==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 16-AUG-12 4B75 . COMPND 2 MOLECULE: NON-STRUCTURAL PROTEIN 4A, SERINE PROTEASE NS3; . SOURCE 2 ORGANISM_SCIENTIFIC: HEPATITIS C VIRUS (ISOLATE BK); . AUTHOR S.M.SAALAU-BETHELL,A.J.WOODHEAD,G.CHESSARI,M.G.CARR,J.COYLE, . 1287 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 52261.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 858 66.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 146 11.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 186 14.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 7 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 15 1.2 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 . 101 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 111 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 253 19.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 19 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 5 0 2 1 5 6 2 0 1 9 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 16 2 2 10 6 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 . 3 4 12 3 10 0 1 3 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 . 2 5 1 0 2 2 1 3 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 1 705 A G 0 0 70 0, 0.0 34,-0.2 0, 0.0 76,-0.2 0.000 360.0 360.0 360.0 118.6 16.4 32.1 -36.3 2 706 A S - 0 0 6 32,-2.6 2,-0.3 31,-0.1 76,-0.2 -0.463 360.0-104.0 -81.3 157.6 14.8 32.8 -39.7 3 707 A V B -a 78 0A 0 74,-3.3 76,-3.0 -2,-0.1 2,-0.4 -0.672 42.4-150.6 -75.7 142.5 14.8 30.5 -42.7 4 708 A V E -D 51 0B 0 47,-2.4 47,-1.9 -2,-0.3 2,-0.6 -0.969 15.6-127.3-127.1 130.9 17.3 31.6 -45.3 5 709 A I E +D 50 0B 9 -2,-0.4 45,-0.2 74,-0.3 3,-0.1 -0.667 32.9 167.5 -70.0 114.4 17.5 31.3 -49.1 6 710 A V E - 0 0 20 43,-2.8 18,-2.1 -2,-0.6 19,-1.2 0.338 61.6 -28.4-111.1 -0.6 21.0 29.8 -49.8 7 711 A G E -DE 49 23B 2 42,-1.1 42,-2.8 16,-0.3 2,-0.3 -0.985 57.5-115.7 170.8-176.0 20.4 28.9 -53.4 8 712 A R E -DE 48 22B 16 14,-2.0 14,-2.3 -2,-0.3 2,-0.6 -0.981 11.5-134.6-147.6 155.6 17.9 28.0 -56.2 9 713 A I E -DE 47 21B 0 38,-2.4 38,-0.7 -2,-0.3 2,-0.4 -0.971 26.8-149.3-112.3 115.6 17.1 25.2 -58.5 10 714 A I E - E 0 20B 31 10,-2.8 10,-1.6 -2,-0.6 2,-0.3 -0.740 8.8-155.4 -90.0 128.6 16.5 26.5 -62.1 11 715 A L E - E 0 19B 23 -2,-0.4 8,-0.2 8,-0.2 2,-0.1 -0.783 21.4-112.2-102.1 144.8 14.1 24.6 -64.2 12 716 A S - 0 0 41 6,-2.4 3,-0.1 -2,-0.3 -1,-0.0 -0.421 17.7-156.2 -70.3 152.9 