==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 05-OCT-12 4BD9 . COMPND 2 MOLECULE: CARBOXYPEPTIDASE A4; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.ALONSO-DEL-RIBERO,M.L.REYTOR,S.A.TREJO,M.A.CHAVEZ,F.X.AVIL . 469 2 10 10 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19994.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 300 64.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 29 6.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 49 10.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 42 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 113 24.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 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 1 0 1 1 2 2 0 0 0 1 1 0 2 0 0 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 1 1 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 PARALLEL BRIDGES PER LADDER . 4 0 2 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 3 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 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 5 A N 0 0 209 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 35.1 75.0 -38.7 -31.0 2 6 A F - 0 0 33 1,-0.1 2,-1.3 14,-0.1 3,-0.0 -0.599 360.0-129.8 -71.1 117.6 74.3 -35.1 -30.1 3 7 A N > - 0 0 98 -2,-0.5 3,-1.2 1,-0.2 -1,-0.1 -0.555 25.5-177.3 -71.8 94.3 76.8 -33.9 -27.5 4 8 A Y T 3 S+ 0 0 35 -2,-1.3 -1,-0.2 1,-0.3 73,-0.1 0.508 79.1 66.8 -69.0 -3.0 74.7 -32.4 -24.8 5 9 A G T 3 S+ 0 0 20 277,-0.1 2,-0.3 2,-0.1 -1,-0.3 -0.030 94.8 70.1-105.3 27.8 77.9 -31.5 -23.0 6 10 A A S < S- 0 0 26 -3,-1.2 2,-0.3 67,-0.1 -4,-0.0 -0.964 85.2-112.6-137.6 154.4 79.0 -29.0 -25.7 7 11 A Y - 0 0 49 -2,-0.3 2,-0.3 65,-0.0 -2,-0.1 -0.725 42.1-156.5 -83.5 140.2 77.7 -25.6 -26.8 8 12 A H - 0 0 39 -2,-0.3 108,-0.0 1,-0.1 65,-0.0 -0.855 17.3-103.9-124.4 157.7 76.1 -25.7 -30.3 9 13 A S > - 0 0 54 -2,-0.3 4,-2.1 1,-0.1 5,-0.2 -0.233 40.2-110.0 -60.2 156.6 75.3 -23.6 -33.3 10 14 A L H > S+ 0 0 14 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.896 120.6 58.0 -54.2 -44.1 71.7 -22.5 -33.8 11 15 A E H > S+ 0 0 164 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.963 107.3 46.0 -52.3 -53.4 71.7 -24.9 -36.8 12 16 A A H > S+ 0 0 28 