==== 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 HYDROLASE 22-JUL-09 3IEH . COMPND 2 MOLECULE: PUTATIVE METALLOPEPTIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SHEWANELLA BALTICA OS155; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 268 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10975.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 185 69.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 9.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 30 11.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.5 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 . 15 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 72 26.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.5 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 1 1 2 0 0 2 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 1 0 2 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 PARALLEL BRIDGES PER LADDER . 1 3 1 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 3 0 0 0 0 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 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 4 A R 0 0 91 0, 0.0 169,-0.0 0, 0.0 168,-0.0 0.000 360.0 360.0 360.0 144.3 0.3 50.2 7.7 2 5 A S > - 0 0 69 1,-0.2 3,-1.7 2,-0.1 113,-0.2 -0.327 360.0-136.5 -59.9 131.1 -0.1 48.9 11.4 3 6 A P T 3 S+ 0 0 38 0, 0.0 113,-2.1 0, 0.0 -1,-0.2 0.374 106.8 51.9 -68.6 0.3 3.1 47.1 12.7 4 7 A F T 3 S+ 0 0 101 111,-0.1 2,-0.3 110,-0.1 -2,-0.1 0.310 79.1 120.1-110.8 1.4 0.7 44.5 14.2 5 8 A E < - 0 0 102 -3,-1.7 2,-0.5 1,-0.1 110,-0.4 -0.535 63.5-129.7 -67.4 135.2 -1.3 43.9 11.0 6 9 A S - 0 0 75 -2,-0.3 2,-0.4 108,-0.1 108,-0.2 -0.740 23.1-170.8 -98.1 127.6 -0.9 40.2 10.1 7 10 A F + 0 0 44 106,-2.6 2,-0.4 -2,-0.5 69,-0.1 -0.971 8.7 173.0-119.4 130.8 0.2 39.1 6.6 8 11 A Q - 0 0 106 -2,-0.4 2,-0.3 10,-0.1 66,-0.0 -1.000 5.2-176.9-141.7 136.9 0.1 35.5 5.5 9 12 A W - 0 0 50 -2,-0.4 9,-2.4 239,-0.0 2,-0.4 -0.912 26.2-120.9-129.9 155.6 0.7 33.8 2.1 10 13 A K E -A 17 0A 157 -2,-0.3 2,-0.5 7,-0.2 240,-0.3 -0.840 24.4-159.8 -95.6 135.0 0.5 30.3 0.8 11 14 A S E >> -A 16 0A 5 5,-2.7 5,-1.3 -2,-0.4 4,-0.7 -0.972 15.1-172.9-111.0 123.2 3.7 28.9 -0.7 12 15 A D T 45S+ 0 0 134 -2,-0.5 -1,-0.1 3,-0.2 5,-0.0 0.693 86.6 67.4 -88.0 -12.4 3.5 26.0 -3.1 13 16 A I T 45S+ 0 0 68 1,-0.2 -1,-0.2 3,-0.1 -2,-0.0 0.939 121.3 18.3 -63.6 -45.1 7.3 25.8 -3.0 14 17 A F T 45S- 0 0 37 2,-0.2 -2,-0.2 0, 0.0 -1,-0.2 0.439 101.7-132.0-103.7 -4.2 7.1 24.7 