==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 16-AUG-10 3OG9 . COMPND 2 MOLECULE: PROTEIN YAHD A COPPER INDUCIBLE HYDROLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: LACTOCOCCUS LACTIS SUBSP. LACTIS; . AUTHOR J.MARTINEZ FONT,S.MANCINI,E.TAUBERGER,S.MONIOT . 412 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19817.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 288 69.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 54 13.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 18 4.4 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 . 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 . 39 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 112 27.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 0 2 0 0 0 2 0 3 1 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 4 2 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 PARALLEL BRIDGES PER LADDER . 4 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 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 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 0 221 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 108.1 2.9 -6.4 15.5 2 2 A T - 0 0 40 1,-0.1 2,-0.7 43,-0.0 45,-0.1 -0.197 360.0-141.8 -57.7 126.8 -0.4 -6.6 17.5 3 3 A D + 0 0 71 43,-0.2 43,-2.8 44,-0.1 2,-0.3 -0.811 45.0 139.1 -86.2 113.9 -3.5 -5.5 15.7 4 4 A Y E -A 45 0A 56 -2,-0.7 2,-0.4 41,-0.2 41,-0.2 -0.986 43.7-138.3-152.2 157.0 -5.6 -3.6 18.2 5 5 A V E -A 44 0A 20 39,-2.5 39,-2.8 -2,-0.3 2,-0.4 -0.984 14.9-171.9-113.6 136.3 -7.9 -0.5 18.8 6 6 A F E -A 43 0A 59 -2,-0.4 2,-0.4 37,-0.2 37,-0.2 -0.998 2.7-177.4-121.2 131.5 -7.8 1.6 21.9 7 7 A K E -A 42 0A 91 35,-2.4 35,-2.7 -2,-0.4 -2,-0.0 -0.968 20.1-145.2-129.0 116.9 -10.4 4.3 22.4 8 8 A A + 0 0 61 -2,-0.4 -1,-0.1 33,-0.2 35,-0.0 0.734 30.5 166.9 -58.7 -37.1 -9.9 6.3 25.6 9 9 A G - 0 0 53 31,-0.2 2,-0.6 32,-0.1 31,-0.2 -0.169 65.1 -22.9 54.4-148.0 -13.5 7.0 26.8 10 10 A R > - 0 0 163 29,-3.4 3,-1.8 1,-0.1 -1,-0.1 -0.874 65.7-141.6 -94.8 120.4 -13.8 8.3 30.3 11 11 A K T 3 S+ 0 0 173 -2,-0.6 -1,-0.1 1,-0.3 -2,-0.0 0.681 94.1 56.1 -56.5 -27.3 -10.6 7.2 32.2 12 12 A D T 3 S+ 0 0 117 2,-0.1 -1,-0.3 -3,-0.0 2,-0.2 0.582 90.4 91.8 -85.6 -8.7 -12.3 6.4 35.6 13 13 A L S < S- 0 0 44 -3,-1.8 87,-0.1 26,-0.2 26,-0.0 -0.556 91.5 -87.5 -88.0 