==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/IMMUNE SYSTEM 11-JAN-12 4D9R . COMPND 2 MOLECULE: COMPLEMENT FACTOR D; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.M.MURRAY,C.WIESMANN . 1317 6 17 16 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 54740.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 840 63.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 1.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 473 35.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 0.9 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 . 1 0.1 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 . 138 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 117 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 43 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 0.8 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 1 4 0 2 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 2 1 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 PARALLEL BRIDGES PER LADDER . 10 22 11 15 12 20 0 0 2 2 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 10 0 2 6 0 2 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 16 A I 0 0 1 0, 0.0 3,-0.5 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 113.3 -36.4 23.6 7.4 2 17 A L B +A 177 0A 12 175,-2.9 175,-2.4 1,-0.2 130,-0.1 -0.785 360.0 8.4-100.3 138.4 -36.0 24.7 3.7 3 18 A G S S+ 0 0 39 128,-0.7 -1,-0.2 -2,-0.4 2,-0.1 0.728 106.4 110.4 66.3 27.4 -38.3 23.6 1.0 4 19 A G - 0 0 35 -3,-0.5 2,-0.3 127,-0.1 -1,-0.2 -0.286 59.5-123.5-111.5-163.9 -40.7 22.0 3.5 5 20 A R E -B 143 0B 184 138,-1.7 138,-2.3 -2,-0.1 -3,-0.0 -0.930 40.1 -70.6-142.9 161.2 -44.2 22.8 4.9 6 21 A E E -B 142 0B 110 -2,-0.3 136,-0.3 136,-0.2 2,-0.1 -0.286 49.7-124.0 -55.8 132.8 -45.8 23.4 8.3 7 22 A A - 0 0 3 134,-3.5 2,-0.2 51,-0.1 -1,-0.1 -0.497 33.9 -96.9 -75.3 147.5 -46.0 20.3 10.5 8 23 A E > - 0 0 154 -2,-0.1 3,-1.9 1,-0.1 4,-0.3 -0.542 58.4 -91.7 -64.2 131.3 -49.5 19.3 11.8 9 24 A A T 3 S- 0 0 45 1,-0.3 -1,-0.1 -2,-0.2 49,-0.1 -0.270 102.5 -7.1 -50.7 128.1 -49.7 20.8 15.3 10 25 A H T 3 S+ 0 0 53 47,-0.3 -1,-0.3 2,-0.2 48,-0.1 0.528 91.1 126.4 60.8 17.1 -48.5 18.4 18.0 11 26 A A S < S+ 0 0 51 -3,-1.9 -2,-0.1 1,-0.2 -1,-0.1 0.633 74.8 50.9 -76.9 -13.5 -48.2 15.4 15.5 12 27 A R > + 0 0 38 -4,-0.3 3,-2.0 1,-0.1 -1,-0.2 -0.806 68.4 177.1-122.3 78.9 -44.5 14.9 16.7 13 28 A P T 3 S+ 0 0 21 0, 0.0 93,-0.7 0, 0.0 43,-0.5 0.731 76.9 62.9 -58.5 -23.1 -45.0 14.8 20.5 14 29 A Y T 3 S+ 0 0 25 91,-0.2 16,-2.6 93,-0.1 2,-0.3 0.501 77.3 115.8 -75.0 -13.9 -41.2 14.2 20.9 15 30 A M E < -J 29 0C 4 -3,-2.0 41,-0.6 14,-0.2 42,-0.4 -0.490 43.3-178.6 -70.3 130.9 -40.3 17.6 19.3 16 31 A A E -JK 28 55C 0 12,-2.1 12,-1.0 -2,-0.3 2,-0.6 -0.887 25.2-139.8-128.8 152.2 -38.5 20.1 21.6 17 32 A S E -JK 27 54C 0 37,-2.2 37,-2.8 -2,-0.3 2,-0.6 -0.960 15.5-151.2-114.9 111.8 -37.2 23.6 21.3 18 33 A V E -JK 26 53C 0 8,-3.2 7,-2.6 -2,-0.6 8,-2.0 -0.768 26.8-161.5 -83.2 119.5 -33.8 24.1 23.0 19 34 A Q E -JK 24 52C 12 33,-3.7 33,-2.2 -2,-0.6 2,-0.5 -0.837 26.5-161.1-114.0 149.9 -33.8 27.8 24.1 20 35 A L E > S-JK 23 51C 35 3,-2.4 3,-1.0 -2,-0.3 31,-0.2 -0.978 87.8 -18.9-126.4 108.0 -31.3 30.4 25.1 21 37 A N T 3 S- 0 0 109 29,-2.4 -1,-0.1 -2,-0.5 30,-0.1 0.913 127.6 -53.1 56.4 49.2 -32.9 33.4 27.0 22 38 A G T 3 S+ 0 0 48 28,-0.4 2,-0.4 1,-0.2 -1,-0.2 0.542 115.3 113.4 66.3 10.7 -36.4 32.5 25.7 23 39 A A E < S-J 20 0C 58 -3,-1.0 -3,-2.4 0, 0.0 2,-0.2 -0.949 76.9-104.7-111.2 134.6 -35.3 32.4 22.0 24 40 A H E +J 19 0C 25 -2,-0.4 -5,-0.2 -5,-0.2 3,-0.1 -0.425 48.4 159.7 -58.1 125.0 -35.2 29.2 19.8 25 41 A L E + 0 0 51 -7,-2.6 2,-0.3 1,-0.4 158,-0.2 0.738 58.0 1.3-113.8 -47.2 -31.6 28.0 19.4 26 42 A a E -J 18 0C 7 -8,-2.0 -8,-3.2 156,-0.1 -1,-0.4 -0.975 65.5-110.6-145.4 159.6 -31.7 24.3 18.5 27 43 A G E -J 17 0C 0 156,-2.5 12,-0.4 -2,-0.3 2,-0.3 -0.295 37.8-174.0 -79.9 167.7 -34.1 21.4 17.8 28 44 A G E -J 16 0C 0 -12,-1.0 -12,-2.1 10,-0.1 2,-0.4 -0.986 19.9-137.1-163.1 160.2 -34.3 18.5 20.3 29 45 A V E -JL 15 37C 0 8,-2.8 8,-3.8 -2,-0.3 2,-0.5 -0.983 17.0-134.7-134.1 121.3 -35.9 15.1 20.8 30 46 A L E + L 0 36C 0 -16,-2.6 78,-2.7 -2,-0.4 6,-0.2 -0.656 32.3 165.9 -71.0 118.0 -37.5 13.8 24.0 31 47 A V + 0 0 14 4,-2.3 2,-0.2 -2,-0.5 5,-0.2 0.577 66.5 11.1-110.2 -21.3 -36.0 10.3 24.4 32 48 A A S S- 0 0 25 3,-1.6 3,-0.3 77,-0.1 -1,-0.2 -0.833 92.7 -89.2-146.0 172.1 -37.1 9.6 28.1 33 49 A E S S+ 0 0 101 -2,-0.2 66,-2.5 1,-0.2 64,-0.1 0.808 126.2 22.4 -57.6 -37.7 -39.4 11.4 30.5 34 50 A Q S S+ 0 0 51 64,-0.2 61,-3.0 193,-0.1 2,-0.5 0.307 112.6 82.9-113.7 6.6 -36.7 13.7 31.9 35 51 A W E - M 0 94C 13 -3,-0.3 -4,-2.3 59,-0.2 -3,-1.6 -0.953 48.6-171.5-127.9 128.6 -34.2 13.6 29.0 36 52 A V E -LM 30 93C 0 57,-2.3 57,-3.2 -2,-0.5 2,-0.4 -0.937 17.3-143.1-113.0 130.4 -34.0 15.6 25.7 37 53 A L E +LM 29 92C 0 -8,-3.8 -8,-2.8 -2,-0.4 55,-0.2 -0.805 37.8 138.8 -95.3 132.1 -31.4 14.6 23.0 38 54 A S E - M 0 91C 0 53,-2.8 53,-2.3 -2,-0.4 2,-0.4 -0.692 52.1 -68.8-147.5-163.8 -29.8 17.5 21.0 39 55 A A > - 0 0 0 -12,-0.4 3,-1.0 51,-0.3 4,-0.4 -0.857 27.2-136.7-106.6 141.7 -26.4 18.5 19.6 40 