0.6 15 18 A N T <5S+ 0 0 144 -4,-0.7 2,-0.3 1,-0.2 -3,-0.2 0.899 72.4 85.6 54.1 46.5 3.4 23.7 0.5 16 19 A C E -A 10 0A 59 -2,-0.3 3,-1.7 -7,-0.2 -7,-0.2 -0.627 39.1-123.6 -82.1 147.0 1.6 29.0 5.2 18 21 A S T 3 S+ 0 0 0 -9,-2.4 -1,-0.1 1,-0.3 -8,-0.1 0.754 112.0 54.0 -62.4 -24.1 4.3 31.7 5.4 19 22 A T T 3 S+ 0 0 20 -10,-0.2 2,-2.6 1,-0.1 -1,-0.3 0.425 72.4 118.1 -90.4 -1.7 3.7 32.0 9.2 20 23 A D <> + 0 0 56 -3,-1.7 4,-2.3 1,-0.2 3,-0.2 -0.387 33.3 167.4 -68.3 76.5 4.2 28.2 9.8 21 24 A I H > + 0 0 6 -2,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.766 69.4 59.8 -65.9 -28.3 7.2 28.7 12.0 22 25 A D H > S+ 0 0 118 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.947 110.3 41.2 -64.7 -49.6 7.1 25.0 13.2 23 26 A N H > S+ 0 0 39 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.903 111.4 58.9 -63.5 -39.2 7.6 23.8 9.7 24 27 A F H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.947 109.4 42.4 -53.8 -52.5 10.1 26.6 9.1 25 28 A Y H X S+ 0 0 48 -4,-2.5 4,-3.1 2,-0.2 -1,-0.2 0.812 108.9 57.9 -66.8 -35.4 12.3 25.3 11.9 26 29 A L H X S+ 0 0 109 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.935 114.0 39.0 -58.3 -48.7 12.0 21.6 11.0 27 30 A L H X S+ 0 0 57 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.849 114.8 54.7 -70.9 -34.8 13.4 22.4 7.5 28 31 A L H X S+ 0 0 2 -4,-2.2 4,-2.6 -5,-0.3 5,-0.2 0.966 109.2 46.7 -63.5 -51.7 15.9 24.8 9.0 29 32 A E H X S+ 0 0 62 -4,-3.1 4,-2.7 2,-0.2 5,-0.3 0.932 112.1 51.4 -52.7 -48.6 17.2 22.2 11.3 30 33 A Q H X S+ 0 0 70 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.931 113.5 43.7 -60.5 -44.8 17.4 19.6 8.5 31 34 A E H X S+ 0 0 37 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.884 114.9 48.8 -66.6 -38.6 19.3 21.9 6.2 32 35 A X H X>S+ 0 0 5 -4,-2.6 5,-2.0 -5,-0.2 4,-0.8 0.858 113.5 46.8 -67.0 -40.4 21.7 23.1 9.0 33 36 A T H <5S+ 0 0 116 -4,-2.7 3,-0.3 -5,-0.2 -2,-0.2 0.872 112.2 50.0 -71.0 -39.8 22.4 19.5 10.1 34 37 A R H <5S+ 0 0 118 -4,-2.3 -2,-0.2 -5,-0.3 -1,-0.2 0.843 113.3 47.2 -66.1 -35.3 23.0 18.4 6.5 35 38 A L H <5S- 0 0 6 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.636 108.2-123.0 -83.4 -13.4 25.4 21.3 6.0 36 39 A G T <5 + 0 0 41 -4,-0.8 -3,-0.2 -3,-0.3 2,-0.1 0.726 51.4 164.8 79.5 21.2 27.4 20.8 9.2 37 40 A X < - 0 0 19 -5,-2.0 2,-0.4 -6,-0.2 18,-0.2 -0.449 33.1-129.0 -77.3 144.7 26.7 24.3 10.5 38 41 A V E -B 54 0B 69 16,-3.4 16,-3.0 -2,-0.1 2,-0.4 -0.763 15.5-135.9 -97.7 135.4 27.3 25.2 14.1 39 42 A E E -B 53 0B 