151.6 -14.8 3.9 34.1 14 14 A A - 0 0 17 -2,-0.2 -1,-0.1 1,-0.1 87,-0.1 -0.255 47.3-117.2 -57.8 135.2 -14.2 0.2 33.8 15 15 A P - 0 0 4 0, 0.0 87,-2.7 0, 0.0 2,-0.5 -0.419 19.3-138.9 -77.8 151.0 -12.4 -0.8 30.6 16 16 A L E -bc 42 102A 0 25,-2.2 27,-3.0 85,-0.2 2,-0.6 -0.925 6.2-156.5-106.6 132.4 -14.0 -3.1 28.0 17 17 A L E -bc 43 103A 0 85,-2.3 87,-2.7 -2,-0.5 2,-0.4 -0.954 16.3-156.5-104.5 118.3 -12.0 -5.9 26.3 18 18 A L E -bc 44 104A 0 25,-2.7 27,-1.3 -2,-0.6 2,-0.4 -0.813 11.0-172.9-101.6 136.1 -13.6 -6.7 22.9 19 19 A L E - c 0 105A 0 85,-2.0 87,-1.6 -2,-0.4 91,-0.2 -0.994 16.6-139.8-131.0 123.3 -13.1 -10.1 21.2 20 20 A H - 0 0 2 -2,-0.4 89,-1.5 25,-0.4 37,-0.1 -0.200 14.5-110.6 -80.8 165.9 -14.4 -10.7 17.7 21 21 A S > - 0 0 13 87,-0.2 3,-2.5 1,-0.2 86,-0.1 -0.311 58.5 -60.6 -82.5 177.5 -16.1 -13.7 16.0 22 22 A T T 3 S+ 0 0 58 1,-0.3 34,-0.2 -2,-0.1 -1,-0.2 -0.395 130.7 15.7 -59.6 129.8 -14.5 -15.9 13.4 23 23 A G T 3 S+ 0 0 50 32,-3.1 -1,-0.3 1,-0.3 33,-0.1 0.378 106.1 113.9 84.7 -5.7 -13.7 -13.7 10.4 24 24 A G < - 0 0 7 -3,-2.5 -1,-0.3 31,-0.4 2,-0.3 -0.150 49.5-153.3 -81.2-176.3 -14.1 -10.5 12.5 25 25 A D > - 0 0 60 -3,-0.1 3,-1.5 21,-0.1 4,-0.4 -0.869 40.4 -73.7-145.8-173.3 -11.4 -8.0 13.4 26 26 A E T 3 S+ 0 0 16 -2,-0.3 -21,-0.2 1,-0.3 3,-0.1 0.662 127.9 49.4 -62.2 -18.6 -10.5 -5.5 16.0 27 27 A H T > S+ 0 0 114 1,-0.1 3,-1.0 2,-0.1 4,-0.4 0.592 84.8 91.4 -92.1 -14.0 -13.2 -3.0 14.7 28 28 A Q T < S+ 0 0 71 -3,-1.5 4,-0.3 1,-0.2 3,-0.2 0.858 95.1 30.6 -51.4 -47.3 -16.1 -5.5 14.6 29 29 A L T 3> S+ 0 0 4 -4,-0.4 4,-3.1 1,-0.2 5,-0.2 0.428 88.5 102.3 -99.9 0.8 -17.5 -4.9 18.1 30 30 A V H <> S+ 0 0 13 -3,-1.0 4,-2.0 1,-0.2 -1,-0.2 0.902 86.7 39.3 -56.8 -52.0 -16.6 -1.2 18.6 31 31 A E H > S+ 0 0 158 -4,-0.4 4,-1.3 -3,-0.2 -1,-0.2 0.854 115.6 54.4 -66.9 -33.9 -20.0 0.3 18.0 32 32 A I H >> S+ 0 0 43 -4,-0.3 4,-2.2 2,-0.2 3,-0.5 0.937 108.9 47.2 -62.4 -49.9 -21.7 -2.5 19.8 33 33 A A H 3X S+ 0 0 0 -4,-3.1 4,-2.9 1,-0.2 -2,-0.2 0.890 107.0 58.3 -59.0 -40.2 -19.6 -2.0 22.9 34 34 A E H 3< S+ 0 0 69 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.813 109.3 44.8 -59.0 -31.9 -20.3 1.8 22.7 35 35 A M H << S+ 0 0 103 -4,-1.3 -2,-0.2 -3,-0.5 -1,-0.2 0.856 116.2 45.9 -77.3 -38.1 -24.1 0.9 23.0 36 36 A I H < S+ 0 0 4 -4,-2.2 -2,-0.2 1,-0.2 -3,-0.2 0.902 131.4 