==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 17-NOV-05 2F2Q . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR M.S.YOUSEF,N.BISCHOFF,C.M.DYER,W.A.BAASE,B.W.MATTHEWS . 175 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9667.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 123 70.3 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 . 12 6.9 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 . 2 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 7 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 91 52.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.1 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 2 0 1 2 1 0 0 0 1 1 0 0 0 0 1 0 1 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 . 1 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 61 0, 0.0 2,-0.3 0, 0.0 168,-0.0 0.000 360.0 360.0 360.0 139.1 40.3 -38.6 -40.5 2 2 A N > - 0 0 66 167,-0.0 4,-2.6 106,-0.0 5,-0.2 -0.891 360.0 -83.5-150.0 173.8 41.1 -35.4 -42.3 3 3 A I H > S+ 0 0 27 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.835 125.5 51.5 -57.5 -37.7 39.5 -32.0 -42.8 4 4 A F H > S+ 0 0 74 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.950 113.1 43.7 -64.9 -48.1 37.4 -33.3 -45.7 5 5 A E H > S+ 0 0 101 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.890 114.2 52.3 -62.3 -37.8 36.0 -36.2 -43.8 6 6 A M H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.939 112.7 42.3 -63.9 -51.0 35.5 -34.0 -40.8 7 7 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 5,-0.3 0.833 108.9 59.1 -69.2 -30.1 33.5 -31.4 -42.6 8 8 A R H X S+ 0 0 107 -4,-2.2 4,-1.9 -5,-0.2 -1,-0.2 0.920 108.3 47.0 -64.4 -38.1 31.5 -34.0 -44.6 9 9 A I H < S+ 0 0 49 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.948 117.2 42.9 -66.9 -44.8 30.3 -35.4 -41.2 10 10 A D H < S+ 0 0 20 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.810 123.3 34.2 -71.6 -31.6 29.5 -31.9 -39.9 11 11 A E H < S- 0 0 33 -4,-2.7 19,-0.5 1,-0.2 -1,-0.2 0.664 91.1-153.4 -96.6 -22.8 27.8 -30.5 -43.1 12 12 A G < - 0 0 23 -4,-1.9 2,-0.4 -5,-0.3 -1,-0.2 -0.227 24.6 -88.2 74.3-171.6 26.1 -33.6 -44.5 13 13 A L + 0 0 47 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.902 44.9 169.9-143.1 109.3 25.4 -33.9 -48.2 14 14 A R E -A 28 0A 136 14,-2.2 14,-2.6 -2,-0.4 4,-0.1 -0.988 20.6-160.2-124.9 133.9 22.2 -32.7 -49.8 15 15 A L E S+ 0 0 68 -2,-0.4 54,-2.4 12,-0.2 2,-0.3 0.537 74.4 56.5 -93.5 -4.0 21.6 -32.5 -53.5 16 16 A K E S-C 68 0B 143 52,-0.2 52,-0.2 12,-0.1 12,-0.1 -0.910 99.0 -87.5-124.3 150.3 18.8 -29.9 -53.5 17 17 A I E + 0 0 43 50,-1.8 2,-0.3 -2,-0.3 10,-0.2 -0.250 52.6 171.1 -54.5 140.6 18.7 -26.5 -52.1 18 18 A Y E -A 26 0A 37 8,-2.3 8,-3.3 -4,-0.1 2,-0.5 -0.907 33.4-109.3-143.2 167.9 17.7 -26.3 -48.4 19 19 A K E -A 25 0A 106 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.910 