82 -2,-0.4 2,-0.5 14,-0.2 14,-0.2 -0.773 16.1-172.9 -90.3 132.7 24.6 26.8 16.2 40 43 A K E -B 52 0B 91 12,-2.9 12,-2.8 -2,-0.4 2,-0.3 -0.900 17.3-148.8-124.4 98.7 25.5 29.7 18.4 41 44 A N E -B 51 0B 86 -2,-0.5 10,-0.2 10,-0.3 3,-0.1 -0.541 14.5-174.2 -66.2 125.4 22.4 30.6 20.5 42 45 A L E - 0 0 11 8,-2.6 2,-0.3 1,-0.4 9,-0.2 0.671 57.3 -75.0 -93.4 -22.1 22.4 34.3 21.3 43 46 A G E -B 50 0B 15 7,-0.8 7,-2.7 2,-0.0 -1,-0.4 -0.977 51.3 -76.8 156.5-163.3 19.3 34.1 23.6 44 47 A E E -B 49 0B 79 -2,-0.3 2,-0.3 5,-0.3 5,-0.2 -0.904 20.3-168.4-131.2 157.5 15.6 33.7 23.6 45 48 A V E > S-B 48 0B 3 3,-2.4 3,-2.0 -2,-0.3 63,-0.1 -0.932 81.0 -18.9-146.9 119.3 12.5 35.8 22.9 46 49 A G T 3 S- 0 0 16 -2,-0.3 3,-0.1 1,-0.3 72,-0.0 0.886 129.0 -48.3 47.3 47.7 9.0 34.5 23.8 47 50 A K T 3 S+ 0 0 165 1,-0.2 2,-0.4 0, 0.0 -1,-0.3 0.428 116.7 109.5 81.8 -6.5 10.2 30.8 24.0 48 51 A Y E < -B 45 0B 31 -3,-2.0 -3,-2.4 2,-0.0 -1,-0.2 -0.855 66.3-128.9-104.8 140.8 12.1 30.9 20.6 49 52 A K E -B 44 0B 82 -2,-0.4 2,-0.6 -5,-0.2 -5,-0.3 -0.581 9.5-147.6 -81.8 146.1 15.8 30.9 20.4 50 53 A V E +B 43 0B 1 -7,-2.7 -8,-2.6 -2,-0.2 -7,-0.8 -0.960 32.9 179.2-110.9 107.9 17.5 33.5 18.3 51 54 A S E -B 41 0B 9 -2,-0.6 2,-0.5 -10,-0.2 53,-0.3 -0.850 31.9-142.0-122.1 147.0 20.6 31.8 17.0 52 55 A L E -B 40 0B 0 -12,-2.8 -12,-2.9 -2,-0.3 2,-0.4 -0.907 22.4-153.4 -98.4 127.9 23.5 32.5 14.7 53 56 A Y E -BC 39 101B 23 48,-3.0 48,-3.0 -2,-0.5 2,-0.4 -0.894 14.7-172.0-106.4 138.4 24.5 29.6 12.5 54 57 A Q E -BC 38 100B 36 -16,-3.0 -16,-3.4 -2,-0.4 46,-0.2 -0.968 28.2-114.8-134.3 143.1 28.1 29.3 11.3 55 58 A S - 0 0 12 44,-2.4 3,-0.3 -2,-0.4 2,-0.2 -0.503 47.5-110.0 -68.5 140.0 30.0 27.1 8.9 56 59 A P S S+ 0 0 57 0, 0.0 -1,-0.1 0, 0.0 43,-0.1 -0.474 87.6 16.7 -79.8 145.7 32.6 25.0 10.8 57 60 A A S S- 0 0 89 -2,-0.2 2,-0.0 1,-0.1 -2,-0.0 0.980 80.2-151.6 62.9 62.0 36.4 25.6 10.7 58 61 A A - 0 0 71 -3,-0.3 2,-0.4 1,-0.1 -1,-0.1 -0.356 3.9-145.4 -61.5 140.0 36.5 29.0 9.2 59 62 A K > - 0 0 68 4,-0.1 3,-1.6 1,-0.1 39,-0.1 -0.917 11.2-139.6-113.6 137.5 39.6 29.8 7.2 60 63 A S T 3 S+ 0 0 131 -2,-0.4 -1,-0.1 1,-0.3 4,-0.1 0.764 100.0 66.9 -70.7 -21.1 41.2 33.3 7.2 61 64 A G T 3 S+ 0 0 74 2,-0.1 -1,-0.3 36,-0.0 -3,-0.0 0.655 95.6 70.5 -70.1 -13.4 41.9 33.0 3.4 62 65 A L S < S- 0 0 34 -3,-1.6 2,-0.2 32,-0.1 35,-0.2 -0.704 92.4-103.8-103.9 155.6 38.1 33.1 2.8 63 66 A P - 0 0 25 0, 0.0 35,-2.5 0, 0.0 2,-0.6 -0.507 26.3-133.3 -75.4 147.2 35.7 36.0 3.2 64 67 A S E +d 