15.6 -71.0 -44.6 -23.6 -1.6 25.8 37 37 A A S >< S- 0 0 2 -4,-2.9 3,-1.8 -5,-0.2 -1,-0.2 -0.649 82.4-155.3-134.6 72.6 -21.3 0.5 28.0 38 38 A P T 3 S+ 0 0 63 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 -0.247 76.8 9.3 -55.2 136.9 -21.4 4.2 26.8 39 39 A S T 3 S+ 0 0 47 1,-0.2 -29,-3.4 -5,-0.1 -26,-0.2 0.283 92.0 133.1 81.7 -8.9 -18.3 6.2 27.7 40 40 A H < - 0 0 8 -3,-1.8 -1,-0.2 -31,-0.2 -31,-0.2 -0.540 65.4-105.1 -76.5 141.0 -16.2 3.2 28.9 41 41 A P - 0 0 3 0, 0.0 -25,-2.2 0, 0.0 2,-0.4 -0.287 38.9-142.5 -57.1 151.0 -12.6 3.0 27.6 42 42 A I E -Ab 7 16A 4 -35,-2.7 -35,-2.4 -27,-0.2 2,-0.4 -0.978 22.1-178.4-127.8 127.9 -12.3 0.3 24.9 43 43 A L E +Ab 6 17A 0 -27,-3.0 -25,-2.7 -2,-0.4 2,-0.5 -0.997 10.9 179.5-118.5 122.9 -9.5 -2.2 24.2 44 44 A S E -Ab 5 18A 2 -39,-2.8 -39,-2.5 -2,-0.4 2,-0.4 -0.975 5.2-169.1-130.3 118.6 -10.1 -4.5 21.2 45 45 A I E -A 4 0A 0 -27,-1.3 -25,-0.4 -2,-0.5 -41,-0.2 -0.926 16.9-131.8-116.9 127.9 -7.4 -7.0 20.2 46 46 A R - 0 0 63 -43,-2.8 -43,-0.2 -2,-0.4 -21,-0.1 -0.482 29.2-109.0 -73.8 141.8 -7.4 -9.1 16.9 47 47 A G - 0 0 5 -2,-0.2 10,-0.2 1,-0.1 -1,-0.1 -0.330 19.6-134.3 -63.8 152.7 -6.8 -12.8 17.1 48 48 A R S S+ 0 0 127 9,-0.3 2,-0.4 7,-0.1 9,-0.2 0.583 76.6 95.2 -89.7 -12.4 -3.4 -14.0 15.7 49 49 A I B +G 56 0B 23 7,-2.0 7,-2.3 1,-0.1 -2,-0.1 -0.700 37.6 162.6 -85.7 132.4 -4.8 -16.9 13.6 50 50 A N > + 0 0 89 -2,-0.4 3,-2.6 5,-0.2 4,-0.2 0.082 5.5 169.2-139.3 24.9 -5.5 -16.2 9.9 51 51 A E G > S- 0 0 107 1,-0.3 3,-1.3 2,-0.2 -2,-0.0 -0.207 84.0 -5.6 -53.7 119.7 -5.7 -19.5 8.1 52 52 A Q G 3 S- 0 0 198 1,-0.2 -1,-0.3 3,-0.0 3,-0.1 0.793 129.3 -63.9 58.0 37.7 -7.0 -18.7 4.6 53 53 A G G < S+ 0 0 57 -3,-2.6 2,-0.7 1,-0.2 -1,-0.2 0.598 102.4 129.8 67.1 12.7 -7.5 -15.0 5.6 54 54 A V < - 0 0 57 -3,-1.3 -1,-0.2 -4,-0.2 -3,-0.2 -0.883 56.6-133.9 -96.3 111.4 -10.2 -15.8 8.2 55 55 A N + 0 0 22 -2,-0.7 -32,-3.1 -31,-0.2 -31,-0.4 -0.450 39.2 155.2 -66.6 136.0 -9.3 -14.1 11.5 56 56 A R B -G 49 0B 28 -7,-2.3 -7,-2.0 -34,-0.2 3,-0.1 -0.966 48.4-127.3-152.5 162.9 -9.6 -16.3 14.6 57 57 A Y S S+ 0 0 6 -2,-0.3 2,-0.3 -10,-0.2 -9,-0.3 0.682 91.0 6.7 -87.8 -19.8 -8.2 -16.6 18.2 58 58 A F S S- 0 0 1 -9,-0.1 -1,-0.2 -11,-0.1 2,-0.1 -0.976 85.6 -87.2-159.8 161.5 -7.0 -20.3 17.9 59 59 A K - 0 0 68 -2,-0.3 13,-2.1 13,-0.3 2,-0.2 -0.381 27.0-142.7 -79.2 