30.6-147.7-105.7 130.0 17.5 -23.7 -45.7 20 20 A D > - 0 0 51 4,-2.6 3,-2.2 -2,-0.5 5,-0.0 -0.313 35.1 -89.4 -87.9 177.5 20.0 -23.9 -42.8 21 21 A T T 3 S+ 0 0 96 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.709 126.6 52.8 -60.5 -22.1 19.5 -22.8 -39.2 22 22 A E T 3 S- 0 0 77 2,-0.1 -1,-0.3 0, 0.0 130,-0.0 0.315 122.8-104.7 -95.3 5.7 20.8 -19.3 -39.8 23 23 A G S < S+ 0 0 18 -3,-2.2 13,-2.6 1,-0.3 2,-0.4 0.756 73.5 140.0 78.1 25.5 18.3 -18.9 -42.7 24 24 A Y E - B 0 35A 68 11,-0.2 -4,-2.6 9,-0.0 2,-0.3 -0.845 56.6-121.1-101.7 135.7 20.7 -19.3 -45.5 25 25 A Y E +A 19 0A 8 9,-3.1 8,-3.3 -2,-0.4 9,-0.5 -0.629 45.7 176.5 -71.0 134.0 19.8 -21.3 -48.7 26 26 A T E -AB 18 32A 5 -8,-3.3 -8,-2.3 -2,-0.3 2,-0.3 -0.895 15.9-178.2-138.1 160.0 22.5 -24.0 -48.9 27 27 A I E > + B 0 31A 0 4,-1.7 4,-2.4 -2,-0.3 2,-0.2 -0.972 50.5 7.3-156.6 162.4 23.4 -27.0 -51.0 28 28 A G E 4 S-A 14 0A 0 -14,-2.6 -14,-2.2 -2,-0.3 2,-0.8 -0.406 123.3 -11.8 72.7-130.0 25.9 -29.9 -51.3 29 29 A I T 4 S- 0 0 6 45,-0.4 -1,-0.2 -16,-0.2 -17,-0.2 -0.733 129.1 -47.4-108.3 78.0 28.3 -30.1 -48.4 30 30 A G T 4 S+ 0 0 13 -2,-0.8 2,-0.9 -19,-0.5 -2,-0.2 0.779 83.2 162.3 67.9 27.5 27.6 -26.9 -46.6 31 31 A H E < -B 27 0A 28 -4,-2.4 -4,-1.7 -20,-0.1 2,-0.2 -0.717 29.8-145.4 -85.7 109.2 27.8 -24.6 -49.7 32 32 A L E +B 26 0A 83 -2,-0.9 -6,-0.2 -6,-0.2 3,-0.1 -0.488 24.1 172.2 -73.7 134.7 26.1 -21.3 -48.7 33 33 A L E - 0 0 13 -8,-3.3 2,-0.3 1,-0.4 -7,-0.2 0.791 50.2 -42.0-107.1 -76.3 24.1 -19.6 -51.4 34 34 A T E - 0 0 31 -9,-0.5 -9,-3.1 15,-0.0 -1,-0.4 -0.926 62.5 -80.4-151.5 170.2 22.1 -16.5 -50.3 35 35 A K E -B 24 0A 143 -2,-0.3 -11,-0.2 -11,-0.2 -12,-0.1 -0.479 37.2-136.8 -78.7 148.6 19.8 -15.4 -47.4 36 36 A S - 0 0 26 -13,-2.6 3,-0.1 -2,-0.2 10,-0.1 -0.622 21.4-115.9 -98.5 161.1 16.1 -16.3 -47.2 37 37 A P - 0 0 39 0, 0.0 -1,-0.1 0, 0.0 2,-0.0 -0.063 48.8 -64.6 -81.8-168.6 13.4 -13.9 -46.3 38 38 A S - 0 0 82 1,-0.1 4,-0.3 -2,-0.0 8,-0.0 -0.288 47.2-111.9 -71.6 164.7 11.1 -14.0 -43.2 39 39 A I S S+ 0 0 163 1,-0.2 -1,-0.1 2,-0.1 3,-0.1 0.704 126.7 36.8 -72.9 -14.5 8.7 -17.0 -43.0 40 40 A N S S+ 0 0 141 1,-0.1 -1,-0.2 2,-0.0 6,-0.1 0.816 86.1 123.2 -95.5 -46.2 6.0 -14.4 -43.4 41 41 A A S S- 0 0 40 1,-0.1 2,-0.2 4,-0.1 -2,-0.1 0.127 81.4 -74.3 25.4 -93.2 8.1 -12.4 -45.9 42 42 A A > - 0 0 37 -4,-0.3 4,-3.1 1,-0.1 5,-0.3 -0.671 25.2-117.4 171.3 132.5 5.7 -12.3 -48.8 43 43 A K H > S+ 0 0 177 1,-0.3 4,-1.7 2,-0.2 5,-0.2 0.890 123.1 49.9 -46.7 -39.9 4.7 -15.0 -51.4 44 44 A S H > S+ 0 0 76 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.932 110.8 47.5 -63.5 -48.8 6.3 -12.6 -53.8 45 45 A E H > S+ 0 0 80 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.879 108.3 55.0 -60.7 -43.4 9.5 -12.2 -51.8 46 46 A L H X S+ 0 0 79 -4,-3.1 4,-2.5 2,-0.2 5,-0.2 0.921 108.3 