98 0B 29 33,-0.2 96,-2.0 -2,-0.2 97,-0.5 -0.930 32.8 179.5-106.4 116.0 33.4 36.0 6.3 65 68 A L E -de 99 161B 0 33,-1.9 35,-2.5 -2,-0.6 2,-0.4 -0.944 16.1-156.8-125.3 139.3 29.9 36.9 5.2 66 69 A L E -de 100 162B 0 95,-1.8 97,-2.7 -2,-0.4 2,-0.5 -0.968 4.7-171.2-120.5 127.3 26.7 37.2 7.1 67 70 A I E -de 101 163B 0 33,-1.8 35,-2.4 -2,-0.4 2,-0.4 -0.985 12.4-177.8-116.1 128.6 23.1 36.8 5.7 68 71 A S E +de 102 164B 0 95,-2.2 97,-2.6 -2,-0.5 2,-0.3 -0.941 4.5 170.6-127.0 148.9 20.3 37.8 8.1 69 72 A A E + e 0 165B 0 33,-2.3 36,-1.6 -2,-0.4 37,-0.1 -0.939 47.5 46.5-147.2 162.8 16.5 37.6 7.5 70 73 A G + 0 0 2 95,-0.8 36,-2.2 5,-0.4 40,-0.2 0.760 49.9 137.1 74.5 29.7 13.3 38.0 9.4 71 74 A F S S+ 0 0 0 34,-0.2 2,-0.5 94,-0.2 53,-0.2 0.814 79.2 46.6 -66.1 -32.9 13.8 41.2 11.4 72 75 A H S > S- 0 0 6 3,-0.2 3,-1.9 51,-0.1 43,-0.2 -0.971 81.5-145.2-118.3 124.3 10.3 42.0 10.4 73 76 A G T 3 S+ 0 0 0 42,-1.0 42,-0.3 41,-0.9 40,-0.2 0.619 96.2 55.1 -66.5 -21.4 7.6 39.3 10.8 74 77 A E T 3 S+ 0 0 4 1,-0.2 2,-0.9 93,-0.1 -1,-0.3 0.519 90.9 76.8 -84.9 -7.4 5.6 40.2 7.7 75 78 A E X + 0 0 3 -3,-1.9 3,-1.2 1,-0.2 -5,-0.4 -0.430 56.8 148.1-101.4 57.4 8.6 40.0 5.4 76 79 A S T 3> + 0 0 2 -2,-0.9 4,-2.2 1,-0.3 5,-0.3 0.633 52.0 76.4 -77.5 -16.8 8.5 36.2 5.5 77 80 A A H 3> S+ 0 0 0 -3,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.791 90.1 63.7 -63.7 -24.8 9.9 35.6 1.9 78 81 A G H <> S+ 0 0 0 -3,-1.2 4,-1.9 2,-0.2 -2,-0.2 0.994 108.4 35.4 -57.8 -66.5 13.3 36.5 3.5 79 82 A P H > S+ 0 0 0 0, 0.0 4,-1.9 0, 0.0 -2,-0.2 0.915 122.4 45.7 -52.3 -50.7 13.5 33.5 5.9 80 83 A W H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.861 110.2 55.9 -65.7 -34.0 11.8 31.1 3.4 81 84 A G H X S+ 0 0 0 -4,-2.1 4,-2.3 -5,-0.3 -1,-0.2 0.874 105.4 51.8 -60.0 -38.5 14.0 32.5 0.7 82 85 A L H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.893 108.3 50.8 -66.1 -40.1 17.0 31.5 2.9 83 86 A L H X S+ 0 0 2 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.908 109.6 50.8 -63.1 -42.7 15.6 27.9 3.3 84 87 A H H X S+ 0 0 24 -4,-2.3 4,-1.3 1,-0.2 -2,-0.2 0.953 110.7 48.7 -58.3 -50.1 15.2 27.7 -0.5 85 88 A F H < S+ 0 0 13 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.868 111.9 48.4 -56.3 -42.9 18.8 28.8 -1.0 86 89 A L H >< S+ 0 0 2 -4,-2.3 3,-2.1 1,-0.2 -1,-0.2 0.864 103.3 60.3 -69.2 -37.1 20.1 26.3 1.6 87 90 A S H 3< S+ 0 0 59 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.841 107.8 47.5 -60.1 -30.8 18.1 23.4 0.0 88 91 A E T 3< S+ 0 0 