56 A A G > S+ 0 0 11 -2,-0.4 3,-1.2 1,-0.2 4,-0.2 0.856 101.2 64.0 -62.1 -39.4 -23.3 19.6 21.8 41 57 A H G > S+ 0 0 47 1,-0.2 3,-1.0 2,-0.2 4,-0.4 0.660 87.5 74.5 -61.8 -15.4 -22.4 22.5 19.5 42 58 A a G < S+ 0 0 8 -3,-1.0 3,-0.4 1,-0.2 -1,-0.2 0.904 97.4 45.8 -62.6 -39.4 -25.7 24.2 20.4 43 59 A L G X> S+ 0 0 43 -3,-1.2 3,-1.1 -4,-0.4 4,-0.7 0.438 86.8 100.7 -83.2 -1.7 -24.4 25.0 23.9 44 60 A E T <4 S+ 0 0 86 -3,-1.0 2,-0.2 1,-0.3 -1,-0.2 0.874 90.8 26.8 -53.6 -50.7 -21.1 26.4 22.4 45 61 A D T 34 S+ 0 0 159 -3,-0.4 -1,-0.3 -4,-0.4 -2,-0.1 -0.392 103.9 83.4-112.2 51.6 -21.8 30.2 22.6 46 61AA A T X4 + 0 0 15 -3,-1.1 3,-1.8 -2,-0.2 2,-1.7 0.788 40.2 130.3-112.0 -56.5 -24.2 30.2 25.4 47 61BA A T 3< S+ 0 0 106 -4,-0.7 -2,-0.1 1,-0.3 -1,-0.0 -0.031 81.0 38.1 29.4 -60.9 -22.2 30.3 28.7 48 61CA D T 3 S+ 0 0 166 -2,-1.7 -1,-0.3 2,-0.1 -2,-0.1 0.916 100.5 92.4 -76.0 -42.2 -24.0 33.2 30.3 49 62 A G S < S- 0 0 22 -3,-1.8 2,-0.8 1,-0.1 -3,-0.1 0.200 81.4-100.7 -59.6 163.9 -27.6 32.5 29.2 50 63 A K - 0 0 102 -4,-0.0 -29,-2.4 21,-0.0 2,-0.5 -0.782 36.5-153.0 -87.3 107.5 -30.6 30.7 30.6 51 64 A V E +K 20 0C 32 -2,-0.8 21,-0.8 -31,-0.2 2,-0.3 -0.796 24.4 167.7 -87.6 121.4 -30.8 27.3 28.8 52 65 A Q E -KN 19 71C 27 -33,-2.2 -33,-3.7 -2,-0.5 2,-0.5 -0.950 30.2-138.9-134.4 155.5 -34.4 25.9 28.7 53 66 A V E -KN 18 70C 0 17,-2.9 17,-2.3 -2,-0.3 2,-0.6 -0.960 14.4-157.8-119.7 114.1 -36.3 23.1 26.9 54 67 A L E -KN 17 69C 7 -37,-2.8 -37,-2.2 -2,-0.5 3,-0.3 -0.817 15.3-171.5 -92.7 120.0 -39.8 23.9 25.5 55 68 A L E +KN 16 68C 0 13,-2.3 13,-1.8 -2,-0.6 -39,-0.1 -0.686 58.8 25.2-110.3 162.3 -42.1 20.8 25.0 56 69 A G S S+ 0 0 3 -41,-0.6 2,-0.2 -43,-0.5 -1,-0.2 0.730 87.4 148.9 60.6 28.2 -45.5 20.2 23.4 57 70 A A + 0 0 7 -42,-0.4 -47,-0.3 -3,-0.3 -1,-0.2 -0.599 29.7 158.8 -93.8 149.3 -45.0 23.3 21.1 58 71 A H S S+ 0 0 11 1,-0.6 83,-1.6 -2,-0.2 2,-0.4 0.476 79.2 38.4-124.4 -55.4 -46.2 24.1 17.7 59 72 A S B -P 140 0D 8 81,-0.2 -1,-0.6 3,-0.2 81,-0.2 -0.788 67.8-153.5 -96.1 137.5 -46.0 27.9 17.7 60 73 A L S S+ 0 0 45 79,-2.1 -1,-0.1 -2,-0.4 80,-0.1 0.782 94.5 33.5 -78.2 -33.3 -43.0 29.4 19.5 61 74 A S S S+ 0 0 69 78,-0.2 -1,-0.1 2,-0.1 79,-0.1 0.805 103.7 78.0 -92.3 -36.3 -44.8 32.7 20.3 62 75 A Q S S- 0 0 115 77,-0.1 -4,-0.2 1,-0.1 -3,-0.2 -0.556 80.9-114.1 -84.5 139.5 -48.4 31.7 20.8 63 76 A P + 0 0 120 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.511 36.5 178.4 -73.9 138.3 -49.8 30.1 24.0 64 77 A E - 0 0 39 -2,-0.2 3,-0.4 3,-0.1 -7,-0.0 -0.945 38.2-117.7-134.7 149.1 -51.0 26.6 23.6 65 78 A P S S+ 0 0 139 0, 