==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-JAN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DE NOVO PROTEIN 30-JUN-09 2KL8 . COMPND 2 MOLECULE: OR15; . SOURCE 2 ORGANISM_SCIENTIFIC: ARTIFICIAL GENE; . AUTHOR G.LIU,N.KOGA,M.JIANG,R.KOGA,R.XIAO,C.CICCOSANTI,D.BAKER, . 85 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6364.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 77 90.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 22 25.9 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 1.2 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 . 20 23.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 28 32.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 1.2 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 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 2 1 0 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 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 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 40 0, 0.0 48,-2.4 0, 0.0 47,-0.7 0.000 360.0 360.0 360.0 123.7 -3.9 12.6 6.4 2 2 A E E -AB 47 77A 69 75,-1.0 75,-2.3 45,-0.2 2,-0.4 -0.632 360.0-150.2-104.8 165.9 -2.3 9.2 6.7 3 3 A M E -AB 46 76A 1 43,-1.5 43,-2.7 73,-0.2 2,-0.8 -0.935 3.8-158.0-143.8 117.3 -3.0 6.0 4.8 4 4 A D E -AB 45 75A 18 71,-2.6 71,-2.6 -2,-0.4 2,-0.7 -0.825 12.7-174.1 -94.6 103.9 -2.7 2.3 6.0 5 5 A I E -AB 44 74A 0 39,-3.2 39,-2.4 -2,-0.8 2,-0.8 -0.870 6.3-164.2 -99.4 108.9 -2.3 -0.0 3.0 6 6 A R E -AB 43 73A 85 67,-3.3 67,-2.2 -2,-0.7 2,-0.5 -0.822 0.7-164.1 -99.9 107.2 -2.3 -3.6 4.2 7 7 A F E -AB 42 72A 0 35,-2.2 35,-3.1 -2,-0.8 2,-0.4 -0.795 7.6-177.4 -90.4 126.6 -1.1 -6.2 1.7 8 8 A R E + B 0 71A 131 63,-3.0 63,-3.0 -2,-0.5 2,-0.2 -0.976 18.8 143.6-127.1 120.1 -1.9 -9.8 2.4 9 9 A G - 0 0 10 -2,-0.4 3,-0.1 61,-0.2 60,-0.1 -0.677 52.2-114.9-142.6-170.7 -0.6 -12.6 0.0 10 10 A D S S+ 0 0 125 -2,-0.2 2,-0.3 1,-0.2 -1,-0.1 0.822 92.9 44.6-103.9 -47.1 0.7 -16.1 -0.4 11 11 A D S >> S- 0 0 64 1,-0.1 4,-0.8 0, 0.0 3,-0.6 -0.743 76.8-127.9-100.8 152.8 4.3 -15.7 -1.7 12 12 A L H >> S+ 0 0 101 -2,-0.3 4,-2.6 1,-0.2 3,-0.7 0.857 105.3 65.4 -65.0 -36.7 6.9 -13.1 -0.3 13 13 A E H 3> S+ 0 0 110 1,-0.3 4,-2.9 2,-0.2 5,-0.4 0.827 93.6 61.9 -58.5 -32.8 7.6 -11.7 -3.8 14 14 A A H <> S+ 0 0 0 -3,-0.6 4,-1.6 2,-0.2 -1,-0.3 0.919 110.0 39.9 -56.4 -45.5 4.0 -10.4 -3.9 15 15 A F H < S+ 0 0 63 -4,-1.8 3,-2.3 1,-0.2 4,-0.4 0.872 113.7 68.2 -75.7 -39.2 6.4 6.5 -6.6 26 26 A A H ><>S+ 0 0 5 -4,-2.8 3,-1.5 1,-0.3 5,-0.6 0.779 87.9 67.8 -55.2 -30.0 6.0 7.6 -2.9 27 27 A R T 3<5S+ 0 0 205 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.1 0.793 93.2 59.4 -59.9 -29.0 9.6 9.1 -3.0 28 28 A K T < 5S+ 0 0 148 -3,-2.3 2,-0.3 -4,-0.2 -1,-0.3 0.643 102.8 65.7 -74.2 -14.9 8.3 11.7 -5.5 29 29 A F T < 5S- 0 0 68 -3,-1.5 2,-2.3 -4,-0.4 20,-0.0 -0.823 92.3-115.4-110.8 149.5 5.8 12.9 -2.7 30 30 A A T 5S+ 0 0 111 -2,-0.3 2,-0.4 2,-0.1 -3,-0.1 -0.321 76.5 118.8 -78.1 58.2 6.6 14.5 0.7 31 31 A G < - 0 0 14 -2,-2.3 2,-0.6 -5,-0.6 17,-0.2 -0.991 63.1-129.1-131.0 133.1 5.1 11.5 2.5 32 32 A T E -C 47 0A 94 15,-2.1 15,-2.9 -2,-0.4 2,-0.8 -0.681 20.5-148.4 -86.0 117.8 6.9 9.1 5.0 33 33 A V E +C 46 0A 38 -2,-0.6 2,-0.3 13,-0.2 13,-0.2 -0.747 23.9 169.7 -92.3 109.6 6.4 5.4 4.1 34 34 A T E +C 45 0A 63 11,-2.5 11,-1.7 -2,-0.8 2,-0.3 -0.844 5.0 177.6-113.4 153.6 6.4 3.1 7.2 35 35 A Y E -C 44 0A 120 -2,-0.3 2,-0.4 9,-0.3 9,-0.2 -0.993 18.2-158.8-156.4 149.1 5.4 -0.6 7.3 36 36 A T E -C 43 0A 86 7,-2.0 7,-2.5 -2,-0.3 2,-0.9 -0.994 11.9-149.8-130.3 126.6 5.1 -3.6 9.7 37 37 A L E +C 42 0A 99 -2,-0.4 2,-0.7 5,-0.2 5,-0.2 -0.808 20.1 179.1 -97.9 99.4 5.1 -7.2 8.5 38 38 A D - 0 0 120 3,-2.2 2,-0.5 -2,-0.9 -2,-0.0 -0.867 59.8 -59.1-106.2 106.7 3.0 -9.2 11.1 39 39 A G S S- 0 0 75 -2,-0.7 2,-0.4 1,-0.2 -2,-0.0 -0.460 123.7 -10.2 60.7-112.9 2.7 -12.9 10.2 40 40 A N S S+ 0 0 71 -2,-0.5 2,-0.2 -32,-0.0 -1,-0.2 -0.666 121.3 77.7-115.7 72.3 1.0 -12.9 6.8 41 41 A D - 0 0 16 -2,-0.4 -3,-2.2 -33,-0.1 2,-0.8 -0.685 59.9-150.9-176.0 122.3 0.0 -9.2 6.4 42 42 A L E -AC 7 37A 7 -35,-3.1 -35,-2.2 -5,-0.2 2,-0.9 -0.853 11.5-161.0-104.7 101.1 2.1 -6.1 5.6 43 43 A E E -AC 6 36A 60 -7,-2.5 -7,-2.0 -2,-0.8 2,-0.7 -0.717 8.9-168.8 -85.1 104.5 0.6 -2.9 7.2 44 44 A I E -AC 5 