==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CARBOXYPEPTIDASE 14-NOV-96 1BAV . COMPND 2 MOLECULE: CARBOXYPEPTIDASE A; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR P.MARTIN,B.EDWARDS . 1228 4 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 45675.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 836 68.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 113 9.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 68 5.5 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 . 4 0.3 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 . 86 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 112 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 384 31.3 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 4 0 0 4 1 7 0 0 0 4 4 0 0 3 0 4 2 3 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 0 4 6 3 3 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 8 0 0 0 4 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 0 4 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 A 0 0 74 0, 0.0 6,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0-130.6 4.7 2.9 28.8 2 2 A R + 0 0 218 4,-0.1 2,-0.2 2,-0.0 3,-0.1 -0.097 360.0 28.8 -97.9 37.5 3.0 0.1 26.8 3 3 A S S S- 0 0 24 1,-0.1 3,-0.4 3,-0.0 22,-0.1 -0.863 70.7-126.3 176.2 148.3 1.5 2.5 24.3 4 4 A T S > S+ 0 0 0 -2,-0.2 3,-1.3 1,-0.2 -1,-0.1 0.740 112.8 66.2 -76.4 -21.0 2.1 5.9 22.6 5 5 A N T 3 S+ 0 0 113 1,-0.3 -1,-0.2 -3,-0.1 -3,-0.0 0.762 106.6 39.3 -68.3 -26.6 -1.4 6.7 23.8 6 6 A T T 3 S+ 0 0 91 -3,-0.4 2,-0.3 2,-0.1 -1,-0.3 0.057 90.5 116.0-108.5 18.4 -0.1 6.4 27.4 7 7 A F S < S- 0 0 21 -3,-1.3 2,-0.8 -6,-0.1 -3,-0.1 -0.710 71.8-120.4 -84.3 138.7 3.2 8.2 26.7 8 8 A N + 0 0 90 -2,-0.3 3,-0.5 1,-0.1 -2,-0.1 -0.765 31.0 178.5 -87.0 114.5 3.5 11.5 28.5 9 9 A Y S S+ 0 0 38 -2,-0.8 -1,-0.1 1,-0.2 72,-0.1 0.378 72.8 66.8 -93.4 1.8 3.9 14.3 26.0 10 10 A A S S+ 0 0 44 276,-0.1 2,-0.3 277,-0.1 -1,-0.2 -0.108 92.9 66.9-113.4 33.0 4.1 17.1 28.7 11 11 A T S S- 0 0 59 -3,-0.5 2,-0.5 66,-0.1 0, 0.0 -0.966 87.5-103.9-148.6 151.9 7.4 16.0 30.2 12 12 A Y - 0 0 45 -2,-0.3 2,-0.1 1,-0.0 -2,-0.1 -0.748 39.5-153.8 -85.6 129.5 10.9 16.0 28.9 13 13 A H - 0 0 27 -2,-0.5 2,-0.2 1,-0.1 64,-0.1 -0.435 9.6-117.5-102.2 