138 -4,-1.3 -1,-0.3 -3,-0.2 2,-0.3 0.364 101.7 90.3 -90.7 6.7 20.1 24.1 -3.1 89 92 A A < - 0 0 16 -3,-2.1 2,-0.3 3,-0.0 -3,-0.0 -0.710 54.6-159.5-107.4 154.8 23.5 24.3 -1.3 90 93 A S > - 0 0 63 -2,-0.3 3,-2.5 -55,-0.0 4,-0.3 -0.829 40.3-104.1-121.0 163.9 26.2 21.7 -0.4 91 94 A A G > S+ 0 0 53 1,-0.3 3,-1.6 -2,-0.3 4,-0.2 0.721 113.4 82.0 -59.9 -17.8 29.0 21.8 2.2 92 95 A D G > S+ 0 0 67 1,-0.3 3,-1.8 2,-0.2 4,-0.4 0.807 76.4 72.5 -54.1 -28.5 31.2 22.5 -0.8 93 96 A L G X> S+ 0 0 32 -3,-2.5 3,-1.9 1,-0.3 4,-1.5 0.871 85.8 64.2 -53.6 -36.1 30.0 26.1 -0.3 94 97 A F G <4 S+ 0 0 14 -3,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.454 90.4 64.0 -75.2 -0.8 32.2 26.4 2.8 95 98 A E G <4 S+ 0 0 131 -3,-1.8 -1,-0.3 -4,-0.2 -2,-0.2 0.616 109.8 39.4 -88.9 -16.0 35.3 26.0 0.7 96 99 A R T <4 S+ 0 0 123 -3,-1.9 2,-0.3 -4,-0.4 -2,-0.2 0.729 127.8 13.6 -99.3 -31.1 34.5 29.3 -1.0 97 100 A V < - 0 0 0 -4,-1.5 2,-0.9 -35,-0.2 -1,-0.3 -0.980 61.2-126.6-146.4 152.9 33.2 31.3 2.0 98 101 A N E - d 0 64B 8 -35,-2.5 -33,-1.9 -2,-0.3 2,-0.4 -0.893 46.1-162.4 -96.8 96.0 33.0 31.3 5.8 99 102 A L E - d 0 65B 0 -2,-0.9 -44,-2.4 -35,-0.2 2,-0.4 -0.722 17.2-177.2 -94.2 133.5 29.1 31.7 6.0 100 103 A S E -Cd 54 66B 5 -35,-2.5 -33,-1.8 -2,-0.4 2,-0.4 -0.935 11.4-160.3-121.7 143.3 27.2 32.9 9.1 101 104 A L E -Cd 53 67B 0 -48,-3.0 -48,-3.0 -2,-0.4 -33,-0.2 -0.979 27.3-172.4-130.5 142.6 23.4 33.1 9.2 102 105 A L E + d 0 68B 1 -35,-2.4 -33,-2.3 -2,-0.4 3,-0.3 -0.826 23.3 176.2-119.6 83.9 20.8 34.8 11.2 103 106 A P + 0 0 4 0, 0.0 2,-0.2 0, 0.0 -21,-0.2 0.768 68.5 10.2 -69.1 -25.4 17.8 33.0 9.6 104 107 A L + 0 0 10 -53,-0.3 -34,-0.2 -3,-0.1 -53,-0.2 -0.709 57.6 171.6-158.9 94.0 15.0 34.5 11.7 105 108 A V S S+ 0 0 0 -36,-1.6 -34,-0.2 -3,-0.3 -35,-0.1 0.818 81.1 41.1 -74.0 -30.0 15.7 37.4 14.1 106 109 A N > + 0 0 0 -36,-2.2 4,-2.2 1,-0.2 -1,-0.2 -0.658 61.5 159.8-124.9 70.7 12.0 38.0 15.0 107 110 A P H > S+ 0 0 0 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.846 73.9 57.3 -63.9 -34.8 10.2 34.7 15.5 108 111 A T H > S+ 0 0 1 2,-0.2 4,-0.8 1,-0.2 6,-0.2 0.915 112.1 41.4 -66.9 -38.6 7.4 36.1 17.6 109 112 A G H >>S+ 0 0 0 1,-0.2 5,-2.5 2,-0.2 4,-1.1 0.915 112.6 56.3 -69.5 -41.1 6.4 38.5 14.8 110 113 A F H <5S+ 0 0 1 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.810 105.4 48.9 -59.8 -39.6 7.0 35.8 12.1 111 114 A S H <5S+ 0 0 35 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.740 117.8 43.1 -74.8 -23.3 4.5 33.3 13.7 112 