35A 0 -39,-2.4 -39,-3.2 -2,-0.9 2,-0.8 -0.837 3.3-167.7 -99.6 109.1 2.0 0.1 5.2 45 45 A R E -AC 4 34A 102 -11,-1.7 -11,-2.5 -2,-0.7 2,-0.7 -0.831 1.0-167.0 -98.9 106.2 1.4 3.5 6.9 46 46 A I E -AC 3 33A 2 -43,-2.7 -43,-1.5 -2,-0.8 2,-0.6 -0.835 12.3-153.1 -91.8 112.0 2.2 6.4 4.6 47 47 A T E +AC 2 32A 59 -15,-2.9 -15,-2.1 -2,-0.7 -45,-0.2 -0.765 66.4 20.0 -93.0 120.4 2.2 9.6 6.7 48 48 A G S S+ 0 0 35 -47,-0.7 -1,-0.2 -2,-0.6 -46,-0.2 0.937 72.5 157.2 92.9 65.1 1.4 12.9 5.0 49 49 A V - 0 0 11 -48,-2.4 -1,-0.2 -3,-0.2 2,-0.2 -0.964 35.6-128.7-122.1 136.6 -0.5 12.3 1.7 50 50 A P > - 0 0 58 0, 0.0 4,-2.3 0, 0.0 3,-0.4 -0.520 25.6-116.7 -78.6 150.8 -2.9 14.8 -0.2 51 51 A E H > S+ 0 0 128 1,-0.2 4,-1.0 2,-0.2 -2,-0.0 0.796 113.1 58.6 -60.1 -30.6 -6.4 13.7 -1.2 52 52 A Q H > S+ 0 0 132 1,-0.2 4,-0.8 2,-0.2 3,-0.4 0.937 112.6 38.1 -63.6 -45.6 -5.6 14.1 -4.9 53 53 A V H > S+ 0 0 7 -3,-0.4 4,-2.7 1,-0.2 5,-0.3 0.785 102.0 74.5 -77.1 -27.7 -2.7 11.6 -4.7 54 54 A R H X S+ 0 0 57 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.873 96.1 51.7 -48.9 -41.0 -4.7 9.4 -2.3 55 55 A K H X S+ 0 0 122 -4,-1.0 4,-2.5 -3,-0.4 -1,-0.2 0.951 110.2 46.4 -60.9 -51.8 -6.7 8.3 -5.3 56 56 A E H X S+ 0 0 109 -4,-0.8 4,-1.8 1,-0.2 -2,-0.2 0.898 116.4 43.8 -62.1 -44.7 -3.6 7.4 -7.4 57 57 A L H X S+ 0 0 4 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.928 115.0 48.4 -67.3 -45.7 -1.9 5.4 -4.6 58 58 A A H X S+ 0 0 12 -4,-2.3 4,-1.5 -5,-0.3 -2,-0.2 0.887 112.5 48.9 -62.4 -39.9 -5.2 3.6 -3.6 59 59 A K H X S+ 0 0 130 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.849 109.7 50.2 -72.3 -34.9 -6.0 2.7 -7.1 60 60 A E H X S+ 0 0 54 -4,-1.8 4,-3.1 2,-0.2 -1,-0.2 0.844 104.3 59.8 -71.4 -32.0 -2.5 1.3 -7.8 61 61 A A H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.918 106.8 47.1 -56.1 -44.1 -2.9 -0.7 -4.6 62 62 A E H X S+ 0 0 60 -4,-1.5 4,-1.6 2,-0.2 -2,-0.2 0.943 110.6 52.4 -58.1 -50.0 -5.9 -2.3 -6.3 63 63 A R H X S+ 0 0 156 -4,-2.1 4,-2.4 2,-0.2 5,-0.3 0.913 110.0 47.9 -53.4 -48.8 -3.8 -2.8 -9.5 64 64 A L H X S+ 0 0 16 -4,-3.1 4,-2.5 1,-0.2 6,-0.3 0.946 110.1 51.4 -57.7 -50.7 -1.1 -4.6 -7.5 