166.8 12.3 12.6 27.9 14 14 A T > - 0 0 51 -2,-0.1 4,-2.2 1,-0.1 5,-0.2 -0.517 37.7 -98.7 -93.1 171.1 15.7 10.9 27.7 15 15 A L H > S+ 0 0 15 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.861 124.2 48.9 -58.5 -39.8 17.4 9.6 24.6 16 16 A D H > S+ 0 0 111 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.912 109.4 52.9 -69.0 -39.9 16.3 6.0 25.3 17 17 A E H > S+ 0 0 83 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.892 111.3 46.1 -62.0 -38.9 12.8 7.1 26.0 18 18 A I H X S+ 0 0 4 -4,-2.2 4,-1.4 2,-0.2 -2,-0.2 0.890 114.4 46.4 -72.9 -37.8 12.6 8.9 22.6 19 19 A Y H X S+ 0 0 25 -4,-2.3 4,-1.4 2,-0.2 -2,-0.2 0.896 112.9 51.5 -70.7 -36.2 14.2 5.9 20.7 20 20 A D H X S+ 0 0 100 -4,-2.8 4,-1.5 1,-0.2 3,-0.4 0.966 106.9 54.0 -60.8 -52.5 11.8 3.6 22.6 21 21 A F H X S+ 0 0 3 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.799 102.0 57.4 -51.7 -39.4 8.8 5.7 21.5 22 22 A M H X S+ 0 0 2 -4,-1.4 4,-2.6 1,-0.2 -1,-0.2 0.945 106.0 50.5 -60.9 -43.7 9.8 5.5 17.8 23 23 A D H X S+ 0 0 79 -4,-1.4 4,-2.2 -3,-0.4 -1,-0.2 0.843 111.3 47.8 -62.8 -37.3 9.6 1.7 18.0 24 24 A L H X S+ 0 0 55 -4,-1.5 4,-1.7 2,-0.2 -1,-0.2 0.886 110.3 52.0 -70.7 -40.1 6.1 1.8 19.6 25 25 A L H X S+ 0 0 0 -4,-2.5 4,-1.7 2,-0.2 3,-0.2 0.949 113.5 43.0 -62.5 -46.5 4.8 4.3 17.1 26 26 A V H < S+ 0 0 32 -4,-2.6 3,-0.3 1,-0.2 -2,-0.2 0.942 110.4 57.0 -64.0 -44.0 6.0 2.2 14.2 27 27 A A H < S+ 0 0 75 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.825 113.5 41.1 -55.2 -34.4 4.6 -0.9 15.9 28 28 A Q H < S+ 0 0 64 -4,-1.7 -1,-0.3 -3,-0.2 -2,-0.2 0.729 128.9 25.5 -87.0 -28.1 1.2 0.7 16.1 29 29 A H >X + 0 0 63 -4,-1.7 4,-2.3 -3,-0.3 3,-1.0 -0.291 65.8 151.8-135.4 58.1 1.1 2.3 12.6 30 30 A P T 34 S+ 0 0 70 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.727 71.6 63.1 -61.1 -23.9 3.4 0.2 10.3 31 31 A E T 34 S+ 0 0 173 1,-0.1 3,-0.1 -3,-0.1 22,-0.1 0.897 116.0 27.6 -68.0 -37.9 1.3 1.2 7.3 32 32 A L T <4 S+ 0 0 20 -3,-1.0 21,-2.7 1,-0.2 2,-0.4 0.765 120.9 40.5 -96.3 -32.9 2.1 4.9 7.6 33 33 A V E < +A 52 0A 3 -4,-2.3 2,-0.3 19,-0.2 19,-0.2 -0.974 49.3 174.4-134.8 136.3 5.5 5.1 9.3 34 34 A S E -A 51 0A 48 17,-2.0 17,-3.0 -2,-0.4 2,-0.4 -0.967 28.0-125.4-130.4 147.6 8.9 3.3 9.3 35 35 A K E -A 50 0A 58 -2,-0.3 2,-0.4 