153.1 -6.7 -23.0 15.3 60 60 A L B -H 71 0C 54 11,-0.2 11,-0.2 -2,-0.1 10,-0.1 -0.585 15.0-132.8 -98.3 171.6 -9.3 -25.6 14.2 61 61 A R - 0 0 123 9,-1.6 10,-0.1 -2,-0.2 -2,-0.0 0.368 44.1-112.2 -92.1 2.1 -8.5 -29.2 13.3 62 62 A G S S+ 0 0 70 8,-0.2 2,-0.1 4,-0.1 8,-0.1 0.752 81.5 125.7 -27.1 91.2 -10.4 -29.2 10.2 63 63 A L > + 0 0 79 4,-0.1 3,-2.5 3,-0.1 7,-0.1 -0.671 29.9 169.7-121.3 62.1 -13.0 -31.6 11.4 64 64 A G T 3 + 0 0 72 1,-0.3 -1,-0.1 -2,-0.1 6,-0.1 0.640 69.8 68.0 -57.6 -16.2 -15.8 -29.1 10.5 65 65 A G T 3 S+ 0 0 78 -3,-0.1 -1,-0.3 2,-0.0 2,-0.3 0.528 98.8 66.1 -73.7 -6.1 -18.4 -31.9 11.1 66 66 A F < - 0 0 117 -3,-2.5 -3,-0.1 1,-0.2 -4,-0.1 -0.747 62.9-154.8-119.7 160.7 -17.5 -31.8 14.8 67 67 A T S > S+ 0 0 44 -2,-0.3 3,-1.8 3,-0.0 4,-0.3 0.706 89.7 10.4 -97.3 -94.1 -17.8 -29.3 17.7 68 68 A K G > S+ 0 0 72 1,-0.3 3,-1.6 2,-0.2 -2,-0.0 0.797 123.5 63.3 -63.4 -32.1 -15.2 -29.9 20.5 69 69 A E G 3 S+ 0 0 114 1,-0.3 -1,-0.3 -6,-0.1 -2,-0.0 0.707 98.4 57.9 -63.0 -21.4 -13.1 -32.3 18.5 70 70 A N G < S+ 0 0 12 -3,-1.8 -9,-1.6 -7,-0.1 2,-0.6 0.525 84.1 96.7 -85.0 -5.3 -12.4 -29.5 16.0 71 71 A F B < S-H 60 0C 21 -3,-1.6 2,-1.1 -4,-0.3 -11,-0.2 -0.757 71.9-138.6 -92.2 120.3 -10.8 -27.2 18.6 72 72 A D > - 0 0 28 -13,-2.1 4,-3.0 -2,-0.6 -13,-0.3 -0.642 18.3-170.6 -76.5 99.1 -7.0 -27.3 18.7 73 73 A L H > S+ 0 0 62 -2,-1.1 4,-2.4 1,-0.2 -1,-0.2 0.804 82.6 55.9 -68.3 -29.7 -6.4 -27.3 22.5 74 74 A E H > S+ 0 0 145 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.937 112.2 43.7 -63.6 -44.6 -2.7 -26.8 22.1 75 75 A S H > S+ 0 0 5 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.922 111.9 53.6 -62.6 -46.7 -3.3 -23.7 20.0 76 76 A L H X S+ 0 0 1 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.921 111.6 46.0 -54.2 -45.7 -6.0 -22.6 22.4 77 77 A D H X S+ 0 0 84 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.947 114.8 46.0 -66.4 -44.7 -3.6 -22.9 25.3 78 78 A E H X S+ 0 0 110 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.915 115.3 45.7 -63.5 -43.8 -0.7 -21.1 23.4 79 79 A E H X S+ 0 0 20 -4,-3.1 4,-3.2 1,-0.2 -1,-0.2 0.855 110.3 53.1 -75.3 -32.7 -2.9 -18.2 22.2 80 80 A T H X S+ 0 0 1 -4,-2.1 4,-2.4 -5,-0.3 -1,-0.2 0.852 108.4 50.7 -71.0 -30.4 -4.6 -17.6 25.5 81 81 A D H X S+ 0 0 75 -4,-1.7 4,-1.9 -5,-0.2 -2,-0.2 0.931 114.0 46.4 -64.2 -44.2 -1.2 -17.3 27.2 82 82 A W H X S+ 0 0 39 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.943 113.4 47.6 -62.3 -47.7 -0.3 -14.8 24.5 83 83 A L H X S+ 0 0 1 -4,-3.2 4,-2.8 2,-0.2 5,-0.2 0.892 109.8 51.4 -65.8 -42.0 -3.6 -12.9 24.9 84 84 A T H X S+ 0 0 11 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.937 113.9 45.3 -59.4 -41.1 -3.4 -12.7 28.7 85 85 A D H X S+ 0 0 106 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.899 113.1 50.8 -70.4 -37.9 0.1 -11.3 28.4 86 86 A E H X S+ 0 0 22 -4,-2.6 4,-2.6 2,-0.2 5,-0.3 0.900 108.4 51.3 -66.8 -42.0 -1.0 -8.9 25.7 87 87 A V H X S+ 0 0 0 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.930 111.7 47.5 -58.4 -46.1 -3.9 -7.7 27.7 88 88 A S H X S+ 0 0 41 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.894 113.3 49.0 -63.1 -39.8 -1.6 -7.0 30.7 89 89 A L H X S+ 0 0 99 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.893 114.7 42.7 -69.0 -40.8 0.9 -5.2 28.4 90 90 A L H X S+ 0 0 3 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.813 110.8 55.5 -78.0 -28.0 -1.7 -3.0 26.7 91 91 A A H X>S+ 0 0 4 -4,-2.2 5,-2.6 -5,-0.3 4,-0.5 0.904 109.7 49.2 -66.7 -40.3 -3.4 -2.3 30.0 92 92 A E H ><5S+ 0 0 152 -4,-2.0 3,-1.1 3,-0.2 -2,-0.2 0.964 112.2 46.7 -52.6 -59.4 0.0 -1.1 31.2 93 93 A K H 3<5S+ 0 0 131 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.820 122.3 35.5 -55.6 -37.8 0.5 1.1 28.1 94 94 A H H 3<5S- 0 0 46 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.270 108.9-115.6-107.6 12.2 -3.0 2.6 28.3 95 95 A D T <<5 + 0 0 150 -3,-1.1 2,-0.3 -4,-0.5 -3,-0.2 0.893 60.7 152.6 55.3 46.5 -3.3 2.8 32.2 96 96 A L < - 0 0 25 -5,-2.6 2,-0.6 -6,-0.1 -1,-0.2 -0.781 45.1-128.3-104.9 150.1 -6.2 0.4 32.4 97 97 A D > - 0 0 85 -2,-0.3 3,-1.4 1,-0.2 4,-0.4 -0.899 11.4-161.0 -99.8 112.5 -7.0 -1.8 35.4 98 98 A V G > S+ 0 0 37 -2,-0.6 3,-1.7 1,-0.3 27,-0.4 0.875 89.7 62.2 -62.2 -38.2 -7.4 -5.5 34.4 99 99 A H G 3 S+ 0 0 28 1,-0.3 -1,-0.3 25,-0.1 203,-0.1 0.641 106.4 46.6 -64.1 -14.9 -9.3 -6.3 37.6 100 100 A K G < S+ 0 0 65 -3,-1.4 -1,-0.3 25,-0.1 -2,-0.2 0.479 88.2 128.5 -98.3 -7.8 -12.0 -3.9 36.5 101 101 A M < - 0 0 0 -3,-1.7 24,-2.4 -4,-0.4 25,-1.4 -0.182 45.5-156.9 -62.1 136.6 -12.2 -5.2 32.9 102 102 A I E -cd 16 126A 3 -87,-2.7 -85,-2.3 23,-0.2 2,-0.4 -0.967 13.8-147.3-111.5 113.4 -15.5 -6.2 31.3 103 103 