115 A R H <5S- 0 0 94 -4,-0.8 -2,-0.2 -3,-0.3 -1,-0.2 0.578 109.3-125.7 -92.6 -11.7 2.0 36.2 13.9 113 116 A G T <5 + 0 0 0 -4,-1.1 -106,-2.6 1,-0.2 2,-0.3 0.730 68.2 123.8 72.8 21.5 2.8 37.5 10.4 114 117 A H < - 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0 0 54 0, 0.0 -27,-3.1 0, 0.0 2,-0.2 -0.485 53.0-116.4 -66.8 155.2 9.8 45.9 -11.6 202 205 A I B -k 174 0D 32 -29,-0.3 2,-1.8 -2,-0.1 -27,-0.2 -0.634 17.8-108.0 -97.7 149.0 12.3 48.3 -10.0 203 206 A A - 0 0 5 -29,-2.6 13,-2.9 -2,-0.2 14,-0.2 -0.568 40.6-177.4 -73.7 86.4 11.7 51.3 -7.7 204 207 A V - 0 0 76 -2,-1.8 11,-2.9 11,-0.3 2,-0.3 0.868 60.6 -21.8 -58.1 -37.1 12.7 53.7 -10.5 205 208 A D S S+ 0 0 118 9,-0.2 2,-0.3 -3,-0.2 9,-0.2 -0.922 82.9 94.0-159.7-179.9 12.2 56.7 -8.2 206 209 A G - 0 0 44 7,-0.4 7,-1.7 -2,-0.3 2,-0.3 -0.830 64.8 -85.6 123.9-163.5 10.5 58.0 -5.0 207 210 A E E -L 212 0E 130 -2,-0.3 2,-0.6 5,-0.3 3,-0.1 -0.982 16.8-152.9-142.5 137.3 11.7 58.1 -1.5 208 211 A I E > S-L 211 0E 41 3,-3.1 3,-1.5 -2,-0.3 2,-0.1 -0.981 85.0 -29.7-104.2 115.9 11.6 55.5 1.2 209 212 A D T 3 S- 0 0 116 -2,-0.6 0, 0.0 1,-0.3 0, 0.0 -0.464 128.8 -33.0 67.1-142.9 11.6 57.7 4.4 210 213 A A T 3 S+ 0 0 88 -2,-0.1 -1,-0.3 -3,-0.1 0, 0.0 0.293 121.5 112.4 -84.6 14.8 13.4 60.9 3.7 211 214 A C E < -L 208 0E 9 -3,-1.5 -3,-3.1 10,-0.0 2,-0.2 -0.779 63.5-141.5 -97.1 114.9 15.5 58.7 1.4 212 215 A P E -L 207 0E 93 0, 0.0 2,-0.4 0, 0.0 -5,-0.3 -0.445 10.4-155.2 -72.2 136.3 15.5 59.0 -2.4 213 216 A V - 0 0 6 -7,-1.7 -7,-0.4 -2,-0.2 2,-0.4 -0.918 9.7-170.8-104.5 135.6 15.6 55.8 -4.4 214 217 A K B > S-I 217 0B 145 3,-2.1 3,-1.5 -2,-0.4 -9,-0.2 -0.978 70.5 -18.0-129.8 120.6 17.0 56.1 -7.9 215 218 A D T 3 S- 0 0 66 -11,-2.9 -11,-0.3 -2,-0.4 -10,-0.1 0.859 128.7 -50.3 53.5 42.8 16.7 53.1 -10.3 216 219 A G T 3 S+ 0 0 0 -13,-2.9 -40,-2.1 1,-0.2 2,-0.4 0.504 115.4 111.9 80.0 8.3 16.1 50.7 -7.4 217 220 A L E < -hI 176 214B 18 -3,-1.5 -3,-2.1 -14,-0.2 2,-0.4 -0.926 41.5-177.6-124.8 134.7 19.1 51.9 -5.4 218 221 A I E -h 177 0B 5 -42,-2.1 -40,-2.8 -2,-0.4 2,-0.5 -0.987 28.4-158.5-121.6 116.3 19.5 53.7 -2.1 219 222 A F E -h 178 0B 48 -2,-0.4 -40,-0.2 -42,-0.2 -42,-0.1 -0.877 55.5 -17.5-111.1 127.6 23.3 54.2 -1.6 220 223 A N S S+ 0 0 50 -42,-2.9 2,-0.7 -2,-0.5 -1,-0.2 0.871 76.9 159.1 50.4 48.1 25.2 54.8 1.6 221 224 A H - 0 0 55 -43,-0.5 2,-0.4 -3,-0.2 -1,-0.2 -0.895 26.1-155.0-100.4 114.1 22.3 55.9 3.7 222 225 A F + 0 0 92 -2,-0.7 2,-0.2 6,-0.1 -43,-0.0 -0.783 26.8 147.9 -98.8 