==== 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 DE NOVO PROTEIN 06-MAR-10 3M24 . COMPND 2 MOLECULE: TAGBFP; . SOURCE 2 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; . AUTHOR V.N.MALASHKEVICH,O.M.SUBACH,S.C.ALMO,V.V.VERKHUSHA . 902 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33367.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 673 74.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 56 6.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 407 45.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 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 . 95 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 77 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 34 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 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 7 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 4 0 0 0 0 0 0 0 4 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 4 0 1 7 0 4 4 8 4 12 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 4 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 0 A M 0 0 130 0, 0.0 3,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-173.5 16.2 -51.2 -6.2 2 1 A S + 0 0 89 1,-0.2 2,-1.5 2,-0.1 3,-0.2 0.874 360.0 66.3 -63.6 -41.7 17.5 -52.5 -9.6 3 2 A E > + 0 0 24 1,-0.2 3,-1.2 2,-0.1 -1,-0.2 -0.494 56.2 157.1 -92.7 68.3 17.5 -48.9 -10.8 4 3 A E T 3 S+ 0 0 137 -2,-1.5 -1,-0.2 1,-0.3 -2,-0.1 0.732 70.6 61.4 -67.2 -24.1 20.3 -47.3 -8.7 5 4 A L T 3 S+ 0 0 81 -3,-0.2 2,-0.8 75,-0.2 -1,-0.3 0.675 89.9 78.9 -75.4 -20.3 20.9 -44.5 -11.3 6 5 A I S < S- 0 0 3 -3,-1.2 -1,-0.1 74,-0.1 4,-0.1 -0.834 75.9-160.3 -94.2 106.3 17.3 -43.3 -10.8 7 6 A K - 0 0 140 -2,-0.8 29,-0.2 2,-0.2 -2,-0.1 -0.215 33.1-102.4 -84.6 172.1 17.2 -41.3 -7.5 8 7 A E S S+ 0 0 101 1,-0.2 2,-0.4 26,-0.1 29,-0.2 0.737 115.6 36.6 -67.5 -26.0 14.3 -40.4 -5.2 9 8 A N S S+ 0 0 97 25,-0.2 2,-0.4 26,-0.1 -2,-0.2 -0.998 77.6 179.2-126.3 131.4 14.5 -36.9 -6.7 10 9 A M E -A 33 0A 5 23,-1.9 23,-1.9 -2,-0.4 2,-0.2 -0.998 17.6-145.8-136.5 139.8 15.3 -36.4 -10.4 11 10 A H E -Ab 32 113A 125 101,-0.6 103,-2.3 -2,-0.4 2,-0.3 -0.626 18.1-160.9 -91.5 159.3 15.5 -33.3 -12.7 12 11 A M E -Ab 31 114A 2 19,-2.4 19,-2.1 -2,-0.2 2,-0.4 -0.999 13.0-164.3-145.2 146.8 14.6 -33.3 -16.4 13 12 A K E -Ab 30 115A 104 101,-2.9 103,-3.0 -2,-0.3 2,-0.4 -0.987 15.7-165.7-125.7 135.5 15.2 -31.3 -19.6 14 13 A L E -Ab 29 116A 2 15,-2.8 15,-2.0 -2,-0.4 2,-0.4 -0.958 