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.892 112.7 50.3 -59.7 -40.9 72.6 -27.9 -34.6 13 17 A I H X S+ 0 0 4 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.910 110.4 48.0 -65.9 -43.2 70.1 -27.0 -32.0 14 18 A Y H X S+ 0 0 23 -4,-2.7 4,-1.2 2,-0.2 -1,-0.2 0.918 113.7 49.2 -62.9 -41.5 67.2 -26.6 -34.4 15 19 A H H >X S+ 0 0 110 -4,-2.5 4,-2.4 -5,-0.3 3,-0.6 0.937 109.0 50.7 -64.0 -45.9 68.2 -29.9 -36.0 16 20 A E H 3X S+ 0 0 11 -4,-2.8 4,-2.4 1,-0.3 -1,-0.2 0.844 106.6 55.8 -62.4 -34.1 68.4 -31.7 -32.6 17 21 A M H 3X S+ 0 0 0 -4,-1.9 4,-1.6 2,-0.2 -1,-0.3 0.818 107.4 50.8 -62.4 -33.1 64.9 -30.4 -31.8 18 22 A D H X + 0 0 52 -4,-0.8 4,-3.2 -5,-0.2 3,-2.8 -0.254 63.0 152.3-142.0 53.5 58.8 -39.3 -30.2 25 29 A P T 34 S+ 0 0 102 0, 0.0 -2,-0.1 0, 0.0 -3,-0.1 0.725 78.1 62.0 -59.5 -21.5 56.1 -38.2 -32.7 26 30 A D T 34 S+ 0 0 109 1,-0.1 3,-0.1 -3,-0.1 -5,-0.1 0.767 122.4 15.0 -68.4 -29.8 53.7 -39.5 -30.1 27 31 A L T <4 S+ 0 0 7 -3,-2.8 21,-2.4 1,-0.2 2,-0.4 0.733 118.0 52.5-122.5 -36.0 54.9 -37.0 -27.5 28 32 A A E < -A 47 0A 5 -4,-3.2 2,-0.4 -7,-0.2 19,-0.2 -0.924 49.1-178.3-121.3 135.9 56.9 -34.1 -29.0 29 33 A R E -A 46 0A 144 17,-2.3 17,-2.5 -2,-0.4 2,-0.8 -0.983 23.9-137.2-132.8 124.8 56.2 -31.7 -31.9 30 34 A R E -A 45 0A 59 -2,-0.4 2,-0.4 15,-0.2 15,-0.2 -0.685 31.4-173.9 -75.0 110.3 58.5 -28.9 -33.3 31 35 A V E -A 44 0A 24 13,-3.0 13,-3.1 -2,-0.8 2,-0.6 -0.898 21.6-139.0-109.9 134.2 56.1 -26.0 -33.8 32 36 A K E +A 43 0A 118 -2,-0.4 11,-0.2 11,-0.2 3,-0.1 -0.836 21.3 178.0 -88.6 121.5 57.1 -22.7 -35.5 33 37 A I E - 0 0 23 9,-2.4 2,-0.3 -2,-0.6 -1,-0.1 0.478 58.4 -50.9-103.6 -2.4 55.5 -19.8 -33.6 34 38 A G E -A 42 0A 15 8,-0.7 8,-2.9 144,-0.0 2,-0.3 -0.982 59.8 -83.9 162.0-164.5 56.9 -17.0 -35.5 35 39 A H E -A 41 0A 73 -2,-0.3 139,-0.2 6,-0.3 2,-0.1 -0.903 30.3-116.7-136.8 162.2 60.1 -15.4 -37.0 36 40 A S > - 0 0 0 4,-2.3 3,-2.3 -2,-0.3 6,-0.1 -0.326 43.4 -90.6 -91.2 176.2 63.0 -13.2 -35.7 37 41 A F T 3 S+ 0 0 83 1,-0.3 91,-0.1 2,-0.1 -1,-0.1 0.874 132.3 46.9 -54.8 -38.5 63.9 -9.7 -37.0 38 42 A E T 3 S- 0 0 75 2,-0.0 -1,-0.3 89,-0.0 89,-0.0 0.174 125.4-105.7 -93.0 17.1 66.3 -11.3 -39.5 39 43 A N < + 0 0 120 -3,-2.3 -2,-0.1 1,-0.2 3,-0.0 0.603 68.1 