14.1 24.6 -68.0 13 717 A G S S+ 0 0 81 -2,-0.1 2,-0.3 4,-0.1 -1,-0.1 0.025 73.8 39.3-120.1 23.1 11.1 26.4 -69.6 14 718 A S S S+ 0 0 99 2,-0.3 -2,-0.0 1,-0.0 -1,-0.0 -0.964 101.4 10.6-166.2 157.0 11.3 24.5 -72.9 15 719 A G S S- 0 0 80 -2,-0.3 3,-0.1 2,-0.1 -1,-0.0 -0.098 112.7 -8.7 62.5-165.5 12.0 21.1 -74.2 16 720 A S S S- 0 0 103 1,-0.1 2,-0.7 -3,-0.0 -2,-0.3 0.583 90.6 -89.5 -77.2 144.2 12.3 18.1 -71.9 17 3 A I + 0 0 33 110,-0.1 2,-0.3 -4,-0.1 -1,-0.1 -0.860 61.3 157.8 -63.3 126.2 12.3 19.0 -67.9 18 4 A T - 0 0 78 -2,-0.7 -6,-2.4 -3,-0.1 2,-0.3 -0.945 18.0-164.9-136.7 159.8 15.9 19.6 -66.8 19 5 A A E -E 11 0B 23 106,-0.6 2,-0.3 -2,-0.3 -8,-0.2 -0.927 11.0-173.6-141.4 160.7 17.4 21.4 -63.8 20 6 A Y E -E 10 0B 92 -10,-1.6 -10,-2.8 -2,-0.3 2,-0.3 -0.970 21.1-127.0-148.9 156.7 20.5 22.9 -62.4 21 7 A S E -E 9 0B 35 -2,-0.3 989,-0.5 -12,-0.2 2,-0.3 -0.700 12.0-164.5-102.2 157.4 21.4 24.5 -59.1 22 8 A Q E -Ef 81010B 28 -14,-2.3 -14,-2.0 -2,-0.3 2,-0.5 -0.995 13.9-143.5-130.1 134.9 23.0 27.7 -58.0 23 9 A Q E +E 7 0B 83 987,-2.7 -16,-0.3 -2,-0.3 3,-0.1 -0.858 19.6 174.6 -93.8 130.3 24.5 28.5 -54.6 24 10 A T + 0 0 32 -18,-2.1 2,-0.3 -2,-0.5 -17,-0.2 0.441 61.8 34.3-108.8 -3.7 23.9 32.1 -53.5 25 11 A R - 0 0 31 -19,-1.2 -1,-0.2 4,-0.0 2,-0.1 -0.998 60.5-140.7-156.5 143.2 25.3 31.8 -49.9 26 12 A G > - 0 0 40 -2,-0.3 4,-2.8 -3,-0.1 5,-0.1 -0.391 46.7 -88.8 -91.2 178.9 27.9 30.2 -47.7 27 13 A L H > S+ 0 0 92 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.935 127.0 46.2 -54.7 -55.0 27.6 28.9 -44.1 28 14 A L H > S+ 0 0 48 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.882 111.8 50.9 -55.7 -44.9 28.5 32.3 -42.5 29 15 A G H > S+ 0 0 24 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.952 111.9 49.5 -56.3 -48.0 26.2 34.2 -44.9 30 16 A C H X S+ 0 0 6 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.945 111.2 46.8 -59.1 -54.8 23.4 31.8 -43.9 31 17 A I H X S+ 0 0 9 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.924 113.5 48.7 -54.2 -47.2 24.0 32.1 -40.2 32 18 A I H X S+ 0 0 70 -4,-2.7 4,-2.6 1,-0.2 6,-0.3 0.895 113.0 46.8 -65.4 -36.6 24.1 35.9 -40.3 33 19 A T H X S+ 0 0 11 -4,-2.3 4,-2.9 -5,-0.3 5,-0.4 0.892 109.9 52.8 -74.3 -37.3 21.0 36.2 -42.4 34 20 A S H < S+ 0 0 8 -4,-2.6 -32,-2.6 -5,-0.2 -2,-0.2 0.894 112.6 46.8 -60.4 -42.0 19.1 33.8 -40.2 35 21 A L H < S+ 0 0 112 -4,-2.3 -2,-0.2 -34,-0.2 -1,-0.2 0.954 122.7 32.2 -61.0 -56.5 20.1 