==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT 04-APR-12 4EHU . COMPND 2 MOLECULE: ACTIVATOR OF 2-HYDROXYISOCAPROYL-COA DEHYDRATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CLOSTRIDIUM DIFFICILE; . AUTHOR S.H.KNAUER,H.DOBBEK . 527 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24151.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 394 74.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 6.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 62 11.8 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 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.8 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 . 33 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 53 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 186 35.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.1 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 1 1 0 0 0 0 4 2 4 0 0 1 0 0 1 0 0 0 2 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 0 2 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 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 2 2 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 4 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 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 53 0, 0.0 19,-2.2 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 155.4 19.6 -43.2 -14.0 2 2 A Y E -Ab 19 57A 64 54,-0.6 56,-2.4 17,-0.2 57,-0.6 -0.969 360.0-176.0-119.8 142.5 20.6 -39.6 -13.1 3 3 A T E -Ab 18 59A 1 15,-2.4 15,-2.8 -2,-0.4 2,-0.4 -0.911 12.4-145.2-126.0 162.4 20.9 -36.6 -15.3 4 4 A M E -Ab 17 60A 1 55,-2.2 57,-2.4 -2,-0.3 2,-0.4 -0.982 7.1-163.5-131.6 140.2 22.2 -33.1 -14.4 5 5 A G E -Ab 16 61A 0 11,-2.4 11,-2.2 -2,-0.4 2,-0.4 -0.974 6.7-169.0-118.1 135.1 21.2 -29.6 -15.5 6 6 A L E -Ab 15 62A 3 55,-2.3 57,-2.6 -2,-0.4 2,-0.5 -0.992 4.7-168.4-122.8 133.1 23.4 -26.5 -14.9 7 7 A D E -Ab 14 63A 5 7,-3.2 7,-2.4 -2,-0.4 2,-0.9 -0.942 4.7-172.9-122.5 104.0 22.2 -23.0 -15.4 8 8 A I E +A 13 0A 7 55,-2.5 58,-3.0 -2,-0.5 59,-0.3 -0.818 17.6 173.3-102.3 95.8 25.1 -20.5 -15.3 9 9 A G - 0 0 9 3,-2.1 25,-2.6 -2,-0.9 -2,-0.0 -0.189 49.1 -88.7 -93.3-170.3 23.6 -17.1 -15.5 10 10 A S S S+ 0 0 34 23,-0.2 23,-0.4 1,-0.1 3,-0.1 0.768 122.1 17.1 -63.1 -25.8 25.0 -13.6 -15.1 11 11 A T S S+ 0 0 57 1,-0.3 22,-0.3 21,-0.2 2,-0.3 0.713 124.1 25.0-129.4 -37.7 24.6 -13.6 -11.4 12 12 A A - 0 0 2 20,-0.2 -3,-2.1 19,-0.1 2,-0.5 -0.983 59.3-133.1-140.7 152.4 24.1 -17.1 -10.0 13 13 A S E -AC 8 30A 1 17,-2.9 17,-2.6 19,-0.4 2,-0.4 -0.901 25.7-169.5-104.7 130.9 24.9 -20.7 -10.8 14 14 A K E -AC 7 29A 22 -7,-2.4 -7,-3.2 -2,-0.5 2,-0.3 -0.946 5.0-176.8-124.5 140.7 22.1 -23.2 -10.5 15 15 A G E -AC 6 28A 0 13,-2.3 13,-1.8 -2,-0.4 2,-0.4 -0.989 5.9-174.5-137.6 146.8 22.3 -27.0 -10.6 16 16 A V E -AC 5 27A 0 -11,-2.2 -11,-2.4 -2,-0.3 2,-0.5 -0.998 12.5-156.0-137.0 135.7 19.7 -29.9 -10.5 17 17 A I E -AC 4 26A 0 9,-2.3 8,-2.2 -2,-0.4 9,-1.2 -0.979 20.1-164.6-106.4 126.4 20.2 -33.6 -10.3 18 18 A L E -AC 3 24A 0 -15,-2.8 -15,-2.4 -2,-0.5 2,-0.5 -0.919 9.9-143.5-115.8 134.4 17.1 -35.4 -11.7 19 19 A K E >> S-AC 2 23A 80 4,-3.0 3,-2.3 -2,-0.4 4,-2.2 -0.872 78.9 -19.9-103.1 124.1 16.4 -39.1 -11.2 20 20 A N T 34 S- 0 0 69 -19,-2.2 -1,-0.2 -2,-0.5 -18,-0.1 0.799 113.8 -73.1 49.5 36.6 14.7 -41.0 -14.0 21 21 A G T 34 S+ 0 0 10 -3,-0.2 -1,-0.3 -20,-0.2 3,-0.1 0.652 130.4 68.6 61.1 17.1 13.5 -37.7 -15.5 22 22 A E T <4 S+ 0 0 116 -3,-2.3 2,-0.5 1,-0.2 -2,-0.2 0.657 82.5 58.3-136.1 -32.9 10.9 -37.4 -12.7 23 23 A D E < -C 19 0A 89 -4,-2.2 -4,-3.0 2,-0.0 2,-0.7 -0.921 62.7-141.8-120.3 118.8 12.4 -36.7 -9.3 24 24 A I E +C 18 0A 68 -2,-0.5 -6,-0.2 -6,-0.2 3,-0.1 -0.636 24.9 172.7 -70.1 111.9 14.6 -33.9 -8.2 25 25 A V E + 0 0 65 -8,-2.2 2,-0.3 -2,-0.7 -1,-0.2 0.549 64.9 9.9 -99.8 -9.7 17.1 -35.5 -5.8 26 26 A A E +C 17 0A 7 -9,-1.2 -9,-2.3 -3,-0.1 2,-0.3 -0.965 57.3 173.5-165.9 146.9 19.3 -32.4 -5.5 27 27 A S E -C 16 0A 35 -2,-0.3 2,-0.3 -11,-0.2 -11,-0.2 -0.979 6.3-179.0-151.6 158.4 19.5 -28.8 -6.3 28 28 A E E -C 15 0A 33 -13,-1.8 -13,-2.3 -2,-0.3 2,-0.4 -0.953 11.6-162.2-162.7 137.7 21.9 -26.0 -5.4 29 29 A T E -C 14 0A 34 -2,-0.3 2,-0.4 -15,-0.2 -15,-0.2 -0.994 5.5-173.1-123.5 131.9 22.2 -22.3 -6.1 30 30 A I E -C 13 0A 11 -17,-2.6 -17,-2.9 -2,-0.4 2,-1.3 -0.998 27.1-133.1-121.1 130.7 25.5 -20.4 -5.6 31 31 A S S S+ 0 0 102 -2,-0.4 2,-0.4 -19,-0.2 -19,-0.1 -0.093 81.7 91.6 -81.7 39.3 25.3 -16.6 -6.0 32 32 A S + 0 0 33 -2,-1.3 -19,-0.4 -19,-0.1 -20,-0.2 -0.993 58.0 179.5-127.2 126.1 28.4 -16.5 -8.2 33 33 A G > - 0 0 5 -2,-0.4 3,-1.7 -23,-0.4 5,-0.4 0.221 40.3 -4.8-105.1-140.7 27.6 -16.7 -11.9 34 34 A T T 3 S+ 0 0 35 -25,-2.6 -1,-0.3 1,-0.2 3,-0.1 -0.169 124.2 22.4 -57.1 143.0 29.5 -16.7 -15.2 35 35 A G T 3 S+ 0 0 82 1,-0.3 -1,-0.2 31,-0.1 2,-0.2 0.412 110.2 88.4 83.2 -3.5 33.2 -16.1 -15.0 36 36 A T S < S- 0 0 69 -3,-1.7 -1,-0.3 -4,-0.0 4,-0.2 -0.462 94.4 -98.2-114.8-171.7 33.5 -17.2 -11.4 37 37 A T S > S+ 0 0 87 1,-0.2 4,-2.3 -2,-0.2 3,-0.4 0.396 89.4 111.0 -85.7 1.4 34.0 -20.4 -9.5 38 38 A G H > S+ 0 0 0 -5,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.858 73.6 49.4 -43.0 -54.0 30.2 -20.5 -9.0 39 39 A P H > S+ 0 0 19 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.874 