G T 3 S+ 0 0 66 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.777 76.6 174.1 59.2 27.4 -10.0 9.1 0.9 73 76 A I < - 0 0 7 -3,-2.1 -1,-0.2 143,-0.2 2,-0.1 -0.528 41.9-108.8 -64.5 124.5 -9.5 9.1 4.7 74 77 A P - 0 0 16 0, 0.0 2,-0.9 0, 0.0 -1,-0.1 -0.403 30.5-134.2 -57.1 133.7 -9.4 12.8 5.7 75 78 A D > - 0 0 20 1,-0.2 4,-2.2 -2,-0.1 110,-0.1 -0.819 21.9-174.6-101.7 99.8 -5.8 13.6 6.6 76 79 A F T 4 S+ 0 0 2 -2,-0.9 4,-0.5 2,-0.2 -1,-0.2 0.831 85.0 48.0 -61.8 -35.2 -5.7 15.6 9.9 77 80 A F T >4 S+ 0 0 0 2,-0.2 3,-1.0 -13,-0.2 4,-0.3 0.964 114.3 40.6 -76.1 -52.4 -2.0 16.1 9.6 78 81 A K G >4 S+ 0 0 20 1,-0.3 3,-1.3 -14,-0.2 -2,-0.2 0.912 113.5 56.2 -64.1 -38.5 -1.7 17.3 6.0 79 82 A Q G 3< S+ 0 0 53 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.665 93.3 73.3 -63.0 -19.3 -4.9 19.4 6.4 80 83 A S G <> S+ 0 0 0 -3,-1.0 4,-2.2 -4,-0.5 3,-0.5 0.613 79.9 136.8 -74.2 -17.0 -3.2 21.2 9.4 81 84 A F T <4 + 0 0 7 -3,-1.3 -78,-0.1 -4,-0.3 -77,-0.1 -0.514 52.7 27.7 -81.8 149.7 -0.8 23.2 7.3 82 85 A P T 4 S+ 0 0 76 0, 0.0 25,-0.6 0, 0.0 -1,-0.3 -0.982 132.5 41.2 -76.7 -16.1 0.3 26.0 7.1 83 86 A E T 4 S- 0 0 72 -3,-0.5 -2,-0.3 1,-0.2 2,-0.2 0.872 96.4-156.8 -63.2 -38.7 -0.4 26.2 10.9 84 87 A G < - 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