129.7 23.1 55.5 7.4 223 226 A D - 0 0 70 -2,-0.4 -98,-0.0 2,-0.1 0, 0.0 -0.601 63.8 -81.9-134.8-166.0 20.4 55.0 10.0 224 227 A T S S+ 0 0 56 -2,-0.2 -97,-2.7 4,-0.1 2,-0.1 0.017 83.7 128.4 -97.1 26.0 20.2 53.1 13.3 225 228 A S S > S- 0 0 2 -99,-0.2 4,-2.4 -100,-0.2 5,-0.2 -0.397 74.4-109.8 -78.8 159.7 19.5 49.8 11.6 226 229 A F H > S+ 0 0 5 -102,-0.7 4,-2.1 1,-0.2 5,-0.2 0.905 117.6 48.5 -53.9 -48.1 21.4 46.6 12.2 227 230 A E H > S+ 0 0 8 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.937 111.3 47.0 -59.7 -54.7 23.1 46.7 8.7 228 231 A A H > S+ 0 0 1 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.926 113.3 51.3 -58.2 -41.1 24.2 50.4 8.9 229 232 A C H X S+ 0 0 7 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.902 110.2 47.1 -61.8 -44.6 25.6 49.8 12.3 230 233 A L H X>S+ 0 0 10 -4,-2.1 5,-2.8 2,-0.2 4,-0.8 0.861 111.5 51.6 -67.7 -37.1 27.6 46.7 11.2 231 234 A V H ><5S+ 0 0 23 -4,-2.6 3,-1.0 3,-0.2 -2,-0.2 0.949 111.6 46.1 -64.3 -46.6 28.9 48.6 8.2 232 235 A R H 3<5S+ 0 0 134 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.875 110.3 56.5 -60.1 -37.4 30.0 51.5 10.6 233 236 A S H 3<5S- 0 0 19 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.633 139.3 -74.7 -70.4 -14.2 31.5 48.8 12.9 234 237 A G T <<5S+ 0 0 21 -3,-1.0 2,-0.4 -4,-0.8 -3,-0.2 0.440 78.8 145.3 138.7 -2.5 33.6 47.4 10.0 235 238 A A < - 0 0 4 -5,-2.8 -1,-0.3 1,-0.2 -76,-0.2 -0.542 41.2-147.9 -66.2 119.8 31.5 45.5 7.5 236 239 A R S S+ 0 0 142 -77,-2.3 2,-0.3 -2,-0.4 -1,-0.2 0.820 76.1 7.5 -65.7 -37.6 33.2 46.3 4.2 237 240 A V - 0 0 24 -79,-0.3 -75,-1.7 -57,-0.1 2,-0.3 -0.976 69.5-175.5-140.4 151.2 30.1 46.2 2.1 238 241 A G E -fG 162 179B 0 -59,-1.6 -59,-2.5 -2,-0.3 2,-0.3 -0.984 4.9-173.7-144.6 150.7 26.4 45.8 3.1 239 242 A A E -fG 163 178B 0 -77,-1.9 -75,-2.7 -2,-0.3 2,-0.5 -0.980 11.1-164.9-143.9 138.8 23.1 45.4 1.2 240 243 A C E -fG 164 177B 2 -63,-3.1 -63,-2.4 -2,-0.3 -75,-0.2 -0.929 21.8-157.0-119.9 101.6 19.6 45.4 2.5 241 244 A T E -fG 165 176B 0 -77,-1.6 -75,-2.6 -2,-0.5 2,-0.5 -0.531 4.1-158.6 -80.9 145.7 17.4 44.0 -0.3 242 245 A E E -fG 166 175B 17 -67,-3.1 -67,-2.0 -2,-0.2 -75,-0.3 -0.921 5.3-169.2-128.0 101.1 13.7 44.8 -0.4 243 246 A T E -f 167 0B 0 -77,-1.7 -75,-2.4 -2,-0.5 2,-0.7 -0.663 36.1-103.7 -82.4 147.5 11.5 42.5 -2.4 244 247 A P E > -f 168 0B 0 0, 0.0 3,-1.8 0, 0.0 -75,-0.2 -0.631 23.7-159.9 -81.6 118.1 7.9 43.7 -3.0 245 248 A A T 3 S+ 0 0 3 -77,-2.0 -76,-0.2 -2,-0.7 -73,-0.1 0.403 86.0 71.5 -81.1 