110.5 48.3 -57.9 -45.1 29.7 -23.6 -11.3 40 40 A S H > S+ 0 0 55 -3,-0.4 4,-2.3 1,-0.2 -2,-0.2 0.897 112.1 50.9 -64.9 -37.3 32.4 -25.7 -9.7 41 41 A R H X S+ 0 0 101 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.865 107.2 53.3 -67.4 -36.8 31.0 -24.9 -6.3 42 42 A V H X S+ 0 0 0 -4,-2.1 4,-2.3 -5,-0.3 -1,-0.2 0.944 109.7 48.9 -60.5 -47.2 27.5 -25.9 -7.4 43 43 A L H X S+ 0 0 27 -4,-2.1 4,-2.5 1,-0.2 5,-0.3 0.911 106.9 54.8 -60.3 -46.3 28.9 -29.2 -8.6 44 44 A E H X S+ 0 0 127 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.892 111.4 45.8 -53.7 -42.0 30.7 -29.9 -5.3 45 45 A K H X S+ 0 0 102 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.880 110.7 50.3 -75.7 -39.0 27.4 -29.4 -3.4 46 46 A L H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 6,-0.3 0.926 115.5 44.5 -60.2 -44.8 25.2 -31.5 -5.6 47 47 A Y H X S+ 0 0 49 -4,-2.5 4,-2.0 2,-0.2 5,-0.5 0.864 113.3 50.7 -68.0 -39.1 27.8 -34.3 -5.3 48 48 A G H < S+ 0 0 59 -4,-2.1 -2,-0.2 -5,-0.3 -1,-0.2 0.920 112.5 46.3 -64.5 -44.8 28.2 -33.8 -1.6 49 49 A K H < S+ 0 0 121 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.916 123.3 32.8 -62.7 -46.2 24.4 -34.0 -1.0 50 50 A T H < S- 0 0 41 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.662 95.9-130.3 -90.1 -19.2 23.8 -37.0 -3.2 51 51 A G < + 0 0 70 -4,-2.0 -3,-0.2 1,-0.3 2,-0.1 0.657 65.8 134.3 71.1 16.0 27.0 -38.9 -2.6 52 52 A L - 0 0 26 -5,-0.5 2,-0.3 -6,-0.3 -1,-0.3 -0.470 43.1-150.9 -91.0 165.6 27.2 -39.2 -6.4 53 53 A A >> - 0 0 32 -2,-0.1 3,-2.1 -3,-0.1 4,-0.5 -0.859 36.1 -93.8-129.7 168.6 30.2 -38.5 -8.6 54 54 A R G >4 S+ 0 0 97 -2,-0.3 3,-2.1 1,-0.3 -1,-0.1 0.884 122.1 60.4 -47.9 -44.1 30.5 -37.4 -12.2 55 55 A E G 34 S+ 0 0 160 1,-0.3 -1,-0.3 -3,-0.0 -3,-0.0 0.724 97.8 59.3 -64.0 -19.6 30.6 -41.0 -13.5 56 56 A D G <4 S+ 0 0 78 -3,-2.1 2,-0.7 -55,-0.0 -54,-0.6 0.604 86.2 87.9 -81.5 -13.2 27.2 -41.6 -12.0 57 57 A I E << -b 2 0A 5 -3,-2.1 -54,-0.2 -4,-0.5 3,-0.1 -0.798 60.0-165.8 -92.9 116.6 25.6 -38.8 -14.2 58 58 A K E S+ 0 0 87 -56,-2.4 2,-0.3 -2,-0.7 -55,-0.2 0.895 72.3 8.6 -71.3 -43.4 24.5 -40.3 -17.6 59 59 A K E -b 3 0A 35 -57,-0.6 -55,-2.2 190,-0.1 2,-0.4 -0.995 62.3-162.5-139.0 145.5 24.0 -36.9 -19.3 60 60 A V E -b 4 0A 2 -2,-0.3 14,-2.7 -57,-0.2 15,-1.2 -0.993 5.6-170.8-125.1 131.2 24.7 -33.3 -18.4 61 61 A V E -bd 5 75A 0 -57,-2.4 -55,-2.3 -2,-0.4 2,-0.4 -0.981 5.7-160.0-120.8 138.3 23.2 -30.2 -20.1 62 62 A V E +bd 6 76A 0 13,-2.3 15,-2.3 -2,-0.4 2,-0.2 -0.920 14.8 168.4-117.2 144.2 24.3 -26.6 -19.4 63 63 A T E +b 7 0A 0 -57,-2.6 -55,-2.5 -2,-0.4 3,-0.2 -0.784 26.9 67.3-138.8 178.2 22.3 -23.5 -20.1 64 64 A G S > S- 0 0 0 13,-0.4 3,-1.9 -2,-0.2 4,-0.3 -0.224 95.4 -49.7 97.7 175.1 22.4 -19.8 -19.4 65 65 A Y T 3 S+ 0 0 134 1,-0.3 3,-0.4 2,-0.1 -56,-0.2 0.823 137.1 46.9 -52.0 -38.2 24.7 -16.9 -20.3 66 66 A G T > S+ 0 0 1 -58,-3.0 3,-1.2 -3,-0.2 4,-0.5 0.347 78.2 109.6 -88.9 7.5 27.8 -18.9 -19.4 67 67 A R G X S+ 0 0 80 -3,-1.9 3,-0.9 -59,-0.3 -1,-0.2 0.809 77.4 49.1 -59.3 -35.2 26.8 -22.1 -21.2 68 68 A M G 3 S+ 0 0 114 -3,-0.4 -1,-0.3 -4,-0.3 -2,-0.1 0.727 103.8 60.9 -80.7 -18.7 29.4 -21.8 -24.0 69 69 A N G < S+ 0 0 126 -3,-1.2 2,-0.5 -4,-0.1 -1,-0.2 0.538 91.8 83.5 -75.9 -9.8 32.2 -21.2 -21.4 70 70 A Y < + 0 0 31 -3,-0.9 3,-0.3 -4,-0.5 -8,-0.1 -0.872 52.9 176.2-104.2 124.1 31.4 -24.6 -19.9 71 71 A S + 0 0 104 -2,-0.5 -1,-0.1 1,-0.2 -3,-0.0 0.473 62.4 75.0-109.2 -4.0 33.0 -27.5 -21.7 72 72 A D S S+ 0 0 102 3,-0.0 2,-0.3 -11,-0.0 -1,-0.2 0.010 74.9 99.7-102.9 29.1 32.0 -30.6 -19.6 73 73 A A - 0 0 26 -3,-0.3 -12,-0.2 -6,-0.1 3,-0.1 -0.786 68.5-137.4-111.2 156.8 28.4 -30.9 -20.8 74 74 A D S S+ 0 0 69 -14,-2.7 2,-0.3 -2,-0.3 -13,-0.2 0.814 92.5 9.5 -76.9 -36.1 26.8 -33.2 -23.3 75 75 A K E -d 61 0A 100 -15,-1.2 -13,-2.3 2,-0.0 2,-0.5 -0.988 60.9-148.7-139.3 150.9 24.7 -30.4 -24.7 76 76 A Q E -d 62 0A 77 -2,-0.3 2,-0.4 -15,-0.2 -13,-0.2 -0.993 31.4-174.5-113.5 123.7 24.6 -26.6 -24.3 77 77 A I - 0 0 34 -15,-2.3 -13,-0.4 -2,-0.5 -10,-0.1 -0.924 29.8 -92.0-129.6 143.4 21.0 -25.4 -24.7 78 78 A S > - 0 0 47 -2,-0.4 4,-2.2 -15,-0.2 5,-0.1 -0.107 26.7-134.7 -44.3 136.6 19.2 -22.1 -24.9 79 79 A E H > S+ 0 0 28 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.722 105.4 63.3 -72.5 -17.7 17.8 -20.8 -21.5 80 80 A L H > S+ 0 0 38 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.949 108.7 40.9 -66.4 -46.6 14.6 -20.0 -23.3 81 81 A S H > S+ 0 0 48 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.910 116.0 50.3 -65.1 -42.4 14.1 -23.7 -24.0 82 82 A C H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.928 111.3 46.1 -68.0 -44.2 15.3 -24.7 -20.6 83 83 A H H X S+ 0 0 8 -4,-2.6 4,-2.8 2,-0.2 5,-0.3 0.926 114.4 49.2 -64.1 -40.7 13.1 -22.4 -18.6 84 84 A A H X S+ 0 0 7 -4,-2.0 4,-2.7 -5,-0.3 -2,-0.2 0.934 113.2 46.5 -61.8 -43.5 10.1 -23.4 -20.7 85 85 A R H X S+ 0 0 61 -4,-2.6 4,-1.5 2,-0.2 -2,-0.2 0.915 114.7 47.3 -64.5 -44.4 10.8 -27.1 -20.3 86 86 A G H X S+ 0 0 0 -4,-2.6 4,-1.1 157,-0.3 3,-0.2 0.939 114.5 45.5 -62.3 -48.0 11.4 -26.7 -16.5 87 87 A V H >X S+ 0 0 0 -4,-2.8 4,-3.0 1,-0.2 3,-0.9 0.927 110.7 52.8 -63.0 -46.5 8.2 -24.6 -16.0 88 88 A N H 3< S+ 0 0 52 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.804 104.9 57.0 -62.0 -28.3 6.0 -26.9 -18.2 89 89 A F H 3< S+ 0 0 87 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.814 119.8 29.3 -67.2 -31.4 7.2 -29.9 -16.1 90 90 A I H << S+ 0 0 63 -4,-1.1 -2,-0.2 -3,-0.9 -3,-0.1 0.794 122.2 41.1 -99.0 -38.3 6.0 -28.2 -12.8 91 91 A I S >< S- 0 0 15 -4,-3.0 3,-0.6 -5,-0.2 -1,-0.2 -0.952 74.6-142.7-127.1 110.0 3.0 -26.1 -13.8 92 92 A P T 3 S+ 0 0 90 0, 0.0 117,-0.1 0, 0.0 -3,-0.1 -0.282 78.8 22.5 -67.5 152.8 0.4 -27.2 -16.4 93 93 A E T 3 S+ 0 0 124 1,-0.2 2,-0.4 19,-0.1 -5,-0.1 0.786 78.9 168.3 67.1 30.4 -1.3 -25.0 -18.9 94 94 A T < + 0 0 0 -3,-0.6 -1,-0.2 1,-0.1 116,-0.2 -0.640 13.3 158.0 -79.8 131.3 1.5 -22.4 -18.9 95 95 A R + 0 0 31 114,-2.3 15,-2.4 112,-0.4 2,-0.4 0.561 63.5 44.0-126.3 -19.8 1.3 -19.8 -21.7 96 96 A T E -Ef 109 210B 1 113,-2.1 115,-2.8 13,-0.2 2,-0.5 -0.994 61.3-172.6-129.7 126.3 3.4 -16.8 -20.4 97 97 A I E -Ef 108 211B 0 11,-2.7 11,-2.9 -2,-0.4 2,-0.6 -0.982 4.7-166.0-117.2 128.4 6.7 -17.1 -18.6 98 98 A I E -Ef 107 212B 0 113,-2.8 115,-2.7 -2,-0.5 2,-0.7 -0.948 5.7-172.1-113.1 111.1 8.4 -14.1 -17.0 99 99 A D E -Ef 106 213B 8 7,-3.1 7,-2.6 -2,-0.6 2,-0.8 -0.881 1.7-174.9-106.6 104.2 12.0 -14.8 -16.2 100 100 A I E +E 105 0B 0 113,-2.1 116,-1.5 -2,-0.7 117,-0.4 -0.881 17.7 165.3-101.7 110.5 13.5 -12.0 -14.1 101 101 A G - 0 0 18 3,-2.4 29,-3.2 -2,-0.8 30,-0.3 -0.246 51.3 -82.0-106.9-163.2 17.2 -12.6 -13.7 102 102 A G S S+ 0 0 13 28,-0.2 29,-0.6 27,-0.2 27,-0.1 0.692 121.8 15.7 -79.5 -22.6 20.3 -10.6 -12.5 103 103 A Q S S+ 0 0 56 1,-0.3 2,-0.3 27,-0.1 22,-0.1 0.558 127.2 21.8-128.4 -14.6 21.0 -8.9 -15.9 104 104 A D - 0 0 18 20,-0.1 -3,-2.4 2,-0.0 2,-0.4 -0.981 57.1-138.0-148.1 163.3 17.9 -9.3 -18.1 105 105 A A E -EG 100 122B 0 17,-1.8 17,-2.1 -2,-0.3 2,-0.4 -0.990 22.9-165.0-121.9 130.9 14.2 -10.0 -18.0 106 106 A K E -EG 99 121B 11 -7,-2.6 -7,-3.1 -2,-0.4 2,-0.5 -0.947 9.0-163.0-119.0 137.2 12.7 -12.3 -20.5 107 107 A V E -EG 98 120B 0 13,-2.9 13,-2.1 -2,-0.4 2,-0.5 -0.978 11.8-169.8-122.0 120.8 9.1 -12.8 -21.4 108 108 A L E -EG 97 119B 2 -11,-2.9 -11,-2.7 -2,-0.5 2,-0.5 -0.906 10.6-160.1-110.9 133.0 8.2 -15.9 -23.2 109 109 A K E -EG 96 118B 34 9,-2.5 8,-3.3 -2,-0.5 9,-1.4 -0.955 18.3-163.2-108.0 129.7 4.8 -16.7 -24.9 110 110 A L E - G 0 116B 1 -15,-2.4 6,-0.2 -2,-0.5 2,-0.1 -0.834 11.9-133.2-113.5 151.4 4.3 -20.4 -25.4 111 111 A D > - 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0 0 28 -5,-2.4 -1,-0.2 -6,-0.1 2,-0.2 -0.338 46.6 -93.3 -55.7 146.9 44.3 -1.8 -18.0 450 181 B K >> - 0 0 121 1,-0.1 4,-2.0 -25,-0.1 3,-0.7 -0.448 27.6-130.0 -69.5 137.4 46.0 1.6 -18.3 451 182 B I H 3> S+ 0 0 66 