147.8 72.0 18.0 63.5 -13.8 -40.5 40 44 A R - 0 0 71 1,-0.1 -4,-2.3 -5,-0.0 -1,-0.2 -0.542 54.4-102.4 -73.7 146.0 64.8 -16.9 -38.8 41 45 A P E -A 35 0A 33 0, 0.0 2,-0.7 0, 0.0 -6,-0.3 -0.447 22.3-137.2 -67.2 146.5 62.1 -19.3 -37.5 42 46 A M E -A 34 0A 0 -8,-2.9 -9,-2.4 -2,-0.1 -8,-0.7 -0.932 28.6-163.5-100.0 111.6 61.2 -19.3 -33.8 43 47 A Y E -A 32 0A 43 -2,-0.7 63,-0.4 -11,-0.2 2,-0.4 -0.822 12.3-175.6-103.0 132.5 60.9 -23.0 -32.9 44 48 A V E -A 31 0A 0 -13,-3.1 -13,-3.0 -2,-0.5 2,-0.6 -0.921 22.1-134.2-112.6 149.8 59.2 -24.5 -29.8 45 49 A L E -AB 30 103A 0 58,-2.2 58,-3.0 -2,-0.4 2,-0.5 -0.922 20.7-156.2 -93.5 125.1 59.0 -28.1 -28.8 46 50 A K E -AB 29 102A 35 -17,-2.5 -17,-2.3 -2,-0.6 2,-0.5 -0.908 4.8-163.6-100.9 126.6 55.5 -29.0 -27.6 47 51 A F E +AB 28 101A 0 54,-2.6 54,-2.4 -2,-0.5 2,-0.3 -0.960 28.4 139.5-111.9 128.1 55.3 -31.9 -25.3 48 52 A S - 0 0 17 -21,-2.4 52,-0.1 -2,-0.5 49,-0.1 -0.996 48.1-163.7-165.1 158.2 51.8 -33.4 -24.9 49 53 A T S S+ 0 0 25 47,-0.4 -22,-0.1 -2,-0.3 -1,-0.1 0.053 71.2 99.8-129.9 19.0 49.5 -36.4 -24.6 50 54 A G S > S- 0 0 11 3,-0.1 3,-1.9 1,-0.0 50,-0.0 -0.003 83.2-124.4-109.5 27.9 46.3 -34.5 -25.4 51 55 A K T 3 S- 0 0 202 1,-0.3 -1,-0.0 -3,-0.1 -3,-0.0 0.611 72.1 -53.4 46.8 20.8 45.6 -35.3 -29.1 52 56 A G T 3 S+ 0 0 66 1,-0.4 -1,-0.3 0, 0.0 2,-0.3 0.531 101.0 116.1 101.0 7.1 45.5 -31.7 -30.2 53 57 A V S < S- 0 0 101 -3,-1.9 2,-0.5 1,-0.0 -1,-0.4 -0.694 77.2 -87.8 -96.3 160.4 43.0 -29.9 -28.0 54 58 A R + 0 0 164 -2,-0.3 3,-0.0 128,-0.1 -1,-0.0 -0.565 52.0 175.9 -72.2 116.6 44.1 -27.0 -25.7 55 59 A R - 0 0 48 -2,-0.5 2,-0.2 1,-0.1 129,-0.2 -0.545 44.9 -79.4-104.2 175.8 45.2 -28.3 -22.3 56 60 A P - 0 0 28 0, 0.0 44,-2.2 0, 0.0 2,-0.3 -0.610 62.5-176.1 -71.8 144.3 46.6 -26.4 -19.4 57 61 A A E -cd 100 185A 0 127,-1.5 129,-3.1 42,-0.2 130,-0.9 -0.972 27.5-136.2-143.6 156.6 50.3 -25.8 -20.2 58 62 A V E -cd 101 187A 1 42,-2.1 44,-2.4 -2,-0.3 2,-0.6 -0.938 20.6-138.0-112.2 138.9 53.5 -24.3 -18.8 59 63 A W E -cd 102 188A 0 128,-3.4 130,-2.9 -2,-0.4 2,-0.6 -0.844 11.4-163.5 -96.0 122.5 55.9 -22.2 -20.9 60 64 A L E -cd 103 189A 2 42,-3.6 44,-3.1 -2,-0.6 2,-0.4 -0.938 13.7-169.2-106.2 117.0 59.6 -22.8 -20.6 61 65 A N E +cd 104 190A 