A A E -cd 17 127A 0 23,-2.2 25,-3.1 -2,-0.6 2,-0.5 -0.725 14.3-173.6 -83.2 132.6 -14.9 -8.7 28.5 104 104 A I E +cd 18 128A 0 -87,-2.7 -85,-2.0 -2,-0.4 2,-0.3 -0.987 16.7 164.3-126.2 113.6 -17.4 -8.5 25.6 105 105 A G E -cd 19 129A 0 23,-2.3 25,-2.8 -2,-0.5 2,-0.4 -0.920 27.8-150.2-131.5 158.0 -17.0 -11.2 23.0 106 106 A Y E > - d 0 130A 34 -87,-1.6 3,-1.4 -2,-0.3 25,-0.2 -0.996 62.6 -49.7-129.3 125.7 -19.0 -12.7 20.2 107 107 A S T 3> S+ 0 0 12 23,-3.0 4,-2.5 -2,-0.4 3,-0.3 -0.223 135.0 20.2 55.1-119.9 -18.7 -16.4 19.2 108 108 A N H 3> S+ 0 0 4 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.903 132.9 45.2 -43.4 -53.0 -15.0 -17.2 18.8 109 109 A G H <> S+ 0 0 0 -89,-1.5 4,-2.3 -3,-1.4 -1,-0.2 0.889 112.0 51.8 -60.3 -39.7 -13.9 -14.2 21.0 110 110 A A H > S+ 0 0 0 -3,-0.3 4,-2.5 20,-0.2 -1,-0.2 0.905 108.9 51.8 -62.8 -40.7 -16.6 -15.0 23.6 111 111 A N H X S+ 0 0 9 -4,-2.5 4,-2.1 1,-0.2 24,-0.2 0.878 110.2 47.7 -62.8 -40.4 -15.3 -18.6 23.8 112 112 A V H X S+ 0 0 2 -4,-1.8 4,-2.6 -5,-0.3 -1,-0.2 0.888 112.0 49.1 -70.5 -42.7 -11.8 -17.5 24.4 113 113 A A H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.912 113.1 47.9 -59.8 -46.9 -12.8 -14.9 27.1 114 114 A L H X S+ 0 0 1 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.887 112.2 48.9 -65.0 -40.0 -14.9 -17.6 28.8 115 115 A N H X S+ 0 0 9 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.934 110.9 49.2 -66.7 -45.5 -12.0 -20.1 28.7 116 116 A M H <>S+ 0 0 0 -4,-2.6 5,-2.7 2,-0.2 6,-0.9 0.876 112.8 49.2 -56.5 -40.6 -9.4 -17.6 30.0 117 117 A F H ><5S+ 0 0 1 -4,-2.1 3,-1.1 3,-0.2 -2,-0.2 0.940 113.7 44.5 -65.7 -50.4 -11.8 -16.8 32.9 118 118 A L H 3<5S+ 0 0 6 -4,-2.3 24,-0.3 1,-0.3 23,-0.2 0.768 113.7 49.9 -69.0 -29.0 -12.5 -20.4 33.8 119 119 A R T 3<5S- 0 0 107 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.471 111.8-122.5 -83.4 -7.6 -8.8 -21.3 33.5 120 120 A G T < 5S+ 0 0 32 -3,-1.1 -3,-0.2 -4,-0.3 3,-0.1 0.748 74.0 128.5 69.3 27.7 -7.9 -18.3 35.8 121 121 A K S + 0 0 7 31,-3.0 3,-1.8 -2,-0.5 34,-0.2 -0.173 20.0 142.2-128.2 38.7 -15.5 -17.0 40.9 145 145 A D T 3 S+ 0 0 108 1,-0.3 31,-0.1 30,-0.2 -1,-0.1 0.713 72.8 42.2 -65.0 -24.5 -18.2 -16.8 43.6 146 146 A D T 3 S+ 0 0 86 -3,-0.1 -1,-0.3 31,-0.1 2,-0.1 0.435 91.9 112.9 -98.4 -2.3 -18.7 -13.0 43.4 147 147 A K < - 0 0 14 -3,-1.8 31,-3.0 -21,-0.0 