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.854 106.3 57.7 -57.9 -35.1 43.7 4.3 -16.9 452 183 B E H 3> S+ 0 0 38 1,-0.2 4,-2.0 2,-0.2 -29,-0.3 0.861 107.9 46.5 -66.9 -34.3 44.2 6.4 -20.1 453 184 B D H <> S+ 0 0 9 -3,-0.7 -26,-1.9 2,-0.2 4,-1.9 0.856 111.5 51.1 -74.8 -35.9 42.8 3.6 -22.3 454 185 B I H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.932 112.0 47.5 -63.2 -46.6 39.9 3.0 -19.9 455 186 B V H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.916 108.3 53.9 -64.5 -42.9 39.0 6.7 -20.0 456 187 B A H X S+ 0 0 8 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.914 109.6 49.1 -56.2 -42.4 39.3 6.8 -23.8 457 188 B G H X S+ 0 0 1 -4,-1.9 4,-2.3 2,-0.2 -28,-0.3 0.894 108.6 53.5 -64.0 -40.0 36.8 4.0 -24.0 458 189 B I H X S+ 0 0 3 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.908 108.9 49.5 -58.3 -42.9 34.5 5.8 -21.5 459 190 B H H X S+ 0 0 4 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.926 108.8 52.1 -64.5 -42.8 34.6 8.9 -23.8 460 191 B T H X S+ 0 0 9 -4,-2.3 4,-2.8 1,-0.2 -1,-0.2 0.912 107.2 53.2 -59.6 -43.8 33.7 6.7 -26.8 461 192 B S H X S+ 0 0 22 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.925 111.9 44.6 -54.8 -47.6 30.7 5.2 -25.0 462 193 B V H X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.2 5,-0.3 0.935 114.0 50.0 -65.1 -43.6 29.3 8.7 -24.2 463 194 B A H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.883 108.0 52.7 -67.0 -37.1 30.0 9.9 -27.7 464 195 B K H X S+ 0 0 115 -4,-2.8 4,-1.6 -5,-0.2 -1,-0.2 0.921 111.1 47.2 -62.6 -41.7 28.3 6.9 -29.3 465 196 B R H X S+ 0 0 87 -4,-1.8 4,-1.1 -5,-0.2 -2,-0.2 0.907 117.6 40.1 -69.1 -41.6 25.1 7.4 -27.3 466 197 B V H X S+ 0 0 2 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.881 111.2 58.6 -73.8 -36.7 24.9 11.2 -27.9 467 198 B S H X S+ 0 0 2 -4,-2.7 4,-2.4 -5,-0.3 -2,-0.2 0.864 101.7 54.7 -58.0 -38.8 25.9 10.9 -31.6 468 199 B S H X S+ 0 0 69 -4,-1.6 4,-1.3 2,-0.2 -1,-0.2 0.904 108.6 49.9 -63.2 -40.4 22.9 8.5 -32.1 469 200 B L H >X S+ 0 0 14 -4,-1.1 4,-1.0 1,-0.2 3,-0.7 0.964 111.5 47.1 -57.8 -55.0 20.7 11.3 -30.8 470 201 B V H >X S+ 0 0 0 -4,-2.5 4,-1.3 1,-0.2 3,-0.5 0.855 108.0 55.7 -58.0 -38.5 22.2 13.9 -33.0 471 202 B K H 3< S+ 0 0 113 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.813 101.2 58.6 -69.0 -27.6 22.0 11.7 -36.1 472 203 B R H << S+ 0 0 177 -4,-1.3 -1,-0.2 -3,-0.7 -2,-0.2 0.817 109.8 43.2 -69.1 -29.6 18.3 11.3 -35.6 473 204 B I H << S- 0 0 16 -4,-1.0 -1,-0.2 -3,-0.5 -2,-0.2 0.691 120.3-109.9 -89.1 -21.5 17.7 15.0 -35.8 474 205 B G < - 0 0 30 -4,-1.3 -3,-0.2 -96,-0.0 -2,-0.1 0.702 26.9-103.7 91.9 106.7 