35.9 -37.1 36 22 A T H < S- 0 0 75 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.784 91.1-144.0 -75.3 -26.1 19.1 39.3 -38.6 37 23 A G < + 0 0 0 -4,-2.9 43,-1.3 -5,-0.3 2,-0.5 0.697 60.5 125.5 65.3 21.3 16.3 38.0 -40.8 38 24 A R B -b 80 0A 133 -5,-0.4 2,-0.5 -6,-0.3 -1,-0.2 -0.957 40.3-172.2-122.5 121.0 17.4 40.5 -43.4 39 25 A D + 0 0 4 41,-3.6 43,-0.1 -2,-0.5 -6,-0.0 -0.844 13.6 177.6-124.8 92.9 18.2 39.4 -46.9 40 26 A K + 0 0 142 -2,-0.5 -1,-0.2 40,-0.1 40,-0.0 0.909 48.6 112.0 -47.7 -52.8 19.7 41.8 -49.4 41 27 A N S S- 0 0 60 1,-0.1 2,-0.3 -36,-0.1 -2,-0.1 0.236 72.9-116.5 -40.7 139.9 20.0 39.2 -52.3 42 28 A Q - 0 0 122 62,-0.0 2,-0.4 39,-0.0 -1,-0.1 -0.602 33.1-142.4 -64.9 134.5 18.0 39.3 -55.5 43 29 A V + 0 0 11 60,-0.6 2,-0.3 -2,-0.3 5,-0.0 -0.890 24.4 177.2-104.3 138.3 15.9 36.2 -55.5 44 30 A E + 0 0 95 -2,-0.4 61,-0.2 61,-0.1 60,-0.0 -0.844 35.3 26.0-132.4 168.4 15.3 34.4 -58.8 45 31 A G S S- 0 0 11 59,-0.3 61,-0.8 -2,-0.3 -35,-0.1 0.148 77.2 -95.0 65.1 175.6 13.6 31.2 -60.0 46 32 A E S S+ 0 0 37 -37,-0.3 15,-3.1 59,-0.2 2,-0.6 0.665 102.1 64.7-105.3 -26.0 10.7 29.3 -58.5 47 33 A V E -DG 9 60B 0 -38,-0.7 -38,-2.4 13,-0.2 2,-0.3 -0.913 68.5-165.2-105.8 120.0 12.5 26.6 -56.5 48 34 A Q E -DG 8 59B 2 11,-3.7 11,-2.4 -2,-0.6 2,-0.6 -0.799 17.1-138.2-105.5 144.7 14.5 27.9 -53.6 49 35 A V E -DG 7 58B 11 -42,-2.8 -43,-2.8 -2,-0.3 -42,-1.1 -0.910 33.8-172.0 -98.1 122.5 17.1 26.0 -51.6 50 36 A V E -DG 5 57B 1 7,-2.7 7,-2.9 -2,-0.6 2,-0.3 -0.806 11.5-172.3-123.5 158.1 16.6 26.9 -47.9 51 37 A S E -DG 4 56B 19 -47,-1.9 -47,-2.4 -2,-0.3 5,-0.2 -0.991 12.8-167.9-147.6 148.4 18.4 26.4 -44.7 52 38 A T - 0 0 4 3,-3.0 -49,-0.1 -2,-0.3 -21,-0.1 -0.444 52.8 -90.4-108.4-167.6 18.1 26.8 -41.0 53 39 A A S S+ 0 0 67 -2,-0.2 3,-0.1 1,-0.1 -22,-0.1 0.821 126.7 36.8 -72.2 -33.0 21.0 26.3 -38.6 54 40 A T S S+ 0 0 126 1,-0.2 2,-0.3 0, 0.0 -1,-0.1 0.599 124.0 7.4-101.1 -13.1 20.2 22.6 -38.2 55 41 A Q - 0 0 89 17,-0.1 -3,-3.0 2,-0.0 2,-0.4 -0.998 53.7-134.5-163.9 167.0 19.1 21.6 -41.7 56 42 A S E +G 51 0B 38 -2,-0.3 -5,-0.3 -5,-0.2 2,-0.2 -0.959 31.6 140.5-129.2 145.8 18.5 22.3 -45.4 57 43 A F E -G 50 0B 1 -7,-2.9 -7,-2.7 -2,-0.4 2,-0.3 -0.786 39.8 -80.7-158.7-159.0 15.6 21.7 -47.7 58 44 A L E -G 49 0B 0 95,-2.6 11,-0.4 -9,-0.2 2,-0.3 -0.802 20.7-165.8-120.7 159.6 13.6 23.1 -50.6 59 45 A A E -G 48 0B 0 -11,-2.4 -11,-3.7 -2,-0.3 2,-0.5 -0.985 9.5-155.6-141.9 142.2 10.8 