15,-0.2 15,-0.2 -0.780 24.1-167.9 -95.5 134.6 12.2 4.1 11.1 36 36 A L E -A 49 0A 53 13,-3.0 13,-2.9 -2,-0.4 2,-0.7 -0.975 16.5-141.7-124.5 131.5 15.4 4.5 9.0 37 37 A Q E +A 48 0A 101 -2,-0.4 11,-0.3 11,-0.2 3,-0.1 -0.841 19.9 178.5 -90.7 118.3 18.9 4.6 10.4 38 38 A I E - 0 0 28 9,-1.8 2,-0.3 -2,-0.7 10,-0.1 0.440 59.5 -44.8-100.9 2.8 20.8 7.1 8.3 39 39 A G E -A 47 0A 22 8,-1.0 8,-3.5 5,-0.0 2,-0.4 -0.958 60.2 -84.9 160.1-176.2 24.1 6.9 10.1 40 40 A R E -A 46 0A 145 -2,-0.3 138,-0.1 6,-0.3 5,-0.0 -0.948 37.5-117.4-124.7 145.0 25.8 6.7 13.5 41 41 A S > - 0 0 5 4,-2.9 3,-2.5 -2,-0.4 6,-0.1 -0.156 42.4 -89.5 -69.8 172.9 26.9 9.6 15.8 42 42 A Y T 3 S+ 0 0 89 1,-0.3 -1,-0.1 2,-0.1 90,-0.1 0.901 131.5 46.8 -50.8 -45.6 30.5 10.3 16.7 43 43 A E T 3 S- 0 0 100 1,-0.1 -1,-0.3 2,-0.0 -2,-0.1 0.178 127.0 -98.8 -84.9 15.7 30.1 8.1 19.7 44 44 A G S < S+ 0 0 19 -3,-2.5 -2,-0.1 1,-0.2 -1,-0.1 0.531 71.6 146.9 82.8 9.0 28.5 5.3 17.7 45 45 A R - 0 0 75 1,-0.1 -4,-2.9 -5,-0.0 -1,-0.2 -0.574 54.9-109.4 -77.6 135.4 24.8 6.0 18.5 46 46 A P E -A 40 0A 36 0, 0.0 2,-0.5 0, 0.0 -6,-0.3 -0.392 26.0-142.7 -65.6 142.1 22.5 5.1 15.6 47 47 A I E -A 39 0A 0 -8,-3.5 -9,-1.8 -6,-0.1 -8,-1.0 -0.936 23.9-163.6-104.5 125.0 20.9 8.2 14.0 48 48 A Y E -A 37 0A 43 -2,-0.5 62,-0.4 62,-0.3 2,-0.4 -0.873 17.4-163.0-116.4 153.5 17.3 7.6 13.0 49 49 A V E -A 36 0A 0 -13,-2.9 -13,-3.0 -2,-0.3 2,-0.6 -0.929 17.3-139.6-127.0 138.4 14.7 9.2 10.7 50 50 A L E -AB 35 107A 0 57,-2.0 57,-2.3 -2,-0.4 2,-0.6 -0.955 19.8-158.0 -99.8 119.0 11.0 8.6 10.9 51 51 A K E -AB 34 106A 63 -17,-3.0 -17,-2.0 -2,-0.6 2,-0.5 -0.897 4.0-163.0-102.0 121.3 9.6 8.3 7.4 52 52 A F E +AB 33 105A 0 53,-3.2 53,-2.2 -2,-0.6 2,-0.3 -0.914 27.0 147.9-102.5 127.6 5.9 9.0 7.0 53 53 A S - 0 0 14 -21,-2.7 51,-0.1 -2,-0.5 3,-0.1 -0.955 47.3-156.0-163.1 141.4 4.4 7.8 3.7 54 54 A T - 0 0 49 46,-0.6 2,-0.3 -2,-0.3 47,-0.1 0.505 68.6 -96.6 -94.0 -5.9 1.3 6.3 2.1 55 55 A G + 0 0 31 -23,-0.1 -1,-0.3 2,-0.1 4,-0.2 -0.967 67.3 114.1 132.5-150.3 3.4 4.7 -0.6 56 56 A G - 0 0 61 -2,-0.3 3,-0.1 -3,-0.1 46,-0.0 -0.039 61.8 -38.6 82.1-175.8 4.4 5.7 -4.2 57 57 A S S S- 0 0 99 1,-0.2 2,-3.3 3,-0.0 -2,-0.1 0.298 97.0 -47.0 -68.5-161.0 7.4 6.6 -6.3 58 58 A N S S- 0 0 88 129,-0.0 -1,-0.2 3,-0.0 3,-0.1 -0.442 84.7-158.7 -73.5 67.8 10.3 8.8 -5.2 59 59 A R - 0 0 52 -2,-3.3 44,-0.1 -4,-0.2 129,-0.1 -0.103 24.5 -88.5 -56.6 146.8 7.6 11.1 -4.0 60 60 A P - 0 0 42 0, 0.0 44,-1.5 0, 0.0 2,-0.3 -0.354 58.9-149.3 -53.7 133.2 8.2 14.8 -3.4 61 61 A A E -cd 104 189A 0 127,-2.4 129,-3.1 42,-0.2 130,-1.3 -0.765 21.8-146.9-119.9 159.5 9.4 15.0 0.2 62 62 A I E -cd 105 191A 0 42,-1.8 44,-3.3 -2,-0.3 2,-0.5 -0.988 18.7-156.4-121.7 118.0 9.4 17.3 3.2 63 63 A W E +cd 106 192A 0 128,-2.8 130,-3.1 -2,-0.5 2,-0.4 -0.857 14.4 175.1 -95.0 132.9 12.4 17.2 5.5 64 64 A I E -cd 107 193A 0 42,-2.0 44,-2.7 -2,-0.5 2,-0.4 -0.999 3.7-176.9-137.4 131.3 12.2 18.3 9.1 65 65 A D E -cd 108 194A 0 128,-2.0 130,-2.6 -2,-0.4 2,-0.3 -0.995 1.8-172.1-133.4 139.9 14.9 18.1 11.7 66 66 A L E + d 0 195A 0 42,-2.8 45,-2.2 -2,-0.4 46,-0.2 -0.890 58.4 24.1-128.1 152.1 14.9 18.9 15.4 67 67 A G + 0 0 0 128,-0.9 45,-0.5 -2,-0.3 -1,-0.1 0.631 55.5 145.6 74.5 18.1 17.5 19.1 18.1 68 68 A I S S+ 0 0 2 127,-0.4 2,-0.7 1,-0.2 75,-0.4 0.797 79.5 51.6 -57.4 -26.7 20.6 19.8 16.1 69 69 A H S > S- 0 0 5 1,-0.1 3,-1.5 3,-0.1 -1,-0.2 -0.954 90.7-150.9-107.5 109.8 21.6 21.9 19.2 70 70 A S T 3 S+ 0 0 0 -2,-0.7 57,-0.2 57,-0.5 -1,-0.1 0.743 85.4 60.2 -56.6 -32.8 21.0 19.5 22.0 71 71 A R T 3 S+ 0 0 37 55,-0.4 2,-2.6 1,-0.2 -1,-0.3 0.642 78.3 91.1 -72.5 -15.2 20.1 21.9 24.8 72 72 A E X> + 0 0 4 -3,-1.5 3,-1.8 1,-0.2 4,-0.7 -0.452 54.1 168.4 -81.1 71.1 17.1 23.2 22.9 73 73 A W H 3> + 0 0 34 -2,-2.6 4,-1.8 206,-0.4 5,-0.2 0.727 62.7 71.4 -57.6 -31.3 14.9 20.6 24.6 74 74 A I H 3> S+ 0 0 2 205,-0.3 4,-1.5 -3,-0.2 -1,-0.3 0.788 97.2 55.8 -59.4 -23.3 11.6 22.1 23.5 75 75 A T H <> S+ 0 0 0 -3,-1.8 4,-2.5 2,-0.2 5,-0.2 0.976 105.8 42.9 -76.6 -55.4 12.5 20.9 20.0 76 76 A Q H X S+ 0 0 1 -4,-0.7 4,-1.8 1,-0.2 -2,-0.2 0.882 117.1 51.3 -59.0 -35.0 13.1 17.2 20.4 77 77 A A H X S+ 0 0 15 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.893 108.0 50.9 -67.4 -38.3 9.9 17.2 22.6 78 78 A T H X S+ 0 0 0 -4,-1.5 4,-2.7 -5,-0.2 -2,-0.2 0.898 108.6 53.3 -63.5 -39.9 8.0 19.1 19.8 79 79 A G H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.874 105.0 53.2 -62.2 -43.0 9.2 16.4 17.4 80 80 A V H X S+ 0 0 5 -4,-1.8 4,-1.7 1,-0.2 -1,-0.2 0.969 