47.1 -59.5 -47.7 9.9 -15.9 -51.3 47 47 A D H X S+ 0 0 87 -4,-1.7 4,-2.6 -5,-0.3 -1,-0.2 0.933 112.6 51.4 -59.2 -46.8 9.9 -16.7 -55.0 48 48 A K H X S+ 0 0 99 -4,-1.9 4,-1.9 1,-0.2 -2,-0.2 0.921 111.3 47.0 -55.0 -49.2 12.3 -13.9 -55.7 49 49 A A H X S+ 0 0 5 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.888 110.7 51.2 -63.2 -41.2 14.7 -15.2 -53.0 50 50 A I H X S+ 0 0 51 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.918 110.7 49.1 -63.4 -45.1 14.5 -18.8 -54.2 51 51 A N H X S+ 0 0 94 -4,-2.6 4,-2.2 -5,-0.2 -1,-0.2 0.869 108.0 54.3 -63.9 -33.0 15.3 -17.6 -57.7 52 52 A A H X S+ 0 0 45 -4,-1.9 4,-2.1 -5,-0.2 -2,-0.2 0.899 110.0 47.6 -66.8 -38.2 18.2 -15.6 -56.3 53 53 A A H X S+ 0 0 1 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.910 111.6 49.7 -67.1 -42.1 19.6 -18.7 -54.7 54 54 A K H X S+ 0 0 52 -4,-2.6 4,-2.6 1,-0.2 11,-0.3 0.882 109.7 52.0 -63.3 -36.1 19.1 -20.7 -57.9 55 55 A S H X S+ 0 0 71 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.908 108.9 50.2 -67.4 -42.4 20.9 -18.0 -59.8 56 56 A E H X S+ 0 0 63 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.931 112.1 47.8 -59.3 -44.6 23.8 -18.1 -57.3 57 57 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 5,-0.3 0.934 109.2 52.1 -64.9 -41.1 24.0 -21.9 -57.7 58 58 A D H X>S+ 0 0 38 -4,-2.6 4,-2.7 1,-0.2 5,-1.1 0.894 110.5 49.1 -61.4 -40.4 23.9 -21.7 -61.5 59 59 A K H <5S+ 0 0 136 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.917 111.7 49.3 -63.4 -41.5 26.8 -19.2 -61.5 60 60 A A H <5S+ 0 0 39 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.890 121.1 34.0 -67.4 -39.7 28.8 -21.4 -59.1 61 61 A I H <5S- 0 0 38 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.764 100.7-129.4 -85.7 -29.8 28.3 -24.6 -61.2 62 62 A G T <5S+ 0 0 68 -4,-2.7 2,-0.3 -5,-0.3 -3,-0.2 0.789 75.8 83.1 81.7 30.7 28.3 -22.9 -64.6 63 63 A A S - 0 0 18 -2,-1.2 3,-1.5 -11,-0.3 -1,-0.2 0.678 34.6-148.0 -92.6 -22.6 20.7 -26.4 -62.3 66 66 A N T 3 S- 0 0 103 1,-0.2 3,-0.1 -12,-0.1 -12,-0.1 0.810 76.2 -52.7 50.3 34.6 17.2 -25.3 -61.2 67 67 A G T 3 S+ 0 0 6 -13,-0.2 -50,-1.8 1,-0.2 2,-0.4 0.599 117.7 100.4 86.8 7.6 18.4 -26.0 -57.6 68 68 A V B < +C 16 0B 70 -3,-1.5 2,-0.3 -52,-0.2 -52,-0.2 -0.989 42.4 176.0-130.0 136.7 19.6 -29.6 -58.0 69 69 A I - 0 0 6 -54,-2.4 2,-0.1 -2,-0.4 -41,-0.1 -0.882 27.9-110.0-132.7 167.9 23.2 -30.8 -58.4 70 70 A T > - 0 0 72 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.461 33.9-107.4 -90.0 168.3 25.0 -34.2 -58.6 71 71 A K H > S+ 0 0 118 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.910 121.6 53.9 -61.8 -41.3 27.3 -35.6 -55.9 72 72 A D H > S+ 0 0 122 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.910 109.5 47.2 -61.4 -40.9 30.4 -34.9 -58.2 73 73 A E H > S+ 0 0 62 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.910 110.6 52.2 -68.0 -37.6 29.3 -31.2 -58.4 74 74 A A H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -45,-0.4 0.908 109.6 49.6 -64.0 -38.8 28.8 -31.1 -54.6 75 75 A E H X S+ 0 0 77 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.831 108.4 54.0 -70.7 -28.0 32.3 -32.4 -54.1 76 76 A K H X S+ 0 0 130 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.946 109.7 45.7 -70.7 -46.5 33.7 -29.8 -56.5 77 77 A L H X S+ 0 0 3 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.901 112.6 53.5 -60.4 -35.7 32.1 -26.9 -54.6 78 78 A F H X S+ 0 0 12 -4,-2.1 4,-2.9 -5,-0.2 5,-0.3 0.925 106.5 50.2 -65.2 -43.5 33.4 -28.6 -51.4 79 79 A N H X S+ 0 0 91 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.936 113.8 46.7 -60.1 -42.8 37.0 -28.7 -52.7 80 80 A Q H X S+ 0 0 100 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.901 112.8 49.2 -65.3 -40.7 36.7 -25.0 -53.6 81 81 A D H X S+ 0 0 36 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.875 110.4 48.7 -71.3 -37.4 35.2 -24.1 -50.3 82 82 A V H X S+ 0 0 6 -4,-2.9 4,-2.4 2,-0.2 5,-0.2 0.942 112.7 49.8 -64.7 -44.2 37.8 -26.0 -48.2 83 83 A D H X S+ 0 0 98 -4,-2.3 4,-2.8 -5,-0.3 5,-0.2 0.929 111.0 49.9 -57.9 -44.5 40.5 -24.2 -50.3 84 84 A A H X S+ 0 0 60 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.869 108.2 52.1 -65.2 -37.0 38.9 -20.9 -49.7 85 85 A A H X S+ 0 0 7 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.923 112.2 45.6 -66.6 -42.8 38.7 -21.4 -46.0 86 86 A V H X S+ 0 0 33 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.930 113.6 48.9 -64.5 -44.1 42.4 -22.2 -45.8 87 87 A R H X S+ 0 0 147 -4,-2.8 4,-1.7 1,-0.2 -2,-0.2 0.896 109.2 54.3 -64.3 -36.2 43.3 -19.3 -48.0 88 88 A G H X S+ 0 0 6 -4,-2.5 4,-0.6 -5,-0.2 -1,-0.2 0.905 109.1 47.1 -63.0 -42.2 41.1 -17.1 -45.8 89 89 A I H >< S+ 0 0 0 -4,-2.0 3,-1.3 1,-0.2 7,-0.4 0.960 111.8 50.4 -62.1 -47.3 43.0 -18.1 -42.7 90 90 A L H 3< S+ 0 0 65 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.765 111.6 47.4 -68.0 -22.4 46.4 -17.6 -44.3 91 91 A R H 3< S+ 0 0 189 -4,-1.7 2,-0.5 -5,-0.2 -1,-0.3 0.528 94.3 92.5 -94.3 -3.4 45.5 -14.1 -45.5 92 92 A N S+ 0 0 120 2,-0.1 4,-0.7 3,-0.1 -1,-0.2 0.830 119.6 40.7 -92.4 -35.3 44.6 -12.6 -36.7 95 95 A L H > S+ 0 0 0 -7,-0.2 4,-2.9 2,-0.1 5,-0.2 0.856 103.4 64.6 -81.7 -36.9 44.0 -16.2 -37.9 96 96 A K H X S+ 0 0 86 -4,-2.7 4,-2.9 -7,-0.4 5,-0.2 0.930 101.8 48.2 -58.1 -47.9 47.3 -17.0 -39.5 97 97 A P H > S+ 0 0 55 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.888 113.8 47.6 -62.4 -33.0 49.5 -16.8 -36.4 98 98 A V H >X S+ 0 0 4 -4,-0.7 4,-0.9 2,-0.2 3,-0.5 0.959 112.7 48.9 -68.3 -49.4 47.0 -19.0 -34.5 99 99 A Y H >< S+ 0 0 39 -4,-2.9 3,-1.1 1,-0.3 -1,-0.2 0.931 110.1 51.6 -54.6 -44.8 46.9 -21.5 -37.3 100 100 A D H 3< S+ 0 0 73 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.796 107.1 54.5 -65.0 -28.0 50.7 -21.6 -37.6 101 101 A S H << S+ 0 0 32 -4,-1.2 -1,-0.3 -3,-0.5 -2,-0.2 0.668 97.0 87.3 -78.0 -17.4 50.9 -22.3 -33.8 102 102 A L S << S- 0 0 6 -3,-1.1 2,-0.1 -4,-0.9 31,-0.0 -0.474 75.4-120.1 -88.9 156.1 48.6 -25.3 -34.0 103 103 A D > - 0 0 55 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.343 45.3 -91.0 -78.8 170.1 49.2 -29.0 -34.6 104 104 A A H > S+ 0 0 78 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.822 123.2 48.6 -56.7 -42.3 47.5 -30.7 -37.6 105 105 A V H > S+ 0 0 24 62,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.922 114.3 45.7 -68.7 -43.5 44.3 -31.9 -35.8 106 106 A R H > S+ 0 0 24 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.844 106.7 59.3 -69.6 -30.5 43.7 -28.5 -34.2 107 107 A R H X S+ 0 0 80 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.907 104.6 51.8 -60.6 -39.6 44.4 -26.8 -37.6 108 108 A A H X S+ 0 0 5 -4,-1.6 4,-2.3 1,-0.2 -2,-0.2 0.886 105.9 54.0 -64.6 -39.5 41.5 -28.8 -39.0 109 109 A A H X S+ 0 0 0 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.904 110.0 46.9 -61.6 -40.3 39.2 -27.6 -36.2 110 110 A L H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.918 110.8 51.2 -68.9 -39.9 40.1 -24.0 -37.0 111 111 A I H X S+ 0 0 8 -4,-2.4 4,-2.8 1,-0.2 -1,-0.2 0.894 107.5 55.6 -61.7 -37.6 39.4 -24.6 -40.8 112 112 A N H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.935 108.1 47.2 -60.4 -46.3 36.1 -26.1 -39.8 113 113 A M H X S+ 0 0 3 -4,-1.9 4,-3.0 1,-0.2 5,-0.3 0.898 113.4 47.7 -60.8 -43.7 35.1 -23.0 -37.9 114 114 A V H X S+ 0 0 6 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.903 109.3 53.5 -67.0 -38.8 36.1 -20.8 -40.8 115 115 A F H < S+ 0 0 27 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.907 116.1 40.2 -59.8 -42.8 34.3 -22.9 -43.3 116 116 A Q H < S+ 0 0 53 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.934 134.0 16.5 -73.4 -46.1 31.1 -22.6 -41.2 117 117 A M H < S- 0 0 59 -4,-3.0 4,-0.5 -5,-0.2 -3,-0.2 0.491 103.9-117.3-110.9 -4.7 31.3 -18.9 -40.2 118 118 A G X - 0 0 31 -4,-2.6 4,-2.1 -5,-0.3 5,-0.2 0.149 33.9 -73.2 83.7 160.1 33.8 -17.3 -42.5 119 119 A E H > S+ 0 0 37 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.895 127.1 48.2 -52.8 -55.2 37.1 -15.6 -42.0 120 120 A T H > S+ 0 0 119 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.890 110.8 52.1 -59.7 -41.9 35.8 -12.3 -40.5 121 121 A G H >4 S+ 0 0 33 -4,-0.5 3,-0.7 1,-0.2 -1,-0.2 0.944 113.6 40.2 -61.9 -51.9 33.6 -14.1 -38.1 122 122 A V H >< S+ 0 0 1 -4,-2.1 3,-2.2 1,-0.2 -1,-0.2 0.872 108.2 62.1 -67.4 -34.5 36.2 -16.4 -36.6 123 123 A A H 3< S+ 0 0 7 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.718 96.4 63.1 -63.3 -21.5 38.8 -13.7 -36.6 124 124 A G T << S+ 0 0 49 -4,-0.9 2,-1.8 -3,-0.7 -1,-0.3 0.499 74.0 91.7 -80.2 -4.8 36.6 -11.8 -34.2 125 125 A F <> + 0 0 48 -3,-2.2 4,-2.4 1,-0.2 5,-0.2 -0.370 53.8 161.9 -85.4 62.9 36.8 -14.5 -31.5 126 126 A T H > + 0 0 76 -2,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.852 65.0 46.2 -55.4 -45.4 39.7 -12.6 -30.0 127 127 A N H > S+ 0 0 86 -3,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.945 114.0 46.6 -68.5 -43.6 39.8 -14.2 -26.5 128 128 A S H > S+ 0 0 4 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.885 111.2 53.1 -63.3 -39.9 39.4 -17.8 -27.7 129 129 A L H X S+ 0 0 13 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.891 108.0 51.1 -62.5 -41.5 42.2 -17.2 -30.3 130 130 A R H X S+ 0 0 109 -4,-2.0 4,-1.9 -5,-0.2 -1,-0.2 0.934 110.7 48.2 -61.9 -46.5 44.5 -15.9 -27.7 131 131 A M H <>S+ 0 0 26 -4,-2.1 5,-2.4 1,-0.2 4,-0.3 0.899 111.6 50.0 -59.8 -42.5 43.9 -18.9 -25.5 132 132 A L H ><5S+ 0 0 2 -4,-2.5 3,-1.7 1,-0.2 -2,-0.2 0.934 109.0 50.9 -60.0 -46.3 44.4 -21.3 -28.4 133 133 A Q H 3<5S+ 0 0 86 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.818 111.6 49.4 -61.3 -31.6 47.7 -19.6 -29.3 134 134 A Q T 3<5S- 0 0 95 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.418 111.9-122.4 -85.8 -0.2 48.7 -20.0 -25.6 135 135 A K T < 5 + 0 0 105 -3,-1.7 2,-1.7 -4,-0.3 3,-0.2 0.753 62.5 146.9 61.0 29.4 47.8 -23.7 -25.7 136 136 A R >< + 0 0 135 -5,-2.4 4,-2.7 1,-0.2 5,-0.2 -0.591 20.3 170.7 -91.3 74.9 45.3 -23.1 -22.8 137 137 A W H > + 0 0 45 -2,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.874 67.7 45.6 -61.7 -48.3 43.0 -25.8 -24.2 138 138 A D H > S+ 0 0 102 2,-0.2 4,-2.1 -3,-0.2 -1,-0.2 0.894 115.0 48.5 -65.0 -38.5 40.5 -26.2 -21.5 139 139 A E H > S+ 0 0 111 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.927 111.6 50.2 -63.9 -44.9 40.2 -22.5 -21.0 140 140 A A H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.914 109.6 52.1 -59.0 -44.1 39.7 -22.1 -24.8 141 141 A A H X S+ 0 0 1 -4,-2.5 4,-1.2 1,-0.2 -1,-0.2 0.897 110.4 46.6 -60.4 -44.4 37.1 -24.8 -24.8 142 142 A V H < S+ 0 0 78 -4,-2.1 4,-0.4 1,-0.2 -1,-0.2 0.911 114.9 48.0 -64.7 -40.3 35.1 -23.1 -22.0 143 143 A N H >< S+ 0 0 39 -4,-2.5 3,-1.4 1,-0.2 -2,-0.2 0.898 106.1 56.1 -68.5 -41.1 35.4 -19.8 -23.8 144 144 A L H 3< S+ 0 0 3 -4,-2.7 6,-0.4 1,-0.3 -1,-0.2 0.792 100.8 59.9 -61.9 -29.9 34.3 -21.1 -27.2 145 145 A A T 3< S+ 0 0 30 -4,-1.2 2,-1.7 1,-0.2 -1,-0.3 0.656 85.1 79.5 -74.3 -15.0 31.1 -22.4 -25.7 146 146 A K S < S+ 0 0 159 -3,-1.4 2,-0.3 -4,-0.4 -1,-0.2 -0.518 82.6 98.6 -91.0 68.5 30.0 -18.9 -24.6 147 147 A S S > S- 0 0 18 -2,-1.7 4,-2.3 1,-0.1 5,-0.2 -0.997 84.2-120.1-153.2 153.8 28.8 -18.1 -28.1 148 148 A R H > S+ 0 0 145 -2,-0.3 4,-2.8 1,-0.2 5,-0.3 0.893 115.2 62.8 -60.7 -37.3 25.9 -17.9 -30.5 149 149 A W H > S+ 0 0 16 1,-0.2 4,-2.2 2,-0.2 8,-0.2 0.958 107.0 40.3 -49.5 -55.7 27.8 -20.4 -32.5 150 150 A Y H 4 S+ 0 0 55 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.907 