==== 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 4EHT . COMPND 2 MOLECULE: ACTIVATOR OF 2-HYDROXYISOCAPROYL-COA DEHYDRATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CLOSTRIDIUM DIFFICILE; . AUTHOR S.H.KNAUER,H.DOBBEK . 528 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24447.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 394 74.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 6.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 62 11.7 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 . 36 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 52 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 182 34.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.9 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 2 0 0 0 0 0 4 2 4 0 0 1 0 1 0 0 0 0 2 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 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 51 0, 0.0 19,-2.7 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 153.2 13.5 35.2 14.8 2 2 A Y E -Ab 19 57A 65 54,-0.6 56,-2.5 17,-0.2 57,-0.7 -0.961 360.0-174.0-122.3 143.4 12.5 38.7 13.9 3 3 A T E -Ab 18 59A 1 15,-2.1 15,-2.6 -2,-0.4 2,-0.4 -0.889 12.9-143.3-126.1 163.7 12.2 41.7 16.2 4 4 A M E -Ab 17 60A 1 55,-2.2 57,-2.5 -2,-0.3 2,-0.4 -0.984 8.0-164.3-131.7 140.6 10.9 45.2 15.4 5 5 A G E -Ab 16 61A 0 11,-2.2 11,-2.0 -2,-0.4 2,-0.4 -0.985 5.9-168.8-121.5 134.7 11.9 48.7 16.4 6 6 A L E -Ab 15 62A 0 55,-2.3 57,-2.9 -2,-0.4 2,-0.6 -0.988 4.7-168.0-122.7 131.6 9.7 51.8 15.9 7 7 A D E -Ab 14 63A 5 7,-3.3 7,-2.5 -2,-0.4 2,-0.8 -0.941 6.8-173.4-122.4 102.4 11.0 55.3 16.4 8 8 A I E +A 13 0A 4 55,-2.3 5,-0.2 -2,-0.6 59,-0.2 -0.843 11.9 173.6-102.2 97.3 8.0 57.8 16.5 9 9 A G - 0 0 13 3,-2.3 25,-2.1 -2,-0.8 -2,-0.0 -0.257 48.1-101.3 -89.7-177.2 9.4 61.3 16.6 10 10 A S S S+ 0 0 33 23,-0.2 23,-0.4 1,-0.1 3,-0.1 0.607 120.7 29.1 -82.7 -8.8 7.4 64.6 16.4 11 11 A T S S+ 0 0 54 1,-0.3 2,-0.3 21,-0.2 22,-0.3 0.740 125.8 17.7-114.2 -40.6 8.4 64.9 12.7 12 12 A A - 0 0 4 20,-0.2 -3,-2.3 19,-0.1 2,-0.5 -0.974 57.7-138.8-140.7 147.8 8.9 61.4 11.2 13 13 A S E -AC 8 30A 0 17,-2.9 17,-2.7 19,-0.4 2,-0.4 -0.929 24.8-171.8-106.9 132.9 8.0 57.8 12.0 14 14 A K E -AC 7 29A 21 -7,-2.5 -7,-3.3 -2,-0.5 2,-0.3 -0.976 4.0-174.4-130.5 138.1 10.8 55.2 11.4 15 15 A G E -AC 6 28A 0 13,-2.4 13,-2.0 -2,-0.4 2,-0.3 -0.950 5.5-174.3-133.9 151.2 10.6 51.4 11.5 16 16 A V E -AC 5 27A 0 -11,-2.0 -11,-2.2 -2,-0.3 2,-0.5 -0.996 12.3-156.0-140.8 135.0 13.1 48.5 