2.5 5.5 42.0 -0.7 246 249 A L T 3 S+ 0 0 110 -75,-1.6 -1,-0.3 -78,-0.4 2,-0.2 0.461 90.9 78.0 -87.0 -8.0 2.5 42.9 -3.0 247 250 A Q S < S- 0 0 53 -3,-1.8 5,-0.1 -76,-0.3 -47,-0.0 -0.471 104.2 -58.8 -92.7 173.6 3.8 40.4 -5.5 248 251 A N > - 0 0 95 -2,-0.2 4,-1.7 1,-0.1 3,-0.3 -0.228 44.5-133.1 -55.2 130.2 3.5 36.6 -5.5 249 252 A F H > S+ 0 0 5 1,-0.2 4,-2.3 2,-0.2 3,-0.4 0.908 102.5 48.4 -57.7 -49.7 5.0 35.0 -2.4 250 253 A D H > S+ 0 0 13 -240,-0.3 4,-2.5 1,-0.3 -1,-0.2 0.833 108.2 55.7 -64.8 -30.4 7.0 32.2 -4.2 251 254 A Q H > S+ 0 0 77 -3,-0.3 4,-2.4 2,-0.2 -1,-0.3 0.882 108.8 48.6 -63.6 -37.4 8.5 34.7 -6.6 252 255 A R H X S+ 0 0 0 -4,-1.7 4,-2.8 -3,-0.4 -2,-0.2 0.919 109.0 52.0 -69.1 -42.8 9.7 36.6 -3.6 253 256 A V H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.939 114.0 43.9 -55.2 -49.9 11.2 33.4 -2.1 254 257 A L H X S+ 0 0 52 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.868 113.3 51.0 -65.8 -38.1 13.0 32.8 -5.4 255 258 A A H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.888 110.5 48.9 -63.9 -43.5 14.1 36.4 -5.6 256 259 A N H X S+ 0 0 0 -4,-2.8 4,-1.9 2,-0.2 -2,-0.2 0.891 112.0 49.4 -63.5 -40.1 15.5 36.3 -2.1 257 260 A S H X S+ 0 0 4 -4,-2.2 4,-1.8 -5,-0.2 -2,-0.2 0.860 110.8 49.8 -65.5 -39.2 17.3 33.1 -2.9 258 261 A A H X S+ 0 0 13 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.921 109.4 51.5 -66.6 -43.3 18.8 34.6 -6.0 259 262 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.868 109.6 49.4 -62.2 -42.9 19.9 37.8 -4.1 260 263 A X H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.887 112.1 49.3 -60.6 -41.9 21.7 35.6 -1.5 261 264 A T H X S+ 0 0 63 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.932 113.9 44.3 -62.7 -48.5 23.4 33.6 -4.3 262 265 A H H X S+ 0 0 67 -4,-2.8 4,-3.2 2,-0.2 5,-0.2 0.872 109.4 57.0 -63.7 -40.0 24.5 36.8 -6.1 263 266 A F H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.943 109.8 45.4 -55.7 -50.9 25.6 38.4 -2.8 264 267 A L H X S+ 0 0 6 -4,-2.1 4,-0.8 2,-0.2 -2,-0.2 0.875 113.8 48.7 -59.6 -43.1 27.9 35.3 -2.2 265 268 A A H >< S+ 0 0 54 -4,-2.1 3,-0.7 2,-0.2 -2,-0.2 0.931 112.7 48.3 -64.3 -46.5 29.3 35.4 -5.8 266 269 A L H 3< S+ 0 0 42 -4,-3.2 -2,-0.2 1,-0.2 -1,-0.2 0.884 117.5 41.8 -60.6 -37.4 29.9 39.1 -5.6 267 270 A C H 3< 0 0 23 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.448 360.0 360.0 -94.2 -1.3 31.7 38.8 -2.3 268 271 A A << 0 0 52 -4,-0.8 -1,-0.2 -3,-0.7 -171,-0.0 -0.703 360.0 360.0-118.1 360.0 33.7 35.6 -3.1