13.6-167.5-129.3 143.7 13.1 -31.6 -22.7 15 14 A Y E +Ab 28 117A 105 101,-2.2 103,-3.2 -2,-0.4 2,-0.4 -0.999 17.2 176.7-125.6 127.6 13.4 -30.5 -26.3 16 15 A M E +Ab 27 118A 3 11,-2.6 11,-3.2 -2,-0.4 2,-0.3 -0.999 6.2 155.1-134.8 133.1 10.3 -30.6 -28.6 17 16 A E E +Ab 26 119A 67 101,-1.9 103,-2.1 -2,-0.4 2,-0.3 -0.993 16.2 94.9-147.6 157.7 9.7 -29.6 -32.2 18 17 A G E -Ab 25 120A 7 7,-2.0 7,-2.3 -2,-0.3 2,-0.3 -0.987 53.5 -72.3 167.9-143.7 7.5 -30.3 -35.1 19 18 A T E -Ab 24 121A 14 101,-1.6 103,-2.9 -2,-0.3 2,-0.4 -0.985 12.8-159.9-145.8 143.6 4.4 -29.3 -37.0 20 19 A V E > S-Ab 23 122A 0 3,-2.0 3,-2.3 -2,-0.3 2,-0.3 -0.977 79.0 -42.5-126.2 119.6 0.6 -29.5 -36.7 21 20 A D T 3 S- 0 0 1 101,-2.7 101,-0.1 -2,-0.4 750,-0.1 -0.498 128.0 -24.4 55.1-120.6 -1.1 -29.1 -40.0 22 21 A N T 3 S+ 0 0 77 -2,-0.3 2,-0.7 -3,-0.1 -1,-0.3 0.265 116.5 107.0 -97.8 13.8 0.9 -26.3 -41.7 23 22 A H E < -A 20 0A 57 -3,-2.3 -3,-2.0 30,-0.0 2,-0.1 -0.821 54.2-156.3-107.7 109.5 2.1 -24.8 -38.3 24 23 A H E +A 19 0A 90 -2,-0.7 2,-0.3 -5,-0.2 -5,-0.2 -0.482 20.1 169.9 -76.5 147.6 5.7 -25.2 -37.1 25 24 A F E -A 18 0A 0 -7,-2.3 -7,-2.0 -2,-0.1 2,-0.3 -0.976 18.8-163.9-151.3 163.1 6.5 -25.0 -33.4 26 25 A K E -AC 17 48A 71 22,-1.9 21,-2.2 -2,-0.3 22,-1.6 -0.977 10.7-176.6-149.7 138.6 9.3 -25.6 -31.0 27 26 A C E -AC 16 46A 1 -11,-3.2 -11,-2.6 -2,-0.3 2,-0.3 -0.961 10.0-163.4-133.0 154.2 9.2 -25.9 -27.2 28 27 A T E +AC 15 45A 51 17,-2.4 17,-3.1 -2,-0.3 2,-0.3 -0.941 15.3 179.9-125.9 155.4 11.7 -26.4 -24.4 29 28 A S E -AC 14 44A 10 -15,-2.0 -15,-2.8 -2,-0.3 2,-0.3 -0.996 14.4-169.2-152.5 158.4 11.0 -27.5 -20.8 30 29 A E E +AC 13 43A 90 13,-1.8 13,-3.0 -2,-0.3 2,-0.3 -0.976 24.3 136.5-142.2 149.6 12.6 -28.2 -17.5 31 30 A G E -AC 12 42A 1 -19,-2.1 -19,-2.4 -2,-0.3 2,-0.3 -0.943 31.9-131.8-167.5-167.0 11.2 -29.9 -14.4 32 31 A E E +AC 11 41A 66 9,-1.4 9,-2.8 -2,-0.3 2,-0.3 -0.962 22.4 161.5-156.8 162.8 11.6 -32.3 -11.6 33 32 A G E -AC 10 40A 10 -23,-1.9 -23,-1.9 -2,-0.3 7,-0.3 -0.958 43.3 -92.9-167.2-172.6 9.7 -35.1 -9.9 34 33 A K E >>> - C 0 39A 71 5,-2.7 5,-1.4 -2,-0.3 4,-1.4 -0.914 30.0-165.0-121.6 99.7 9.7 -38.2 -7.6 35 34 A P T 345S+ 0 0 0 0, 0.0 -1,-0.1 0, 0.0 -27,-0.1 0.821 88.1 42.8 -61.9 -33.6 10.1 -41.2 -9.8 36 35 A Y T 345S+ 0 0 37 -28,-0.2 -28,-0.1 1,-0.2 -27,-0.1 0.698 114.8 49.8 -85.2 -19.7 9.1 -43.8 -7.2 37 36 A E T <45S- 0 0 100 -3,-0.7 33,-0.2 -29,-0.2 -1,-0.2 0.559 108.4-126.5 -90.1 -11.5 6.2 -41.7 -5.9 38 37 A G T <5 + 0 