25.6 -51.2 60 46 A T E -GH 47 67B 0 7,-1.8 7,-2.9 -2,-0.3 2,-0.5 -0.959 13.1-135.6-120.8 128.0 8.7 26.0 -54.3 61 47 A C E + H 0 66B 0 -15,-3.1 47,-2.9 -2,-0.5 2,-0.4 -0.716 29.0 170.8 -84.7 128.0 6.9 29.2 -55.2 62 48 A V E > -iH 108 65B 3 3,-3.2 3,-1.6 -2,-0.5 47,-0.2 -0.977 65.6 -12.2-140.8 122.2 3.4 28.6 -56.5 63 49 A N T 3 S- 0 0 57 45,-2.1 46,-0.1 -2,-0.4 3,-0.1 0.839 129.2 -48.7 57.4 42.6 0.9 31.4 -57.1 64 50 A G T 3 S+ 0 0 35 44,-0.3 37,-3.9 1,-0.2 2,-0.5 0.391 119.8 107.3 83.9 -3.9 2.9 34.1 -55.4 65 51 A V E < -HJ 62 100B 2 -3,-1.6 -3,-3.2 35,-0.3 2,-0.8 -0.931 63.8-144.1-110.6 125.8 3.4 31.9 -52.3 66 52 A C E -HJ 61 99B 2 33,-2.6 33,-2.2 -2,-0.5 -5,-0.3 -0.794 31.1-163.7 -81.7 109.8 6.8 30.3 -51.5 67 53 A W E +HJ 60 98B 1 -7,-2.9 -7,-1.8 -2,-0.8 2,-0.3 -0.683 19.7 151.4-101.3 147.0 5.7 26.9 -50.0 68 54 A T E - J 0 97B 0 29,-2.6 29,-2.3 -2,-0.3 2,-0.3 -0.855 43.7 -71.6-152.1-167.1 7.6 24.4 -47.9 69 55 A V >> - 0 0 0 -11,-0.4 4,-2.7 -2,-0.3 3,-0.6 -0.692 22.8-138.8-100.7 148.6 7.1 21.7 -45.2 70 56 A Y H 3> S+ 0 0 1 -2,-0.3 4,-2.1 1,-0.2 -1,-0.1 0.853 103.6 61.0 -69.8 -35.8 6.2 22.2 -41.6 71 57 A H H 34 S+ 0 0 14 1,-0.2 -1,-0.2 2,-0.2 25,-0.0 0.699 115.9 34.9 -66.0 -16.3 8.7 19.5 -40.5 72 58 A G H <4 S+ 0 0 5 -3,-0.6 -2,-0.2 2,-0.1 -1,-0.2 0.846 129.3 27.9 -97.1 -50.6 11.5 21.6 -42.0 73 59 A A H >< S- 0 0 0 -4,-2.7 3,-2.2 1,-0.3 -3,-0.2 0.613 78.5-171.1 -92.0 -13.4 10.4 25.3 -41.4 74 60 A G T 3< - 0 0 0 -4,-2.1 -1,-0.3 -5,-0.3 -2,-0.1 -0.399 68.7 -43.2 50.7-128.1 8.3 24.9 -38.3 75 61 A S T 3 S+ 0 0 31 267,-0.1 12,-0.4 -2,-0.1 -1,-0.3 0.207 99.1 141.2-106.9 8.4 6.7 28.3 -37.8 76 62 A K < - 0 0 66 -3,-2.2 -74,-0.1 1,-0.1 2,-0.1 -0.064 50.7-116.7 -63.3 155.5 9.8 30.3 -38.6 77 63 A T - 0 0 36 -76,-0.2 -74,-3.3 9,-0.1 2,-0.5 -0.399 24.9-119.1 -78.5 160.3 9.9 33.5 -40.5 78 64 A L E -aC 3 85A 1 7,-2.7 7,-3.0 -76,-0.2 2,-0.4 -0.920 25.8-118.2-104.7 128.8 11.8 33.8 -43.9 79 65 A A E + C 0 84A 2 -76,-3.0 -74,-0.3 -2,-0.5 -41,-0.2 -0.531 46.9 172.0 -66.1 122.0 14.6 36.4 -44.1 80 66 A G E > -bC 38 83A 3 -43,-1.3 -41,-3.6 3,-0.6 3,-1.3 -0.610 46.1 -88.0-127.3-174.9 13.6 38.9 -46.7 81 67 A P T 3 S+ 0 0 34 0, 0.0 -2,-0.0 0, 0.0 -41,-0.0 0.820 126.0 35.1 -74.8 -35.7 14.8 42.3 -48.0 82 68 A K T 3 S- 0 0 178 1,-0.4 -44,-0.1 -43,-0.1 -42,-0.0 -0.218 130.9 -80.3-104.4 38.0 13.0 44.5 -45.6 83 69 A G E < S-C 80 0A 4 -3,-1.3 -3,-0.6 2,-0.0 -1,-0.4 -0.343 83.5 -5.2 