65 65 A A H < S+ 0 0 7 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.762 111.3 51.2 -59.8 -26.4 -3.6 -6.8 -5.8 66 66 A K H >< S+ 0 0 141 -4,-1.6 3,-0.8 -3,-0.2 -2,-0.2 0.973 111.6 41.6 -74.4 -59.8 -5.0 -7.7 -9.2 67 67 A E H 3< S+ 0 0 116 -4,-2.4 -2,-0.2 1,-0.3 -3,-0.1 0.842 126.2 37.1 -57.8 -35.5 -1.7 -8.7 -11.0 68 68 A F T 3< S- 0 0 64 -4,-2.5 -1,-0.3 -5,-0.3 -2,-0.2 0.507 100.0-138.9 -92.8 -6.9 -0.6 -10.6 -7.8 69 69 A N < + 0 0 142 -3,-0.8 -3,-0.2 -5,-0.3 -4,-0.1 0.636 58.3 137.1 57.9 15.8 -4.2 -11.8 -7.1 70 70 A I - 0 0 14 -6,-0.3 2,-0.3 -5,-0.2 -61,-0.2 -0.243 60.1 -91.2 -87.1 174.9 -3.5 -11.0 -3.5 71 71 A T E -B 8 0A 75 -63,-3.0 -63,-3.0 -3,-0.1 2,-0.4 -0.688 37.9-173.5 -90.0 139.1 -5.6 -9.3 -0.8 72 72 A V E +B 7 0A 29 -2,-0.3 2,-0.4 -65,-0.2 -65,-0.2 -0.987 8.6 176.0-135.7 126.6 -5.4 -5.5 -0.2 73 73 A T E -B 6 0A 69 -67,-2.2 -67,-3.3 -2,-0.4 2,-0.5 -0.975 8.0-172.5-129.6 120.5 -7.1 -3.5 2.6 74 74 A Y E -B 5 0A 90 -2,-0.4 2,-0.6 -69,-0.3 -69,-0.3 -0.939 7.9-160.7-121.2 117.8 -6.4 0.3 2.9 75 75 A T E -B 4 0A 73 -71,-2.6 -71,-2.6 -2,-0.5 2,-0.7 -0.855 13.9-143.9 -98.8 116.9 -7.7 2.4 5.8 76 76 A I E -B 3 0A 42 -2,-0.6 2,-1.0 -73,-0.2 -73,-0.2 -0.692 10.8-142.7 -82.0 112.4 -7.8 6.2 5.1 77 77 A R E -B 2 0A 101 -75,-2.3 -75,-1.0 -2,-0.7 2,-0.3 -0.638 21.8-149.0 -78.9 101.6 -6.8 8.1 8.3 78 78 A L - 0 0 116 -2,-1.0 2,-0.5 -77,-0.2 -75,-0.0 -0.534 15.0-118.3 -80.0 131.9 -9.1 11.2 8.1 79 79 A E - 0 0 175 -2,-0.3 2,-0.2 -77,-0.0 -1,-0.1 -0.556 47.6-175.0 -65.0 116.4 -8.0 14.5 9.6 80 80 A H - 0 0 164 -2,-0.5 2,-0.2 2,-0.0 -1,-0.0 -0.686 23.7-177.5-121.3 168.4 -10.6 15.1 12.3 81 81 A H - 0 0 150 -2,-0.2 2,-1.2 2,-0.0 -2,-0.0 -0.789 34.9-119.0-168.7 117.4 -11.7 17.8 14.9 82 82 A H - 0 0 170 -2,-0.2 -2,-0.0 1,-0.0 0, 0.0 -0.449 44.7-147.7 -62.0 93.9 -14.4 17.8 17.5 83 83 A H - 0 0 129 -2,-1.2 -1,-0.0 1,-0.1 -3,-0.0 -0.076 15.9-146.8 -63.1 163.8 -16.4 20.7 16.1 84 84 A H 0 0 174 1,-0.1 -1,-0.1 0, 0.0 -2,-0.0 0.789 360.0 360.0 -98.4 -39.9 -18.4 23.2 18.3 85 85 A H 0 0 211 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.153 360.0 360.0-120.2 360.0 -21.3 24.0 15.9