2,-0.4 -0.407 51.9-149.8 -86.6 149.3 -18.6 -12.7 39.6 148 148 A H E -ef 126 178A 70 -23,-0.7 -21,-1.1 29,-0.2 2,-0.4 -0.945 17.4-179.5-117.4 134.6 -21.5 -11.7 37.2 149 149 A V E -ef 127 179A 0 29,-2.2 31,-2.3 -2,-0.4 2,-0.4 -1.000 16.1-152.1-140.4 134.1 -21.6 -13.1 33.7 150 150 A F E -ef 128 180A 1 -23,-3.0 -21,-3.1 -2,-0.4 2,-0.4 -0.930 18.9-179.4-107.7 131.0 -24.1 -12.5 30.8 151 151 A L E -ef 129 181A 0 29,-2.8 31,-3.1 -2,-0.4 2,-0.3 -0.997 12.4-157.5-130.2 137.1 -24.6 -15.3 28.2 152 152 A S E + f 0 182A 0 -23,-1.9 -20,-0.5 -2,-0.4 -21,-0.4 -0.851 14.5 174.3-107.7 155.9 -26.8 -15.5 25.2 153 153 A Y E - f 0 183A 30 29,-2.1 31,-2.2 -2,-0.3 34,-0.0 -0.981 17.5-155.3-149.9 144.7 -28.0 -18.7 23.5 154 154 A A > - 0 0 0 -2,-0.3 3,-1.6 29,-0.2 6,-0.2 -0.996 15.3-144.4-119.0 139.8 -30.3 -19.5 20.6 155 155 A P T 3 S+ 0 0 75 0, 0.0 7,-0.1 0, 0.0 30,-0.1 0.635 103.1 55.0 -79.3 -7.0 -32.0 -22.9 20.4 156 156 A N T 3 S+ 0 0 96 28,-0.2 2,-0.8 31,-0.1 32,-0.3 0.226 76.0 123.4-101.0 14.2 -31.7 -22.8 16.6 157 157 A D < - 0 0 10 -3,-1.6 3,-0.3 30,-0.3 30,-0.1 -0.650 44.4-167.5 -74.6 109.3 -28.0 -22.2 16.8 158 158 A M S S+ 0 0 175 -2,-0.8 -1,-0.2 1,-0.2 29,-0.0 0.781 84.5 56.6 -66.1 -24.9 -26.5 -25.0 14.7 159 159 A I S S+ 0 0 68 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 0.821 102.8 52.2 -82.0 -32.3 -23.0 -24.1 16.1 160 160 A V S S- 0 0 3 -3,-0.3 -1,-0.2 -6,-0.2 -3,-0.2 -0.900 78.6-145.9-112.5 106.2 -23.7 -24.4 19.8 161 161 A P > - 0 0 50 0, 0.0 4,-2.6 0, 0.0 5,-0.2 -0.377 20.1-122.5 -61.1 145.4 -25.3 -27.7 20.9 162 162 A Q H > S+ 0 0 151 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.905 113.5 50.9 -53.8 -47.1 -27.7 -27.5 23.8 163 163 A K H > S+ 0 0 172 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.898 109.2 52.0 -61.1 -42.2 -25.7 -30.0 25.9 164 164 A N H > S+ 0 0 9 2,-0.2 4,-2.2 1,-0.2 3,-0.2 0.940 109.3 47.8 -60.1 -50.2 -22.6 -27.9 25.2 165 165 A F H X S+ 0 0 5 -4,-2.6 4,-2.4 1,-0.2 5,-0.2 0.902 109.3 55.6 -58.5 -38.8 -24.2 -24.7 26.4 166 166 A G H X S+ 0 0 36 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.847 107.6 49.6 -56.2 -39.1 -25.5 -26.6 29.5 167 167 A D H X S+ 0 0 70 -4,-1.8 4,-2.7 -3,-0.2 -2,-0.2 0.879 109.4 50.7 -69.7 -40.8 -21.9 -27.6 30.3 168 168 A L H X S+ 0 0 3 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.937 