0 0 -4,-1.4 178,-2.6 1,-0.2 2,-0.3 0.721 65.4 123.6 75.8 25.8 5.0 -41.2 -9.5 39 38 A T E < +CD 34 215A 36 -5,-1.4 -5,-2.7 176,-0.2 2,-0.3 -0.892 28.1 161.7-122.6 148.1 4.8 -37.4 -9.5 40 39 A Q E -CD 33 214A 10 174,-1.9 174,-2.8 -2,-0.3 2,-0.4 -0.985 22.7-150.4-162.4 152.2 6.3 -34.7 -11.7 41 40 A T E -CD 32 213A 27 -9,-2.8 -9,-1.4 -2,-0.3 2,-0.4 -0.968 12.0-166.5-125.1 142.0 6.1 -31.1 -12.7 42 41 A M E -CD 31 212A 8 170,-2.9 170,-3.1 -2,-0.4 2,-0.6 -0.998 9.2-156.2-131.7 131.4 7.2 -29.7 -16.0 43 42 A R E -CD 30 211A 50 -13,-3.0 -13,-1.8 -2,-0.4 2,-0.4 -0.955 22.5-163.7-108.9 117.4 7.6 -26.0 -16.9 44 43 A I E -CD 29 210A 1 166,-3.7 166,-2.5 -2,-0.6 2,-0.5 -0.854 14.0-168.1-115.5 131.0 7.2 -25.4 -20.6 45 44 A K E -CD 28 209A 121 -17,-3.1 -17,-2.4 -2,-0.4 2,-0.6 -0.974 17.4-143.4-113.6 127.9 8.2 -22.6 -22.9 46 45 A V E +C 27 0A 16 162,-2.4 -19,-0.3 -2,-0.5 3,-0.1 -0.832 26.9 171.6 -80.1 119.7 7.0 -22.2 -26.5 47 46 A V E + 0 0 76 -21,-2.2 2,-0.3 -2,-0.6 -20,-0.2 0.532 61.2 29.6-112.9 -13.8 10.1 -20.8 -28.2 48 47 A E E S+C 26 0A 81 -22,-1.6 -22,-1.9 0, 0.0 -1,-0.3 -0.982 119.3 18.9-143.7 139.4 9.1 -20.9 -32.0 49 48 A G S S- 0 0 44 -2,-0.3 -22,-0.0 1,-0.3 -24,-0.0 0.329 90.4-178.7 89.5 -7.5 5.6 -20.7 -33.5 50 49 A G + 0 0 38 -24,-0.1 -1,-0.3 2,-0.1 2,-0.1 -0.419 57.2 46.4 -80.7 151.2 3.9 -19.2 -30.5 51 50 A P S S- 0 0 74 0, 0.0 156,-0.1 0, 0.0 155,-0.1 0.578 96.5-134.4 -69.0 140.1 1.2 -18.3 -29.7 52 51 A L - 0 0 4 154,-0.4 4,-0.1 155,-0.2 -2,-0.1 -0.382 6.1-142.7 -70.7 137.4 0.1 -21.6 -31.1 53 52 A P S S+ 0 0 42 0, 0.0 2,-0.3 0, 0.0 81,-0.2 0.351 83.3 60.5 -81.6 11.0 -2.9 -21.7 -33.5 54 53 A F S S- 0 0 0 79,-0.1 78,-0.2 80,-0.1 2,-0.2 -0.901 102.0 -79.4-132.2 160.2 -3.9 -25.0 -31.9 55 54 A A > - 0 0 0 76,-1.7 3,-1.4 -2,-0.3 4,-0.2 -0.409 29.9-145.5 -57.1 120.7 -4.9 -26.3 -28.5 56 55 A F T >> S+ 0 0 0 1,-0.2 3,-2.5 -2,-0.2 4,-0.9 0.793 92.8 80.8 -56.6 -29.0 -1.7 -26.9 -26.4 57 56 A D H >> S+ 0 0 6 1,-0.3 3,-0.9 2,-0.2 4,-0.5 0.844 81.1 62.1 -44.8 -39.9 -3.7 -29.9 -24.9 58 57 A I H <4 S+ 0 0 2 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.672 108.0 44.6 -66.5 -14.2 -2.8 -32.0 -28.0 59 58 A L H X4 S+ 0 0 0 -3,-2.5 3,-1.9 -4,-0.2 4,-0.3 0.589 89.6 89.7 -96.5 -18.2 0.9 -31.6 -27.0 60 59 A A H X< S+ 0 0 4 -4,-0.9 3,-1.2 -3,-0.9 -2,-0.1 0.819 81.4 54.4 -58.0 -37.4 0.4 -32.3 -23.3 61 60 A T T 3< S+ 0 0 28 -4,-0.5 -1,-0.3 1,-0.2 -2,-0.1 0.580 101.3 61.6 -75.8 -5.4 0.9 -36.0 -23.4 62 61 A S T < 0 0 1 -3,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.467 360.0 360.0 -97.0 -7.6 4.2 -35.7 -25.2 63 62 A F < 0 0 9 -3,-1.2 -2,-0.2 -4,-0.3 -1,-0.2 0.774 360.0 360.0 -73.6 360.0 6.0 -33.7 -22.4 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 66 A S > 0 0 16 0, 0.0 3,-1.6 0, 0.0 -3,-0.0 0.000 360.0 360.0 360.0 69.5 7.8 -39.2 -19.2 66 67 A K T 3 + 0 0 6 1,-0.3 3,-0.5 2,-0.1 13,-0.2 0.521 360.0 76.2 -76.3 -10.6 7.7 -42.9 -18.2 67 68 A T T 3 S+ 0 0 0 1,-0.2 2,-0.6 12,-0.1 -1,-0.3 0.750 87.3 67.2 -66.4 -23.5 10.5 -42.9 -15.6 68 69 A F S < S+ 0 0 0 -3,-1.6 2,-0.5 -30,-0.1 148,-0.3 -0.322 71.6 119.3 -98.0 49.2 8.2 -41.2 -13.1 69 70 A I - 0 0 0 -2,-0.6 2,-1.1 -3,-0.5 148,-0.2 -0.965 63.0-133.1-112.6 128.2 5.6 -44.0 -12.6 70 71 A N E -e 217 0A 51 146,-2.5 148,-2.8 -2,-0.5 2,-1.1 -0.731 22.1-155.9 -74.4 103.3 5.1 -45.5 -9.2 71 72 A H E -e 218 0A 28 -2,-1.1 3,-0.4 146,-0.2 148,-0.1 -0.744 19.0-175.1 -85.9 101.5 5.2 -49.2 -10.0 72 73 A T > + 0 0 39 146,-1.6 3,-2.2 -2,-1.1 145,-0.0 -0.213 55.8 37.4 -84.8 177.5 3.3 -50.8 -7.1 73 74 A Q T 3 S- 0 0 117 1,-0.3 -1,-0.2 146,-0.0 146,-0.1 0.703 125.7 -72.1 56.0 24.7 2.7 -54.5 -6.3 74 75 A G T 3 S+ 0 0 70 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.701 77.3 170.0 65.7 21.8 6.2 -55.4 -7.4 75 76 A I < - 0 0 7 -3,-2.2 -1,-0.2 143,-0.1 143,-0.1 -0.503 44.0-106.8 -65.2 124.5 5.5 -54.9 -11.1 76 77 A P - 0 0 15 0, 0.0 2,-1.0 0, 0.0 -1,-0.1 -0.326 30.0-130.1 -54.8 134.9 8.8 -55.0 -13.0 77 78 A D > - 0 0 10 1,-0.2 4,-2.6 -6,-0.1 5,-0.2 -0.754 25.0-177.7-100.1 93.1 9.8 -51.5 -14.1 78 79 A F T 4 S+ 0 0 3 -2,-1.0 4,-0.4 1,-0.2 -1,-0.2 0.823 83.5 44.7 -58.0 -37.3 10.7 -51.6 -17.8 79 80 A F T >4 S+ 0 0 0 -13,-0.2 3,-0.8 2,-0.2 4,-0.3 0.921 113.8 45.3 -78.8 -48.3 11.6 -47.9 -17.9 80 81 A K G >4 S+ 0 0 1 1,-0.2 3,-1.1 -14,-0.2 -2,-0.2 0.902 110.9 55.7 -63.0 -37.9 13.6 -47.6 -14.7 81 82 A Q G 3< S+ 0 0 21 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.682 92.4 74.1 -64.5 -20.0 15.5 -50.9 -15.6 82 83 A S G X> S+ 0 0 0 -3,-0.8 4,-1.4 -4,-0.4 3,-0.6 0.661 79.3 136.4 -74.1 -17.0 16.6 -49.4 -19.0 83 84 A F T <4 + 0 0 6 -3,-1.1 -78,-0.1 -4,-0.3 -79,-0.1 -0.486 53.6 26.7 -80.1 150.9 19.2 -47.0 -17.6 84 85 A P T 34 S+ 0 0 75 0, 0.0 25,-0.5 0, 0.0 -1,-0.3 -0.991 130.9 45.6 -75.0 -13.7 22.0 -46.1 -18.1 85 86 A E T <4 S- 0 0 80 -3,-0.6 -2,-0.3 1,-0.2 2,-0.1 0.844 96.6-155.3 -61.3 -38.0 21.2 -47.0 -21.8 86 87 A G < - 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