96.5-176.5 13.5 42.0 -42.7 84 70 A P E -C 79 0A 70 0, 0.0 2,-0.5 0, 0.0 -5,-0.2 -0.246 55.3-148.7 -60.0 129.9 11.7 38.8 -41.5 85 71 A I E -C 78 0A 39 -7,-3.0 -7,-2.7 -48,-0.1 2,-0.2 -0.883 15.7-139.4 -98.9 124.8 8.6 37.7 -43.4 86 72 A T - 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0 0 30 -3,-0.3 2,-0.5 1,-0.1 -1,-0.1 -0.363 37.5 -98.5 -63.3 152.3 3.3 -12.4 -22.5 557 543 A D > - 0 0 54 19,-0.3 4,-1.9 1,-0.2 5,-0.2 -0.669 29.1-149.0 -76.4 124.1 4.2 -13.6 -19.0 558 544 A A H > S+ 0 0 74 -2,-0.5 4,-2.1 1,-0.2 -1,-0.2 0.831 92.8 54.5 -62.7 -34.0 1.7 -11.9 -16.6 559 545 A H H > S+ 0 0 90 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.940 109.3 43.8 -70.2 -49.8 4.2 -11.7 -13.8 560 546 A F H > S+ 0 0 8 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.887 113.5 54.1 -58.9 -41.3 6.9 -9.9 -15.7 561 547 A L H X S+ 0 0 21 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.905 105.6 51.2 -63.4 -42.5 4.3 -7.6 -17.1 562 548 A S H X S+ 0 0 61 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.839 112.1 49.2 -62.7 -33.5 3.0 -6.7 -13.7 563 549 A Q H X S+ 0 0 76 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.906 110.6 46.4 -75.6 -42.5 6.6 -5.9 -12.6 564 550 A T H <>S+ 0 0 12 -4,-2.6 5,-0.6 1,-0.2 -2,-0.2 0.903 114.7 51.5 -67.1 -37.8 7.5 -3.7 -15.6 565 551 A K H ><5S+ 0 0 51 -4,-2.5 3,-1.7 -5,-0.3 -2,-0.2 0.949 109.9 46.6 -53.3 -53.6 4.1 -2.0 -15.0 566 552 A Q H 3<5S+ 0 0 164 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.867 105.9 58.8 -67.4 -35.7 4.7 -1.3 -11.3 567 553 A A T 3<5S- 0 0 38 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.440 100.2-137.8 -73.8 -0.4 8.2 0.0 -11.8 568 554 A G T < 5 + 0 0 38 -3,-1.7 -3,-0.1 -4,-0.2 -2,-0.1 0.503 48.3 148.4 61.8 2.9 6.8 2.7 -14.1 569 555 A D < - 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0 0 51 -28,-0.1 -26,-0.2 -23,-0.0 -25,-0.1 -0.883 22.4-120.7-167.4 131.2 40.3 20.6 -48.3 1140 481 B R B -t 1113 0T 90 -28,-2.3 -26,-0.9 -2,-0.3 -421,-0.0 -0.247 55.0 -69.8 -70.4 167.8 39.9 17.9 -45.7 1141 482 B P - 0 0 39 0, 0.0 3,-0.4 0, 0.0 2,-0.1 -0.308 53.9-129.4 -65.8 145.1 43.1 16.4 -44.0 1142 483 B S S S+ 0 0 0 -155,-0.5 -156,-0.2 1,-0.2 3,-0.1 -0.467 73.4 41.2 -95.0 159.6 45.4 14.2 -46.1 1143 484 B G S S+ 0 0 7 1,-0.3 40,-3.1 -158,-0.2 2,-0.4 0.532 79.7 111.3 88.7 8.3 46.9 10.8 -45.6 1144 485 B M B -u 1183 0U 61 -3,-0.4 2,-0.3 38,-0.2 -1,-0.3 -0.895 41.6-171.4-109.2 143.3 44.0 