114.9 51.4 -64.6 -42.5 27.6 -23.0 -29.8 151 151 A N H < S+ 0 0 115 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.881 114.6 43.5 -65.4 -33.4 24.0 -22.2 -28.8 152 152 A Q H < S+ 0 0 77 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.834 132.1 18.2 -80.5 -34.9 22.8 -22.5 -32.4 153 153 A T S X S+ 0 0 30 -4,-2.2 4,-2.7 -5,-0.3 -1,-0.2 -0.564 75.6 161.8-134.4 70.4 24.7 -25.7 -33.4 154 154 A P H > S+ 0 0 47 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.846 70.0 50.8 -64.1 -40.1 25.7 -27.3 -30.1 155 155 A N H > S+ 0 0 107 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.930 115.7 42.4 -66.9 -40.9 26.4 -30.8 -31.2 156 156 A R H > S+ 0 0 20 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.933 115.2 50.0 -68.4 -42.9 28.7 -29.6 -34.0 157 157 A A H X S+ 0 0 0 -4,-2.7 4,-3.2 1,-0.2 5,-0.2 0.894 107.8 55.0 -64.2 -37.5 30.4 -27.0 -31.8 158 158 A K H X S+ 0 0 99 -4,-2.5 4,-2.7 -5,-0.2 -1,-0.2 0.908 108.0 48.6 -61.7 -40.7 30.9 -29.6 -29.1 159 159 A R H X S+ 0 0 52 -4,-1.7 4,-1.7 2,-0.2 12,-0.2 0.929 114.3 45.2 -63.2 -44.7 32.8 -31.8 -31.6 160 160 A V H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.938 114.7 48.6 -64.8 -46.5 34.9 -28.9 -32.8 161 161 A I H X S+ 0 0 7 -4,-3.2 4,-2.4 1,-0.2 -2,-0.2 0.902 109.3 51.9 -61.0 -41.0 35.6 -27.8 -29.2 162 162 A T H X S+ 0 0 52 -4,-2.7 4,-2.8 1,-0.2 6,-0.4 0.862 107.1 55.1 -63.1 -35.1 36.5 -31.3 -28.1 163 163 A T H X S+ 0 0 0 -4,-1.7 4,-2.4 1,-0.2 5,-0.3 0.916 110.6 43.8 -63.7 -42.8 39.0 -31.4 -31.0 164 164 A F H < S+ 0 0 0 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.867 114.2 52.2 -68.5 -35.2 40.7 -28.2 -29.7 165 165 A R H < S+ 0 0 114 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.939 125.2 21.4 -67.7 -42.1 40.6 -29.6 -26.2 166 166 A T H < S- 0 0 63 -4,-2.8 -2,-0.2 2,-0.2 -3,-0.2 0.680 85.8-134.1-102.7 -22.2 42.2 -32.9 -26.9 167 167 A G S < S+ 0 0 17 -4,-2.4 2,-0.3 -5,-0.3 -62,-0.2 0.741 74.7 104.1 71.1 19.1 44.1 -32.5 -30.2 168 168 A T S S- 0 0 50 -6,-0.4 3,-0.3 -5,-0.3 -1,-0.3 -0.801 80.7-120.5-126.9 170.6 42.6 -35.8 -31.2 169 169 A W S > S+ 0 0 50 -2,-0.3 3,-2.3 1,-0.2 4,-0.5 0.192 71.1 121.3 -95.2 16.5 39.8 -37.0 -33.6 170 170 A D G > + 0 0 113 1,-0.3 3,-1.1 2,-0.2 -1,-0.2 0.796 67.6 58.2 -51.9 -35.7 37.8 -38.7 -30.8 171 171 A A G 3 S+ 0 0 23 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.687 109.1 46.1 -71.5 -14.0 34.7 -36.6 -31.3 172 172 A Y G X S+ 0 0 2 -3,-2.3 3,-0.7 -13,-0.1 2,-0.4 0.380 86.1 109.5-107.3 3.3 34.5 -37.9 -34.9 173 173 A K T < S+ 0 0 91 -3,-1.1 -3,-0.0 -4,-0.5 0, 0.0 -0.659 84.6 18.2 -82.7 131.4 35.1 -41.5 -34.2 174 174 A N T 3 0 0 168 -2,-0.4 -1,-0.3 1,-0.3 -4,-0.0 0.902 360.0 360.0 74.3 43.8 32.1 -43.7 -34.7 175 175 A L < 0 0 117 -3,-0.7 -1,-0.3 0, 0.0 -166,-0.1 -0.998 360.0 360.0-135.5 360.0 30.4 -41.0 -36.8