20.1 15.5 -38.7 475 206 B V + 0 0 45 -4,-0.1 2,-0.3 24,-0.1 4,-0.0 -0.334 41.4 177.4 -58.7 134.7 23.4 17.2 -38.4 476 207 B Q - 0 0 103 2,-0.1 -112,-0.4 -2,-0.0 -111,-0.2 -0.946 31.9 -88.2-140.9 121.9 23.4 20.8 -39.7 477 208 B R S S+ 0 0 148 -2,-0.3 2,-0.1 -113,-0.2 26,-0.1 -0.390 102.9 54.2 -72.6 151.6 26.5 23.0 -39.5 478 209 B N S S- 0 0 31 -113,-0.1 -114,-2.5 24,-0.1 -113,-2.2 0.474 74.1-172.6 -78.5 141.5 27.5 24.9 -37.6 479 210 B V E -np 365 503D 1 23,-0.6 25,-3.1 -115,-0.2 2,-0.4 -0.862 4.7-171.9 -99.7 127.3 27.3 22.2 -34.8 480 211 B V E -np 366 504D 0 -115,-2.7 -113,-2.8 -2,-0.5 2,-0.5 -0.962 11.9-151.9-125.7 134.1 28.1 23.6 -31.4 481 212 B M E +n 367 0D 0 23,-1.9 2,-0.2 -2,-0.4 -113,-0.2 -0.930 23.2 165.0-107.3 133.9 28.6 21.7 -28.1 482 213 B V E +n 368 0D 0 -115,-2.7 -113,-2.0 -2,-0.5 28,-0.2 -0.752 25.1 77.3-133.4 179.0 27.8 23.3 -24.8 483 214 B G S > S- 0 0 5 26,-2.6 3,-0.9 -2,-0.2 4,-0.2 -0.196 91.0 -71.0 98.0 167.6 27.2 22.1 -21.2 484 215 B G G > S+ 0 0 24 1,-0.3 3,-1.5 26,-0.2 4,-0.2 0.810 129.5 62.0 -68.2 -31.2 29.8 21.1 -18.6 485 216 B V G > S+ 0 0 13 -116,-1.5 3,-2.1 1,-0.3 -1,-0.3 0.805 90.5 68.3 -65.1 -27.9 30.6 17.9 -20.4 486 217 B A G < S+ 0 0 5 -3,-0.9 -1,-0.3 -117,-0.4 -2,-0.2 0.606 84.3 72.2 -67.8 -10.6 31.9 20.0 -23.4 487 218 B R G < S+ 0 0 167 -3,-1.5 2,-0.9 -4,-0.2 -1,-0.3 0.640 78.7 89.4 -72.7 -14.7 34.7 21.1 -21.1 488 219 B N <> - 0 0 13 -3,-2.1 4,-2.0 -4,-0.2 3,-0.4 -0.751 65.2-164.1 -87.2 105.2 36.0 17.6 -21.6 489 220 B S H > S+ 0 0 49 -2,-0.9 4,-2.2 1,-0.2 -1,-0.2 0.813 87.1 57.8 -63.4 -29.5 38.2 17.8 -24.6 490 221 B G H > S+ 0 0 5 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.877 106.1 48.7 -67.9 -40.0 38.2 14.0 -25.0 491 222 B I H > S+ 0 0 0 -3,-0.4 4,-2.5 -6,-0.2 -2,-0.2 0.918 110.7 50.5 -63.6 -42.9 34.4 13.9 -25.3 492 223 B V H X S+ 0 0 20 -4,-2.0 4,-2.4 1,-0.2 5,-0.2 0.948 111.6 48.0 -64.8 -42.2 34.4 16.7 -27.9 493 224 B R H X S+ 0 0 104 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.921 112.9 48.0 -60.3 -45.3 37.0 14.9 -30.0 494 225 B A H X S+ 0 0 4 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.876 111.0 52.0 -66.1 -36.1 35.1 11.6 -29.7 495 226 B M H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 5,-0.3 0.918 107.4 50.1 -66.2 -45.0 31.8 13.4 -30.7 496 227 B A H X>S+ 0 0 30 -4,-2.4 5,-1.1 1,-0.2 4,-0.8 0.879 112.4 50.3 -62.8 -36.9 33.3 15.0 -33.8 497 228 B R H <5S+ 0 0 125 -4,-1.9 3,-0.5 -5,-0.2 -2,-0.2 0.955 111.9 45.8 -62.1 -51.7 34.6 11.6 -34.8 498 229 B E H <5S+ 0 0 42 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.841 119.8 38.2 -66.8 -33.6 31.2 9.8 -34.3 499 