8.9 -44.1 1145 486 B F - 0 0 20 38,-2.3 40,-0.4 -2,-0.4 2,-0.1 -0.970 24.5-103.8-131.7 157.0 42.1 6.1 -45.8 1146 487 B D >> - 0 0 42 -2,-0.3 3,-1.5 -53,-0.2 4,-0.6 -0.305 25.0-119.5 -72.2 153.4 38.9 4.1 -45.0 1147 488 B S H 3> S+ 0 0 0 1,-0.3 4,-1.9 2,-0.2 -1,-0.1 0.629 109.9 74.2 -65.8 -16.8 38.7 0.5 -43.7 1148 489 B S H 3> S+ 0 0 0 -55,-0.3 4,-2.2 2,-0.2 -1,-0.3 0.816 89.9 58.6 -63.6 -30.1 36.8 -0.4 -46.9 1149 490 B V H <> S+ 0 0 17 -3,-1.5 4,-1.7 2,-0.2 -2,-0.2 0.891 103.0 50.9 -67.7 -37.4 40.2 -0.1 -48.6 1150 491 B L H X S+ 0 0 0 -4,-0.6 4,-1.9 2,-0.2 3,-0.4 0.961 109.2 51.5 -58.0 -51.5 41.6 -2.8 -46.3 1151 492 B C H X S+ 0 0 0 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.876 107.1 53.7 -49.4 -44.7 38.6 -4.9 -47.2 1152 493 B E H X S+ 0 0 31 -4,-2.2 4,-3.0 2,-0.2 5,-0.3 0.854 104.1 56.4 -59.3 -37.3 39.4 -4.3 -50.9 1153 494 B C H X S+ 0 0 0 -4,-1.7 4,-2.3 -3,-0.4 -2,-0.2 0.950 108.9 44.0 -64.3 -48.3 43.0 -5.5 -50.4 1154 495 B Y H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.905 114.0 53.7 -57.6 -40.3 41.8 -8.9 -49.1 1155 496 B D H X S+ 0 0 3 -4,-2.0 4,-3.3 1,-0.2 -2,-0.2 0.930 111.3 42.2 -64.6 -50.0 39.3 -9.0 -51.9 1156 497 B A H X>S+ 0 0 9 -4,-3.0 4,-2.9 2,-0.2 5,-1.6 0.850 110.2 60.5 -61.0 -36.7 41.9 -8.4 -54.7 1157 498 B G H <5S+ 0 0 0 -4,-2.3 6,-2.3 -5,-0.3 5,-0.3 0.952 115.3 32.7 -55.6 -51.1 44.2 -10.9 -52.9 1158 499 B C H <5S+ 0 0 20 -4,-2.4 4,-0.3 4,-0.2 -2,-0.2 0.929 123.1 47.6 -71.9 -43.5 41.6 -13.5 -53.3 1159 500 B A H <5S+ 0 0 4 -4,-3.3 -3,-0.2 -5,-0.2 -2,-0.2 0.923 132.1 0.2 -67.5 -48.2 40.3 -12.3 -56.6 1160 501 B W T <5S+ 0 0 127 -4,-2.9 -3,-0.2 -5,-0.1 -2,-0.1 0.811 124.9 49.1-112.5 -44.3 43.5 -11.7 -58.6 1161 502 B Y S - 0 0 85 -2,-0.4 4,-2.6 1,-0.1 5,-0.2 -0.541 33.4-106.1 -74.5 156.9 45.2 -16.3 -48.8 1165 506 B P H > S+ 0 0 21 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.838 122.6 55.2 -49.2 -36.7 43.8 -13.9 -46.2 1166 507 B A H > S+ 0 0 48 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.924 107.9 46.7 -66.8 -45.0 46.8 -14.7 -44.0 1167 508 B E H > S+ 0 0 65 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.960 112.8 49.7 -60.6 -50.9 49.3 -13.8 -46.7 1168 509 B T H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.922 109.7 52.9 -50.7 -47.2 47.4 -10.6 -47.4 1169 510 B S H X S+ 0 0 9 -4,-2.3 4,-2.9 1,-0.2 -1,-0.2 0.909 105.1 53.3 -57.5 -45.8 47.4 -9.8 -43.7 1170 511 B V H X S+ 0 0 71 