112.5 44.9 -55.6 -52.8 7.9 13.6 19.6 81 81 A W H X S+ 0 0 36 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.882 110.3 54.9 -59.3 -42.6 4.5 15.3 19.6 82 82 A F H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.918 104.3 54.5 -56.9 -46.1 4.6 15.9 15.8 83 83 A A H X S+ 0 0 0 -4,-2.5 4,-1.2 1,-0.2 -1,-0.2 0.930 111.0 44.5 -56.0 -46.7 5.2 12.2 15.2 84 84 A K H X S+ 0 0 15 -4,-1.7 4,-1.6 1,-0.2 3,-0.3 0.902 111.3 54.0 -66.2 -39.6 2.1 11.3 17.1 85 85 A K H X S+ 0 0 42 -4,-2.4 4,-2.8 1,-0.2 5,-0.2 0.868 102.8 57.0 -63.0 -36.7 0.0 14.1 15.5 86 86 A F H X S+ 0 0 0 -4,-2.4 4,-0.8 1,-0.2 -1,-0.2 0.872 110.1 45.3 -63.4 -36.3 1.0 12.8 12.0 87 87 A T H < S+ 0 0 12 -4,-1.2 -1,-0.2 -3,-0.3 -2,-0.2 0.788 114.9 48.8 -77.7 -28.3 -0.5 9.4 12.9 88 88 A E H < S+ 0 0 100 -4,-1.6 -2,-0.2 1,-0.2 -3,-0.2 0.930 112.9 42.8 -76.2 -47.9 -3.6 11.0 14.4 89 89 A N H >X S+ 0 0 25 -4,-2.8 4,-2.0 3,-0.1 3,-1.6 0.617 83.1 105.2 -78.6 -15.1 -4.6 13.4 11.7 90 90 A Y T 3< S+ 0 0 65 -4,-0.8 -58,-0.0 1,-0.3 7,-0.0 -0.571 97.8 13.3 -67.5 127.2 -4.1 11.1 8.7 91 91 A G T 34 S+ 0 0 53 -2,-0.4 -1,-0.3 2,-0.3 -2,-0.1 0.134 129.7 62.8 91.0 -19.5 -7.6 10.2 7.6 92 92 A Q T <4 S+ 0 0 152 -3,-1.6 -2,-0.2 1,-0.2 -3,-0.1 0.872 89.8 53.0-102.5 -62.5 -8.9 12.9 9.9 93 93 A N S X S- 0 0 48 -4,-2.0 4,-2.7 1,-0.1 -2,-0.3 -0.758 71.8-144.6 -84.8 123.0 -7.8 16.5 8.8 94 94 A P H > S+ 0 0 96 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.847 95.6 43.9 -48.5 -51.9 -8.6 17.2 5.1 95 95 A S H > S+ 0 0 34 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.936 114.9 48.4 -68.1 -43.9 -5.5 19.3 4.3 96 96 A F H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.899 110.1 51.1 -64.3 -39.0 -3.1 17.0 6.1 97 97 A T H X S+ 0 0 31 -4,-2.7 4,-1.1 -8,-0.2 -1,-0.2 0.893 108.6 54.3 -64.5 -33.6 -4.5 13.9 4.5 98 98 A A H X S+ 0 0 49 -4,-1.8 4,-0.5 -5,-0.2 3,-0.4 0.934 109.5 46.1 -63.8 -46.7 -4.0 15.7 1.1 99 99 A I H >X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 3,-1.0 0.928 114.9 46.5 -63.4 -42.5 -0.4 16.4 1.8 100 100 A L H 3< S+ 0 0 0 -4,-2.5 -46,-0.6 1,-0.2 -1,-0.2 0.622 105.4 60.4 -76.5 -14.6 0.4 12.8 3.0 101 101 A D H 3< S+ 0 0 69 -4,-1.1 -1,-0.2 -3,-0.4 -2,-0.2 0.561 121.5 24.2 -85.7 -8.4 -1.5 11.3 0.1 102 102 A S H << S+ 0 