11.2 17 17 A I E -AC 4 26A 0 9,-2.7 8,-2.4 -2,-0.3 9,-1.3 -0.981 20.6-163.0-109.2 126.7 12.6 44.7 11.1 18 18 A L E -AC 3 24A 0 -15,-2.6 -15,-2.1 -2,-0.5 2,-0.6 -0.924 9.7-142.6-116.7 131.7 15.8 42.9 12.3 19 19 A K E >> S-AC 2 23A 73 4,-3.1 3,-2.5 -2,-0.4 4,-1.9 -0.825 78.7 -23.3 -98.0 122.8 16.6 39.3 11.7 20 20 A N T 34 S- 0 0 80 -19,-2.7 -1,-0.2 -2,-0.6 -18,-0.1 0.817 114.7 -69.5 49.4 36.9 18.3 37.3 14.4 21 21 A G T 34 S+ 0 0 6 -3,-0.3 -1,-0.3 -20,-0.2 3,-0.1 0.645 130.1 66.9 62.8 19.5 19.7 40.6 15.8 22 22 A E T <4 S+ 0 0 136 -3,-2.5 2,-0.5 1,-0.3 -2,-0.2 0.650 82.3 56.8-138.3 -41.2 22.0 41.1 12.9 23 23 A D E < -C 19 0A 89 -4,-1.9 -4,-3.1 2,-0.0 2,-0.6 -0.913 64.5-138.8-111.6 124.3 20.5 41.8 9.5 24 24 A I E +C 18 0A 69 -2,-0.5 -6,-0.2 -6,-0.2 3,-0.1 -0.679 24.9 175.5 -71.4 116.8 18.1 44.6 8.7 25 25 A V E + 0 0 60 -8,-2.4 2,-0.3 -2,-0.6 -1,-0.2 0.634 66.5 12.6 -99.2 -19.3 15.5 42.9 6.5 26 26 A A E +C 17 0A 9 -9,-1.3 -9,-2.7 -3,-0.1 -1,-0.3 -0.968 60.5 175.9-156.4 143.1 13.2 46.0 6.2 27 27 A S E +C 16 0A 39 -2,-0.3 2,-0.3 -11,-0.2 -11,-0.2 -0.983 6.0 178.4-145.0 153.2 13.3 49.7 7.0 28 28 A E E -C 15 0A 29 -13,-2.0 -13,-2.4 -2,-0.3 2,-0.4 -0.943 13.7-164.4-162.2 130.9 10.9 52.5 6.4 29 29 A T E -C 14 0A 39 -2,-0.3 2,-0.4 -15,-0.2 -15,-0.2 -0.973 7.2-173.1-118.0 133.4 10.6 56.2 7.1 30 30 A I E -C 13 0A 22 -17,-2.7 -17,-2.9 -2,-0.4 2,-1.5 -0.997 26.9-132.8-125.4 127.2 7.3 58.1 6.8 31 31 A S S S+ 0 0 107 -2,-0.4 2,-0.4 -19,-0.2 -19,-0.1 -0.080 82.1 87.4 -76.6 39.0 7.4 61.9 7.2 32 32 A S + 0 0 35 -2,-1.5 -19,-0.4 -19,-0.1 -20,-0.2 -0.988 56.4 176.8-133.3 130.5 4.5 61.9 9.6 33 33 A G > > + 0 0 4 -23,-0.4 3,-2.2 -2,-0.4 5,-0.5 0.226 38.6 11.5-105.5-140.4 5.2 61.6 13.3 34 34 A T T 3 5S+ 0 0 42 -25,-2.1 -1,-0.2 1,-0.3 3,-0.1 -0.737 124.2 5.9 -81.8 129.1 3.2 61.6 16.6 35 35 A G T 3 5S+ 0 0 77 -2,-0.4 -1,-0.3 1,-0.2 2,-0.2 -0.020 104.0 88.8-123.6 95.8 0.3 61.5 16.3 36 36 A T T < 5S- 0 0 72 -3,-2.2 4,-0.3 -4,-0.1 -1,-0.2 -0.393 92.7 -77.4-121.8-163.4 -0.6 61.0 12.7 37 37 A T T >5S+ 0 0 87 1,-0.2 4,-1.9 -2,-0.2 5,-0.2 0.304 101.5 105.9 -81.5 11.7 -1.2 58.0 10.5 38 38 A G H > S+ 0 0 20 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.891 112.0 54.2 -55.1 -42.1 3.3 54.8 12.6 40 40 A S H > S+ 0 0 67 -4,-0.3 4,-2.4 1,-0.2 -2,-0.2 0.899 109.4 46.5 -60.7 -43.5 0.5 52.8 10.9 41 41 A R H X S+ 0 0 88 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.761 107.6 57.0 -75.1 -25.6 1.8 53.3 7.4 42 42 A V H X S+ 0 0 0 -4,-1.7 4,-2.0 -5,-0.2 -1,-0.2 0.921 109.1 47.0 -65.1 -43.4 5.3 52.4 8.6 43 43 A L H X S+ 0 0 28 -4,-2.0 4,-2.7 1,-0.2 5,-0.4 0.945 109.1 53.7 -64.8 -46.4 4.0 49.1 9.8 44 44 A E H X S+ 0 0 121 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.883 111.5 46.6 -50.8 -42.6 2.1 48.5 6.5 45 45 A K H X S+ 0 0 97 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.834 112.9 47.5 -75.5 -33.2 5.3 49.0 4.6 46 46 A L H X S+ 0 0 0 -4,-2.0 4,-1.3 2,-0.2 6,-0.4 0.936 119.6 38.6 -71.3 -46.9 7.5 46.8 6.8 47 47 A Y H X>S+ 0 0 45 -4,-2.7 4,-1.7 2,-0.2 5,-0.5 0.939 117.3 50.8 -67.4 -49.7 4.9 44.0 6.8 48 48 A G H <5S+ 0 0 61 -4,-2.5 -2,-0.2 -5,-0.4 -1,-0.2 0.901 112.9 45.3 -53.2 -46.6 4.0 44.5 3.2 49 49 A K H <5S+ 0 0 118 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.752 122.7 35.3 -75.8 -24.3 7.6 44.5 2.0 50 50 A T H <5S- 0 0 39 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.475 98.2-131.5-104.7 -5.8 8.6 41.4 4.1 51 51 A G T <5 + 0 0 66 -4,-1.7 -3,-0.2 1,-0.2 -4,-0.1 0.528 66.1 131.6 63.1 4.4 5.3 39.6 3.7 52 52 A L < - 0 0 26 -5,-0.5 2,-0.3 -6,-0.4 -1,-0.2 -0.316 44.0-152.0 -78.6 168.7 5.5 39.1 7.5 53 53 A A > - 0 0 36 -3,-0.1 3,-2.3 -2,-0.1 4,-0.5 -0.893 38.5 -87.8-135.7 167.0 2.6 39.8 9.8 54 54 A R G > S+ 0 0 99 -2,-0.3 3,-1.2 1,-0.3 -2,-0.0 0.775 122.6 63.9 -45.2 -31.7 2.5 40.9 13.5 55 55 A E G 3 S+ 0 0 155 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.801 94.7 57.3 -68.6 -29.8 2.6 37.2 14.5 56 56 A D G < S+ 0 0 79 -3,-2.3 2,-0.7 -55,-0.1 -54,-0.6 0.564 87.0 92.4 -78.3 -8.3 6.1 36.6 13.1 57 57 A I E < -b 2 0A 6 -3,-1.2 -54,-0.2 -4,-0.5 3,-0.1 -0.796 56.0-169.0 -94.6 116.2 7.6 39.3 15.3 58 58 A K E S+ 0 0 88 -56,-2.5 2,-0.3 -2,-0.7 -55,-0.2 0.862 72.2 8.5 -74.1 -40.0 8.9 37.9 18.5 59 59 A K E -b 3 0A 42 -57,-0.7 -55,-2.2 190,-0.1 2,-0.4 -0.994 62.2-163.0-145.0 141.5 9.5 41.3 20.3 60 60 A V E -b 4 0A 3 -2,-0.3 14,-2.4 -57,-0.2 15,-1.2 -0.987 6.2-172.0-124.2 131.9 8.6 44.9 19.5 61 61 A V E -bd 5 75A 0 -57,-2.5 -55,-2.3 -2,-0.4 2,-0.4 -0.975 5.8-159.2-123.1 139.6 10.1 48.0 21.0 62 62 A V E +bd 6 76A 0 13,-2.2 15,-1.9 -2,-0.4 2,-0.2 -0.945 15.4 168.7-119.2 138.1 9.0 51.6 20.5 63 63 A T E +b 7 0A 0 -57,-2.9 -55,-2.3 -2,-0.4 15,-0.1 -0.735 30.4 60.2-132.8 179.9 11.1 54.7 21.2 64 64 A G S > S- 0 0 0 13,-0.4 3,-2.4 -2,-0.2 2,-1.2 -0.034 98.4 -36.8 90.2 169.7 10.9 58.4 20.4 65 65 A Y T 3 S+ 0 0 151 1,-0.3 -31,-0.3 2,-0.1 -2,-0.1 -0.553 137.2 34.7 -66.6 97.3 8.4 61.2 21.4 66 66 A G T 3 S+ 0 0 5 -2,-1.2 -1,-0.3 -4,-0.1 -2,-0.1 0.349 