230 B I H <5S- 0 0 9 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.493 99.6-136.5 -96.6 -3.0 29.1 12.4 -36.1 500 231 B N T <5 + 0 0 148 -4,-0.8 2,-0.3 -3,-0.5 -3,-0.2 0.845 66.7 108.1 54.8 40.1 31.8 13.0 -38.7 501 232 B T S S+ 0 0 49 1,-0.1 3,-1.8 2,-0.0 -1,-0.3 -0.420 71.1 154.4-122.3 55.5 32.9 28.9 -21.9 509 240 B P G > S+ 0 0 8 0, 0.0 -26,-2.6 0, 0.0 3,-0.8 0.793 70.8 53.8 -63.5 -28.0 30.7 26.0 -22.9 510 241 B Q G 3 S+ 0 0 22 1,-0.2 3,-0.3 -28,-0.2 4,-0.3 0.667 106.8 53.8 -76.7 -16.1 29.2 25.5 -19.5 511 242 B L G <> S+ 0 0 12 -3,-1.8 4,-2.6 1,-0.2 -1,-0.2 0.283 72.9 100.6-103.3 6.9 28.0 29.1 -19.2 512 243 B T H <> S+ 0 0 0 -3,-0.8 4,-2.3 -4,-0.3 -157,-0.3 0.842 83.8 50.5 -68.4 -32.7 26.0 29.5 -22.4 513 244 B G H > S+ 0 0 0 -3,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.931 112.6 46.2 -66.5 -46.0 22.7 29.1 -20.6 514 245 B A H > S+ 0 0 0 -4,-0.3 4,-2.2 2,-0.2 -229,-0.2 0.893 113.1 50.9 -61.4 -38.7 23.6 31.7 -18.0 515 246 B L H X S+ 0 0 0 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.926 109.7 49.1 -65.8 -44.5 24.9 34.0 -20.9 516 247 B G H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.907 110.5 50.9 -61.1 -42.2 21.6 33.6 -22.8 517 248 B A H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.910 108.3 52.6 -58.7 -42.4 19.7 34.4 -19.6 518 249 B A H X S+ 0 0 0 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.825 108.3 51.3 -64.5 -31.3 21.9 37.5 -19.2 519 250 B L H X S+ 0 0 4 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.889 109.6 48.0 -74.2 -40.0 21.0 38.5 -22.7 520 251 B Y H X S+ 0 0 62 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.856 109.6 54.9 -65.7 -32.6 17.3 38.1 -22.1 521 252 B A H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.910 105.7 51.7 -63.5 -40.9 17.8 40.1 -19.0 522 253 B F H X S+ 0 0 37 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.878 106.7 53.8 -62.1 -40.4 19.4 42.9 -21.1 523 254 B D H X S+ 0 0 50 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.895 110.8 46.8 -57.8 -42.5 16.3 42.8 -23.3 524 255 B E H X S+ 0 0 43 -4,-1.9 4,-1.3 2,-0.2 -2,-0.2 0.908 109.1 53.2 -67.3 -43.1 14.2 43.3 -20.3 525 256 B A H < S+ 0 0 4 -4,-2.6 3,-0.3 1,-0.2 -2,-0.2 0.900 110.9 46.5 -62.5 -41.2 16.3 46.1 -18.9 526 257 B K H < S+ 0 0 130 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.919 107.0 57.6 -65.8 -43.6 16.1 48.1 -22.2 527 258 B E H < 0 0 150 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.761 360.0 360.0 -58.8 -26.7 12.3 47.5 -22.4 528 259 B S < 0 0 96 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.867 360.0 360.0 -74.5 360.0 12.0 49.2 -19.0