0 68 -3,-1.0 2,-0.3 -4,-0.5 -2,-0.2 0.548 124.3 40.1-128.6 -15.3 1.0 13.0 -2.3 103 103 A M < - 0 0 7 -4,-2.3 2,-0.3 -5,-0.2 -49,-0.3 -0.914 66.1-131.9-136.8 159.1 4.1 13.6 -0.3 104 104 A D E - c 0 61A 6 -44,-1.5 -42,-1.8 -2,-0.3 2,-0.4 -0.762 17.5-144.0-106.4 155.9 6.3 11.9 2.3 105 105 A I E -Bc 52 62A 0 -53,-2.2 -53,-3.2 -2,-0.3 2,-0.5 -0.989 6.4-160.5-123.5 130.0 7.5 13.5 5.5 106 106 A F E -Bc 51 63A 7 -44,-3.3 -42,-2.0 -2,-0.4 2,-0.5 -0.948 11.3-172.0-109.9 128.0 11.0 12.8 7.0 107 107 A L E -Bc 50 64A 1 -57,-2.3 -57,-2.0 -2,-0.5 2,-0.9 -0.941 12.7-167.9-128.1 110.4 11.3 13.7 10.7 108 108 A E E - c 0 65A 0 -44,-2.7 -42,-2.8 -2,-0.5 3,-0.4 -0.826 9.1-179.1 -98.8 101.1 14.6 13.5 12.5 109 109 A I S S+ 0 0 0 -2,-0.9 2,-0.4 1,-0.3 -30,-0.2 0.847 76.6 26.4 -68.6 -44.6 13.7 13.9 16.2 110 110 A V + 0 0 2 -62,-0.4 -62,-0.3 1,-0.1 -1,-0.3 -0.799 66.1 169.7-124.1 87.0 17.2 13.8 17.8 111 111 A T S S+ 0 0 0 -45,-2.2 -43,-0.2 -2,-0.4 -44,-0.1 0.803 78.9 43.5 -68.6 -26.4 19.6 15.1 15.2 112 112 A N > + 0 0 1 -45,-0.5 4,-2.0 -46,-0.2 -1,-0.3 -0.768 68.3 170.3-123.6 81.9 22.4 15.3 17.7 113 113 A P H > S+ 0 0 0 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.896 76.1 48.6 -59.3 -47.8 22.2 12.0 19.8 114 114 A N H > S+ 0 0 2 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.952 112.5 46.7 -61.3 -53.6 25.6 12.4 21.6 115 115 A G H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.902 112.1 52.2 -57.0 -41.6 24.9 16.0 22.7 116 116 A F H X S+ 0 0 5 -4,-2.0 4,-0.8 2,-0.2 3,-0.3 0.949 109.7 47.3 -60.5 -51.6 21.4 15.1 23.8 117 117 A A H >X S+ 0 0 21 -4,-2.5 3,-1.3 1,-0.2 4,-0.9 0.927 110.8 54.2 -54.8 -43.0 22.6 12.2 26.0 118 118 A F H >X>S+ 0 0 40 -4,-2.6 4,-2.7 1,-0.3 5,-1.2 0.862 102.1 57.0 -61.4 -35.9 25.3 14.6 27.4 119 119 A T H 3<5S+ 0 0 6 -4,-2.0 -1,-0.3 -3,-0.3 -2,-0.2 0.685 107.1 51.2 -71.4 -15.0 22.6 17.2 28.3 120 120 A H H <<5S+ 0 0 62 -3,-1.3 -1,-0.2 -4,-0.8 -2,-0.2 0.633 125.8 18.5 -94.3 -17.1 20.9 14.5 30.5 121 121 A S H <<5S+ 0 0 81 -4,-0.9 -2,-0.2 -3,-0.7 -3,-0.2 0.642 134.6 13.7-126.9 -21.7 23.9 13.4 32.4 122 122 A E T <5S+ 0 0 133 -4,-2.7 2,-0.5 -5,-0.3 -3,-0.2 0.719 122.0 10.4-120.3 -70.1 26.6 16.0 32.3 123 123 A N > < - 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