113.3 44.6 -59.7 -48.1 -20.7 -24.0 29.9 169 169 A K H X S+ 0 0 73 -4,-2.4 4,-3.1 1,-0.2 5,-0.3 0.934 114.1 51.4 -61.8 -44.5 -23.4 -22.7 32.3 170 170 A G H X S+ 0 0 21 -4,-2.2 4,-3.0 -5,-0.2 -2,-0.2 0.905 108.0 50.6 -59.4 -46.6 -22.6 -25.6 34.7 171 171 A D H X S+ 0 0 15 -4,-2.7 4,-1.1 2,-0.2 -1,-0.2 0.934 114.3 45.1 -59.6 -45.2 -18.8 -24.9 34.7 172 172 A L H <>S+ 0 0 0 -4,-2.2 5,-2.4 2,-0.2 4,-0.5 0.918 115.8 45.3 -63.0 -44.7 -19.5 -21.2 35.5 173 173 A E H ><5S+ 0 0 107 -4,-3.1 3,-0.9 1,-0.2 -2,-0.2 0.885 108.9 56.1 -69.8 -37.4 -22.1 -22.0 38.2 174 174 A D H 3<5S+ 0 0 130 -4,-3.0 -1,-0.2 -5,-0.3 -2,-0.2 0.797 106.3 52.1 -59.3 -28.9 -19.9 -24.6 39.7 175 175 A S T 3<5S- 0 0 6 -4,-1.1 -31,-3.0 -3,-0.2 -1,-0.2 0.579 127.4-103.2 -81.9 -12.1 -17.3 -21.9 40.0 176 176 A G T < 5 + 0 0 12 -3,-0.9 -3,-0.2 -4,-0.5 -2,-0.1 0.413 65.4 156.0 106.8 1.4 -19.8 -19.7 41.8 177 177 A C < - 0 0 7 -5,-2.4 2,-0.7 -6,-0.2 -1,-0.2 -0.220 42.2-132.3 -63.7 148.6 -20.8 -17.2 39.0 178 178 A Q E -f 148 0A 78 -31,-3.0 -29,-2.2 -34,-0.2 2,-0.4 -0.892 35.1-158.1 -97.6 116.3 -24.1 -15.4 39.0 179 179 A L E -f 149 0A 34 -2,-0.7 2,-0.5 -31,-0.2 -29,-0.2 -0.778 22.9-164.3-105.7 141.4 -25.4 -15.9 35.5 180 180 A E E -f 150 0A 87 -31,-2.3 -29,-2.8 -2,-0.4 2,-0.5 -0.995 16.9-160.0-112.7 126.2 -27.9 -14.0 33.3 181 181 A I E -f 151 0A 62 -2,-0.5 2,-0.5 -31,-0.2 -29,-0.2 -0.921 4.5-166.4-109.6 122.2 -29.0 -16.0 30.3 182 182 A Y E -f 152 0A 63 -31,-3.1 -29,-2.1 -2,-0.5 2,-0.6 -0.910 10.0-149.3-107.3 128.5 -30.6 -14.3 27.3 183 183 A E E -f 153 0A 132 -2,-0.5 -29,-0.2 -31,-0.2 2,-0.2 -0.862 17.3-174.2-100.9 114.3 -32.4 -16.4 24.7 184 184 A S - 0 0 5 -31,-2.2 -28,-0.2 -2,-0.6 3,-0.2 -0.528 21.0-142.7 -99.0 172.8 -32.3 -15.0 21.1 185 185 A S S S+ 0 0 89 -2,-0.2 3,-0.1 -31,-0.2 -31,-0.1 0.166 78.0 80.7-126.8 17.8 -34.1 -16.4 18.0 186 186 A L S > S- 0 0 91 1,-0.4 3,-1.6 3,-0.3 -1,-0.1 -0.085 87.6-124.6-116.2 38.8 -31.7 -16.0 15.1 187 187 A G T 3 S- 0 0 8 1,-0.3 -1,-0.4 -3,-0.2 -30,-0.3 -0.310 80.9 -13.9 55.6-139.2 -29.3 -19.0 15.5 188 188 A H T 3 S+ 0 0 33 -32,-0.3 -1,-0.3 -3,-0.1 2,-0.2 0.588 108.2 113.8 -71.7 -11.5 -25.6 -18.0 15.8 189 189 A Q S < S- 0 0 115 -3,-1.6 2,-0.3 1,-0.1 -3,-0.3 -0.416 72.8-119.6 -68.1 132.8 -26.3 -14.5 14.6 190 190 A L - 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