1 128,-3.4 130,-3.4 -2,-0.6 2,-0.3 -0.857 11.7 163.0-112.3 134.0 61.5 -19.9 -22.0 62 66 A A E + d 0 191A 0 42,-1.8 45,-2.6 -2,-0.4 46,-0.2 -0.982 50.5 27.8-145.1 159.7 65.3 -19.8 -22.7 63 67 A G + 0 0 1 128,-0.6 45,-0.6 -2,-0.3 49,-0.1 0.711 60.1 138.7 67.0 23.0 67.9 -17.8 -24.6 64 68 A I S S+ 0 0 5 127,-0.5 2,-0.6 43,-0.2 76,-0.1 0.879 75.4 51.0 -64.2 -32.0 66.1 -14.5 -24.6 65 69 A H S > S- 0 0 2 1,-0.1 3,-1.5 3,-0.1 -1,-0.2 -0.919 86.3-149.9-106.3 117.1 69.5 -13.0 -23.9 66 70 A S T 3 S+ 0 0 0 57,-0.8 57,-0.2 -2,-0.6 -1,-0.1 0.794 88.1 55.0 -66.4 -33.6 71.9 -14.4 -26.4 67 71 A R T 3 S+ 0 0 2 55,-1.2 2,-2.2 54,-0.3 -1,-0.3 0.618 83.4 90.5 -73.6 -10.9 75.2 -14.4 -24.5 68 72 A E X> + 0 0 1 -3,-1.5 3,-1.9 1,-0.2 4,-0.6 -0.363 53.8 165.3 -85.4 62.0 73.6 -16.5 -21.7 69 73 A W H 3> + 0 0 17 -2,-2.2 4,-2.3 206,-0.3 3,-0.3 0.721 64.1 65.2 -56.0 -31.5 74.6 -19.8 -23.4 70 74 A I H 3> S+ 0 0 2 205,-0.2 4,-2.6 1,-0.2 -1,-0.3 0.828 97.2 61.5 -62.9 -29.4 74.0 -22.1 -20.4 71 75 A S H <> S+ 0 0 0 -3,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.915 108.0 38.2 -58.5 -52.1 70.4 -21.1 -20.8 72 76 A Q H X S+ 0 0 0 -4,-0.6 4,-2.0 -3,-0.3 -2,-0.2 0.884 116.7 52.5 -71.2 -39.6 70.0 -22.6 -24.4 73 77 A A H X S+ 0 0 10 -4,-2.3 4,-1.3 1,-0.2 -2,-0.2 0.896 111.5 46.1 -64.8 -40.8 72.2 -25.6 -23.6 74 78 A T H X S+ 0 0 0 -4,-2.6 4,-2.1 -5,-0.2 -1,-0.2 0.904 110.6 54.7 -64.8 -42.8 70.1 -26.4 -20.5 75 79 A A H X S+ 0 0 1 -4,-1.9 4,-1.2 1,-0.2 -2,-0.2 0.881 109.5 45.2 -62.9 -37.9 66.9 -25.9 -22.5 76 80 A I H X S+ 0 0 4 -4,-2.0 4,-1.5 2,-0.2 -1,-0.2 0.787 111.1 52.1 -81.2 -23.4 67.8 -28.4 -25.2 77 81 A W H X S+ 0 0 23 -4,-1.3 4,-2.5 2,-0.2 -2,-0.2 0.864 107.8 54.8 -72.1 -36.1 69.1 -31.0 -22.7 78 82 A T H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.791 101.3 57.2 -67.5 -31.7 65.8 -30.6 -21.0 79 83 A A H X S+ 0 0 0 -4,-1.2 4,-1.6 2,-0.2 -1,-0.2 0.976 112.4 41.0 -58.6 -55.5 64.0 -31.4 -24.2 80 84 A R H X S+ 0 0 50 -4,-1.5 4,-2.4 1,-0.2 -2,-0.2 0.859 112.8 56.3 -60.1 -37.7 65.8 -34.7 -24.4 81 85 A K H X S+ 0 0 43 -4,-2.5 4,-1.1 1,-0.2 -1,-0.2 0.923 104.5 52.1 -62.2 -44.9 65.3 -35.2 -20.6 82 86 A I H < S+ 0 0 0 -4,-2.4 4,-0.4 1,-0.2 3,-0.2 0.902 115.0 39.6 -61.8 -43.7 61.5 -34.9 -20.9 83 87 A V H >< S+ 0 0 4 -4,-1.6 3,-0.9 1,-0.2 -1,-0.2 0.901 113.3 54.8 -72.8 -38.5 61.2 -37.5 -23.7 84 88 A S H 3< S+ 0 0 55 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.668 114.8 39.6 -69.8 -17.4 63.8 -39.9 -22.2 85 89 A D T >X S+ 0 0 34 -4,-1.1 3,-1.8 -3,-0.2 4,-1.6 0.335 80.4 122.1-117.4 2.8 62.0 -40.0 -18.9 86 90 A Y T <4 S+ 0 0 34 -3,-0.9 -3,-0.0 -4,-0.4 -59,-0.0 -0.562 92.2 5.5 -65.4 128.9 58.4 -40.1 -20.0 87 91 A Q T 34 S+ 0 0 141 2,-0.4 -1,-0.3 -2,-0.3 -4,-0.0 0.802 125.9 70.7 60.4 31.5 57.0 -43.3 -18.6 88 92 A R T <4 S+ 0 0 206 -3,-1.8 -2,-0.2 1,-0.3 -1,-0.1 0.284 95.2 50.6-142.4 -12.2 60.2 -44.0 -16.6 89 93 A D X - 0 0 37 -4,-1.6 4,-2.0 1,-0.1 -2,-0.4 -0.968 68.4-151.5-132.8 115.8 59.9 -41.2 -14.1 90 94 A P H > S+ 0 0 105 0, 0.0 4,-1.3 0, 0.0 5,-0.1 0.772 92.7 64.7 -52.7 -28.3 56.6 -40.8 -12.1 91 95 A A H > S+ 0 0 14 2,-0.2 4,-1.6 3,-0.1 3,-0.1 0.978 112.1 23.6 -67.0 -64.1 57.4 -37.1 -11.9 92 96 A I H > S+ 0 0 0 1,-0.2 4,-3.9 2,-0.2 5,-0.3 0.932 119.4 61.4 -67.9 -45.3 57.2 -35.9 -15.5 93 97 A T H X S+ 0 0 32 -4,-2.0 4,-1.3 -8,-0.4 -1,-0.2 0.827 108.0 45.0 -48.8 -36.5 55.0 -38.7 -16.6 94 98 A S H X S+ 0 0 36 -4,-1.3 4,-0.9 -5,-0.3 -1,-0.3 0.848 114.6 47.7 -79.1 -37.1 52.5 -37.4 -14.1 95 99 A I H >X S+ 0 0 0 -4,-1.6 4,-2.6 2,-0.2 3,-0.8 0.947 110.6 51.6 -62.7 -51.0 52.9 -33.8 -15.2 96 100 A L H 3< S+ 0 0 0 -4,-3.9 -47,-0.4 1,-0.3 -2,-0.2 0.866 104.2 57.2 -58.8 -38.0 52.7 -34.7 -18.9 97 101 A E H 3< S+ 0 0 105 -4,-1.3 -1,-0.3 -5,-0.3 -2,-0.2 0.829 116.0 36.6 -62.2 -32.7 49.4 -36.6 -18.4 98 102 A K H << S+ 0 0 113 -4,-0.9 2,-0.3 -3,-0.8 -2,-0.2 0.808 126.2 11.1 -87.5 -34.1 47.8 -33.5 -16.9 99 103 A M < - 0 0 0 -4,-2.6 2,-0.3 -44,-0.1 -42,-0.2 -0.943 66.9-106.0-151.5 163.0 49.4 -30.8 -19.0 100 104 A D E - c 0 57A 0 -44,-2.2 -42,-2.1 -2,-0.3 2,-0.6 -0.662 23.2-147.0 -92.6 144.5 51.4 -29.7 -22.0 101 105 A I E -Bc 47 58A 0 -54,-2.4 -54,-2.6 -2,-0.3 2,-0.6 -0.950 7.8-164.7-114.2 117.3 55.0 -28.4 -21.9 102 106 A F E -Bc 46 59A 5 -44,-2.4 -42,-3.6 -2,-0.6 2,-0.6 -0.892 9.6-168.1 -98.2 119.8 56.0 -25.7 -24.4 103 107 A L E -Bc 45 60A 2 -58,-3.0 -58,-2.2 -2,-0.6 -42,-0.2 -0.910 13.1-175.4-117.2 112.5 59.8 -25.3 -24.6 104 108 A L E + c 0 61A 0 -44,-3.1 -42,-1.8 -2,-0.6 3,-0.4 -0.819 5.1 177.8-104.2 94.1 61.5 -22.4 -26.4 105 109 A P S S+ 0 0 1 0, 0.0 2,-0.3 0, 0.0 -30,-0.2 0.794 76.7 31.0 -71.3 -28.1 65.3 -23.1 -26.3 106 110 A V + 0 0 1 -63,-0.4 -43,-0.2 1,-0.1 -63,-0.2 -0.744 59.5 169.2-132.6 87.5 66.3 -20.0 -28.3 107 111 A A S S+ 0 0 5 -45,-2.6 -43,-0.2 -3,-0.4 -44,-0.2 0.570 82.9 40.5 -72.0 -7.9 64.0 -17.1 -27.8 108 112 A N > + 0 0 0 -45,-0.6 4,-2.1 -46,-0.2 -1,-0.3 -0.601 65.4 166.5-144.0 72.2 66.5 -14.8 -29.6 109 113 A P H > S+ 0 0 0 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.847 75.7 53.4 -59.9 -41.1 67.9 -16.6 -32.6 110 114 A D H > S+ 0 0 1 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.937 111.3 45.6 -64.7 -45.5 69.5 -13.6 -34.3 111 115 A G H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.900 110.2 56.2 -62.2 -38.5 71.4 -12.6 -31.1 112 116 A Y H X S+ 0 0 3 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.949 108.6 44.3 -61.7 -51.8 72.5 -16.2 -30.6 113 117 A V H X S+ 0 0 32 -4,-2.3 4,-2.0 1,-0.2 5,-0.3 0.888 111.1 57.2 -55.7 -39.2 74.1 -16.5 -34.1 114 118 A Y H X>S+ 0 0 35 -4,-2.0 5,-2.4 -5,-0.2 4,-2.4 0.891 106.6 48.1 -64.3 -35.3 75.6 -13.1 -33.4 115 119 A T H <5S+ 0 0 0 -4,-2.2 303,-1.6 3,-0.2 -1,-0.2 0.865 112.4 49.8 -69.6 -32.1 77.3 -14.4 -30.2 116 120 A Q H <5S+ 0 0 35 -4,-1.8 303,-1.2 301,-0.2 -2,-0.2 0.854 127.7 20.0 -73.5 -34.5 78.6 -17.4 -32.0 117 121 A T H <5S+ 0 0 61 -4,-2.0 -2,-0.2 300,-0.2 -3,-0.2 0.600 136.1 11.2-114.4 -19.5 80.1 -15.6 -35.0 118 122 A Q T <5S+ 0 0 104 -4,-2.4 2,-0.3 -5,-0.3 -3,-0.2 0.712 120.9 15.3-131.5 -43.4 80.7 -11.9 -34.0 119 123 A N > < - 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0 0 11 24,-0.2 27,-0.1 23,-0.2 -1,-0.1 -0.138 25.1 -77.6 86.1 169.0 92.7 -32.9 -32.1 428 123 B P S S+ 0 0 60 0, 0.0 -1,-0.1 0, 0.0 26,-0.1 0.821 96.0 97.0 -71.5 -36.4 93.2 -36.8 -32.1 429 124 B i S S- 0 0 54 24,-0.4 23,-0.1 1,-0.1 24,-0.1 -0.059 72.1-131.0 -68.2 158.5 95.9 -36.9 -34.9 430 125 B K + 0 0 195 2,-0.1 22,-0.1 22,-0.1 -1,-0.1 0.266 64.3 116.6-100.2 16.2 99.6 -37.1 -34.2 431 126 B G - 0 0 34 20,-1.3 2,-0.3 1,-0.0 21,-0.1 -0.018 57.4-136.2 -67.1 177.5 100.9 -34.4 -36.5 432 127 B S + 0 0 87 19,-0.1 19,-0.2 2,-0.0 -2,-0.1 -0.794 31.1 161.9-143.2 101.9 102.6 -31.3 -35.3 433 128 B F E -N 450 0F 92 17,-1.7 17,-2.8 -2,-0.3 2,-0.7 -0.973 39.4-128.8-119.8 114.5 101.6 -28.0 -36.9 434 129 B P E +N 449 0F 76 0, 0.0 2,-0.3 0, 0.0 15,-0.2 -0.519 44.0 166.5 -60.3 108.7 102.4 -24.8 -35.1 435 130 B R E -N 448 0F 58 13,-1.6 13,-2.6 -2,-0.7 2,-0.3 -0.892 28.5-129.4-120.5 155.0 99.0 -23.1 -35.1 436 131 B Y E -NO 447 460F 63 24,-3.6 24,-2.8 -2,-0.3 2,-0.3 -0.786 22.7-179.0-101.8 152.5 97.8 -20.1 -33.1 437 132 B Y E -N 446 0F 18 9,-2.3 9,-2.9 -2,-0.3 2,-0.5 -0.985 32.2-107.4-142.2 154.8 94.7 -19.7 -31.0 438 133 B Y E -N 445 0F 16 -2,-0.3 2,-0.7 7,-0.3 7,-0.2 -0.724 27.4-164.6 -82.5 123.8 93.1 -17.0 -28.9 439 134 B D E >> -N 444 0F 29 5,-2.7 4,-1.7 -2,-0.5 5,-1.4 -0.922 3.3-167.5-107.9 106.8 93.4 -17.6 -25.1 440 135 B Y T 45S+ 0 0 52 -2,-0.7 -1,-0.1 -20,-0.3 -19,-0.1 0.845 84.2 60.6 -68.4 -31.7 91.0 -15.3 -23.3 441 136 B E T 45S+ 0 0 139 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 0.946 117.4 31.7 -54.6 -49.3 92.5 -15.9 -19.9 442 137 B D T 45S- 0 0 91 2,-0.2 -1,-0.2 -3,-0.1 -2,-0.2 0.692 103.5-135.5 -80.5 -19.8 95.9 -14.6 -21.1 443 138 B G T <5 + 0 0 38 -4,-1.7 2,-0.3 1,-0.2 -3,-0.2 0.771 68.6 105.0 66.7 27.5 94.1 -12.2 -23.4 444 139 B E E S- 0 0 62 1,-0.1 4,-1.6 -26,-0.1 -26,-0.2 -0.769 77.2-114.2-125.4 175.7 99.7 -17.3 -38.1 463 158 B K H > S+ 0 0 96 -2,-0.2 4,-3.0 2,-0.2 5,-0.3 0.942 116.2 48.2 -74.5 -48.8 99.5 -14.9 -35.1 464 159 B E H > S+ 0 0 128 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.770 109.9 56.0 -65.4 -22.5 98.2 -11.9 -37.1 465 160 B S H > S+ 0 0 46 2,-0.2 4,-1.6 3,-0.1 -1,-0.2 0.926 109.3 46.0 -66.7 -49.6 95.6 -14.3 -38.6 466 161 B j H X S+ 0 0 0 -4,-1.6 4,-3.2 1,-0.2 3,-0.4 0.956 114.7 45.4 -58.6 -52.1 94.5 -15.2 -35.1 467 162 B E H < S+ 0 0 104 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.709 107.7 59.9 -72.4 -14.8 94.3 -11.6 -33.9 468 163 B N H < S+ 0 0 136 -4,-0.9 -1,-0.2 -5,-0.3 -2,-0.2 0.873 117.5 30.0 -72.9 -38.2 92.6 -10.6 -37.1 469 164 B A H < 0 0 35 -4,-1.6 -2,-0.2 -3,-0.4 -3,-0.1 0.829 360.0 360.0 -84.0 -37.0 89.7 -12.9 -36.3 470 165 B h < 0 0 15 -4,-3.2 -1,-0.2 -5,-0.2 -2,-0.1 -0.639 360.0 360.0-124.3 360.0 90.0 -12.8 -32.6