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.898 111.6 46.4 -60.3 -41.0 51.1 -10.2 -43.3 1171 512 B R H X S+ 0 0 12 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.935 112.1 47.7 -69.3 -48.9 51.7 -7.7 -46.2 1172 513 B L H X S+ 0 0 0 -4,-2.6 4,-3.2 1,-0.2 5,-0.2 0.910 107.5 59.0 -56.8 -40.7 49.3 -5.1 -45.0 1173 514 B R H X S+ 0 0 74 -4,-2.9 4,-3.0 -5,-0.2 -1,-0.2 0.937 103.9 51.7 -50.5 -49.5 50.9 -5.5 -41.5 1174 515 B A H X S+ 0 0 17 -4,-1.7 4,-0.6 2,-0.2 -1,-0.2 0.874 111.9 45.8 -54.6 -42.4 54.2 -4.5 -43.2 1175 516 B Y H >< S+ 0 0 1 -4,-1.7 3,-1.4 2,-0.2 -2,-0.2 0.963 113.0 49.1 -66.0 -53.7 52.6 -1.4 -44.7 1176 517 B L H 3< S+ 0 0 44 -4,-3.2 -2,-0.2 1,-0.3 -1,-0.2 0.904 109.5 52.5 -52.7 -46.4 50.9 -0.4 -41.5 1177 518 B N H 3< S+ 0 0 117 -4,-3.0 -1,-0.3 -5,-0.2 -2,-0.2 0.634 90.9 89.8 -69.2 -13.2 54.0 -0.8 -39.4 1178 519 B T S X< S- 0 0 25 -3,-1.4 3,-0.9 -4,-0.6 2,-0.1 -0.758 75.1-136.1 -91.3 122.7 56.1 1.5 -41.7 1179 520 B P T 3 S+ 0 0 72 0, 0.0 -2,-0.1 0, 0.0 -1,-0.0 -0.345 81.5 41.5 -77.3 159.1 56.0 5.2 -40.7 1180 521 B G T 3 S+ 0 0 26 1,-0.3 3,-0.1 -2,-0.1 -2,-0.0 0.223 91.9 106.2 88.5 -12.7 55.5 8.0 -43.2 1181 522 B L S < S- 0 0 2 -3,-0.9 -1,-0.3 -6,-0.2 -229,-0.1 -0.450 84.2 -70.6 -89.1 166.8 52.9 6.1 -45.2 1182 523 B P - 0 0 8 0, 0.0 2,-0.3 0, 0.0 -38,-0.2 -0.247 55.4-130.5 -49.9 146.0 49.1 6.7 -45.3 1183 524 B V B +u 1144 0U 33 -40,-3.1 -38,-2.3 -3,-0.1 2,-0.3 -0.793 30.2 162.8-111.2 147.4 47.2 5.7 -42.1 1184 525 B C - 0 0 33 -2,-0.3 2,-0.4 -40,-0.2 -38,-0.1 -0.841 44.9 -80.4-141.0 178.2 44.1 3.6 -41.4 1185 526 B Q - 0 0 41 -40,-0.4 2,-1.2 -2,-0.3 104,-0.0 -0.718 50.1-110.8 -82.5 138.9 42.4 1.9 -38.5 1186 527 B D + 0 0 75 -2,-0.4 101,-0.4 1,-0.2 4,-0.1 -0.600 62.5 141.4 -75.8 98.7 43.8 -1.5 -37.7 1187 528 B H > + 0 0 2 -2,-1.2 4,-2.6 99,-0.1 5,-0.2 -0.070 27.0 119.0-126.1 27.7 41.1 -3.9 -38.8 1188 529 B L H > S+ 0 0 1 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.918 75.0 47.1 -63.6 -46.5 43.3 -6.5 -40.3 1189 530 B E H > S+ 0 0 130 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.893 112.9 50.0 -66.9 -40.2 42.2 -9.4 -38.0 1190 531 B F H > S+ 0 0 7 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.959 114.7 42.7 -61.0 -50.6 38.5 -8.6 -38.5 1191 532 B W H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 5,-0.3 0.913 113.3 52.9 -67.6 -38.8 38.8 -8.5 -42.3 1192 533 B E H X S+ 0 0 39 -4,-2.8 4,-2.1 -5,-0.2 -1,-0.2 0.942 