0.0 -1,-0.1 0, 0.0 -9,-0.0 0.941 114.4 43.7 -55.3 -49.4 -52.5 24.3 26.3 66 79 A S S S+ 0 0 40 -10,-0.2 2,-0.3 -3,-0.1 -9,-0.1 0.629 86.2 112.2 -69.6 -22.8 -49.7 21.6 26.0 67 80 A K + 0 0 44 -3,-0.4 2,-0.4 -11,-0.1 -11,-0.2 -0.411 38.8 167.6 -62.1 119.9 -46.8 24.2 25.8 68 81 A R E -N 55 0C 90 -13,-1.8 -13,-2.3 -2,-0.3 2,-0.6 -0.987 26.9-146.1-137.5 124.4 -44.6 24.0 28.9 69 82 A L E -N 54 0C 72 -2,-0.4 2,-0.4 -15,-0.2 -15,-0.2 -0.828 21.8-162.0 -91.5 118.2 -41.1 25.7 29.2 70 83 A Y E -N 53 0C 3 -17,-2.3 -17,-2.9 -2,-0.6 2,-0.1 -0.853 12.0-130.8-107.2 140.2 -38.8 23.5 31.4 71 84 A D E -N 52 0C 63 -2,-0.4 25,-1.9 -19,-0.2 2,-0.7 -0.364 29.8-107.5 -80.9 162.8 -35.6 24.5 33.1 72 85 A V E +O 95 0C 39 -21,-0.8 23,-0.2 23,-0.2 3,-0.1 -0.852 31.8 177.0-103.8 114.7 -32.4 22.5 32.7 73 86 A L E S+ 0 0 106 21,-2.2 2,-0.3 -2,-0.7 -1,-0.2 0.925 75.1 7.2 -74.5 -49.7 -31.2 20.5 35.7 74 87 A R E -O 94 0C 120 20,-1.2 20,-3.6 2,-0.0 2,-0.5 -0.998 58.2-155.9-140.4 139.5 -28.2 18.8 34.0 75 88 A A E -O 93 0C 48 -2,-0.3 18,-0.2 18,-0.2 -3,-0.0 -0.965 15.3-176.5-116.5 108.5 -26.4 19.3 30.6 76 89 A V E -O 92 0C 27 16,-3.1 16,-2.7 -2,-0.5 150,-0.1 -0.817 1.9-173.2-110.5 91.8 -24.5 16.2 29.5 77 90 A P E -O 91 0C 61 0, 0.0 14,-0.3 0, 0.0 12,-0.1 -0.381 47.3 -82.9 -72.4 161.2 -22.5 16.7 26.2 78 91 A H > - 0 0 18 12,-2.5 3,-1.6 10,-0.4 12,-0.0 -0.458 42.2-126.4 -60.6 134.7 -20.9 13.5 24.7 79 92 A P T 3 S+ 0 0 96 0, 0.0 -1,-0.1 0, 0.0 9,-0.0 0.827 107.6 48.2 -56.4 -29.1 -17.5 13.3 26.7 80 93 A D T 3 S+ 0 0 98 8,-0.1 2,-0.2 2,-0.0 7,-0.1 0.475 90.8 100.1 -91.2 -3.4 -15.5 13.1 23.4 81 94 A S < + 0 0 22 -3,-1.6 7,-0.1 7,-0.2 5,-0.1 -0.488 44.2 157.7 -77.9 157.5 -17.2 16.1 21.7 82 95 A Q > - 0 0 118 3,-0.5 3,-1.1 5,-0.4 -41,-0.1 -0.948 52.7 -82.1-166.1 176.2 -15.5 19.5 21.7 83 96 A P T 3 S+ 0 0 95 0, 0.0 -2,-0.0 0, 0.0 -39,-0.0 0.739 116.2 51.5 -66.2 -26.8 -15.6 22.8 19.7 84 97 A D T 3 S+ 0 0 162 1,-0.0 2,-0.4 2,-0.0 -3,-0.0 0.379 101.9 63.8 -93.3 5.1 -13.3 21.9 16.8 85 98 A T < - 0 0 43 -3,-1.1 -3,-0.5 2,-0.1 -1,-0.0 -0.989 57.6-151.5-134.8 144.5 -15.0 18.7 15.7 86 99 A I S > S+ 0 0 72 -2,-0.4 3,-1.0 -5,-0.1 -1,-0.1 0.587 71.1 113.9 -78.6 -12.2 -18.2 17.5 14.2 87 100 A D T 3 S+ 0 0 56 1,-0.2 -5,-0.4 -7,-0.1 -2,-0.1 -0.361 82.7 2.3 -65.4 140.8 -17.5 14.2 15.9 88 101 A H T 3 S+ 0 0 47 1,-0.2 2,-2.4 -7,-0.1 -10,-0.4 0.786 75.9 174.2 54.3 39.6 -19.7 13.0 18.7 89 102 A D < + 0 0 10 -3,-1.0 2,-0.3 -50,-0.1 -1,-0.2 -0.323 30.7 125.4 -77.4 60.6 -22.0 16.0 18.3 90 103 A L - 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