108.0 51.5 -57.5 -47.3 41.0 -11.6 -42.4 1193 534 B S H X S+ 0 0 34 -4,-2.4 4,-0.6 -5,-0.2 -1,-0.2 0.915 110.8 48.9 -54.6 -44.3 38.4 -13.4 -40.3 1194 535 B V H >< S+ 0 0 0 -4,-2.0 3,-1.2 1,-0.2 -2,-0.2 0.946 115.2 40.1 -63.3 -51.6 35.6 -12.4 -42.8 1195 536 B F H >< S+ 0 0 5 -4,-2.3 3,-1.5 1,-0.3 -1,-0.2 0.766 104.5 69.2 -72.5 -25.9 37.3 -13.5 -46.0 1196 537 B T H 3< S+ 0 0 67 -4,-2.1 -1,-0.3 -5,-0.3 -2,-0.2 0.735 98.8 52.3 -60.9 -22.6 38.7 -16.6 -44.3 1197 538 B G T << S+ 0 0 13 -3,-1.2 2,-1.2 -4,-0.6 -1,-0.2 0.440 84.6 91.0 -92.5 -2.3 35.1 -17.8 -44.2 1198 539 B L < + 0 0 2 -3,-1.5 3,-0.3 -4,-0.1 2,-0.2 -0.555 59.3 157.4-100.9 70.7 34.3 -17.4 -47.9 1199 540 B T + 0 0 72 -2,-1.2 -2,-0.0 1,-0.2 -3,-0.0 -0.494 45.3 27.6-101.9 161.8 35.3 -20.7 -49.4 1200 541 B H S S- 0 0 148 -2,-0.2 -1,-0.2 1,-0.1 2,-0.0 0.921 73.2-173.8 56.4 48.9 34.4 -22.6 -52.5 1201 542 B I - 0 0 33 -3,-0.3 2,-0.8 1,-0.1 -1,-0.1 -0.358 34.5-102.7 -62.0 150.9 33.6 -19.6 -54.6 1202 543 B D >> - 0 0 51 19,-0.3 4,-2.4 1,-0.2 3,-0.6 -0.727 27.5-151.9 -80.8 109.0 32.1 -20.3 -58.0 1203 544 B A H 3> S+ 0 0 75 -2,-0.8 4,-2.5 1,-0.2 5,-0.2 0.806 93.4 54.0 -48.2 -38.0 35.0 -19.8 -60.5 1204 545 B H H 3> S+ 0 0 102 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.924 109.5 46.0 -68.0 -41.1 32.7 -18.8 -63.3 1205 546 B F H <> S+ 0 0 10 -3,-0.6 4,-2.1 2,-0.2 -2,-0.2 0.908 113.2 51.2 -66.7 -40.2 30.9 -16.1 -61.3 1206 547 B L H X S+ 0 0 22 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.946 107.1 52.3 -60.8 -50.3 34.3 -14.8 -60.1 1207 548 B S H X S+ 0 0 64 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.884 110.2 50.1 -50.7 -43.9 35.6 -14.7 -63.7 1208 549 B Q H X S+ 0 0 66 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.929 110.8 46.8 -64.2 -45.9 32.6 -12.6 -64.7 1209 550 B T H <>S+ 0 0 15 -4,-2.1 5,-0.8 2,-0.2 4,-0.5 0.854 114.1 48.0 -68.8 -37.5 32.9 -10.0 -61.9 1210 551 B K H ><5S+ 0 0 51 -4,-2.5 3,-1.9 2,-0.2 -1,-0.2 0.968 110.9 50.8 -58.9 -58.8 36.6 -9.6 -62.5 1211 552 B Q H 3<5S+ 0 0 175 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.816 106.5 55.5 -48.3 -38.8 36.0 -9.2 -66.3 1212 553 B A T 3<5S- 0 0 40 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.624 102.0-141.3 -78.0 -12.4 33.3 -6.5 -65.6 1213 554 B G T < 5 + 0 0 35 -3,-1.9 -3,-0.1 -4,-0.5 -2,-0.1 0.560 48.0 139.2 72.3 12.8 35.9 -4.6 -63.6 1214 555 B D < - 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