75.9 115.0 129.3 -0.2 5.3 59.1 21.2 67 67 A R S X S+ 0 0 79 -3,-2.4 3,-1.4 -59,-0.2 2,-0.2 0.937 79.2 57.2 -59.4 -50.9 6.6 55.8 22.4 68 68 A M T 3 S+ 0 0 77 -4,-0.3 3,-0.1 1,-0.3 -5,-0.0 -0.576 103.0 46.8 -66.0 151.0 4.2 56.3 25.3 69 69 A N T 3 S+ 0 0 158 -2,-0.2 2,-0.6 1,-0.1 -1,-0.3 0.433 93.9 103.0 82.1 -0.7 0.9 56.7 23.4 70 70 A Y X - 0 0 44 -3,-1.4 3,-0.5 -8,-0.1 2,-0.4 -0.908 64.0-146.4-118.6 106.4 1.9 53.6 21.4 71 71 A S T 3 + 0 0 100 -2,-0.6 -3,-0.0 1,-0.3 -4,-0.0 -0.971 62.9 23.7-115.9 131.0 0.1 50.4 22.4 72 72 A D T 3 + 0 0 114 -2,-0.4 2,-0.3 1,-0.1 -1,-0.3 0.351 63.3 122.4-140.9 147.6 1.4 48.0 22.2 73 73 A A < - 0 0 9 -3,-0.5 -12,-0.2 -6,-0.1 3,-0.1 -0.762 59.0-115.5-121.0 160.7 5.0 47.1 22.3 74 74 A D S S+ 0 0 64 -14,-2.4 2,-0.3 -2,-0.3 -13,-0.2 0.826 99.1 3.7 -68.9 -31.5 6.9 44.8 24.6 75 75 A K E -d 61 0A 90 -15,-1.2 -13,-2.2 2,-0.0 2,-0.4 -0.993 57.0-147.8-151.9 151.0 8.8 47.8 25.8 76 76 A Q E -d 62 0A 75 -2,-0.3 2,-0.4 -15,-0.2 -13,-0.2 -0.995 30.6-175.0-115.0 128.4 9.1 51.5 25.4 77 77 A I - 0 0 31 -15,-1.9 -13,-0.4 -2,-0.4 5,-0.1 -0.949 31.9 -88.7-132.8 144.4 12.7 52.7 25.7 78 78 A S > - 0 0 48 -2,-0.4 4,-2.1 -15,-0.1 5,-0.1 -0.092 28.1-136.1 -43.1 137.8 14.4 56.1 25.8 79 79 A E H > S+ 0 0 38 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.760 105.7 62.1 -71.5 -23.5 15.5 57.4 22.4 80 80 A L H > S+ 0 0 36 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.967 108.4 41.4 -61.6 -50.9 18.8 58.4 23.9 81 81 A S H > S+ 0 0 50 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.911 115.2 51.8 -62.6 -42.1 19.4 54.7 24.7 82 82 A C H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.917 109.7 46.5 -66.5 -43.8 18.1 53.6 21.4 83 83 A H H X S+ 0 0 9 -4,-2.7 4,-2.6 1,-0.2 5,-0.2 0.919 113.4 50.7 -64.0 -39.7 20.2 55.9 19.2 84 84 A A H X S+ 0 0 6 -4,-2.0 4,-2.6 -5,-0.3 -2,-0.2 0.930 112.6 45.9 -59.9 -47.4 23.3 54.9 21.2 85 85 A R H X S+ 0 0 63 -4,-2.4 4,-1.4 2,-0.2 -2,-0.2 0.940 114.8 47.0 -62.8 -47.8 22.6 51.2 20.8 86 86 A G H X S+ 0 0 0 -4,-2.6 4,-1.0 157,-0.3 -2,-0.2 0.910 114.8 45.8 -63.4 -42.4 21.9 51.5 17.1 87 87 A V H >X S+ 0 0 0 -4,-2.6 4,-3.5 -5,-0.2 3,-1.0 0.941 110.5 52.0 -66.5 -46.9 25.0 53.6 16.4 88 88 A N H 3< S+ 0 0 49 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.765 105.3 58.4 -63.0 -23.8 27.3 51.4 18.4 89 89 A F H 3< S+ 0 0 90 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.823 118.8 29.0 -70.9 -32.3 26.0 48.5 16.4 90 90 A I H << S+ 0 0 63 -3,-1.0 -2,-0.2 -4,-1.0 -3,-0.1 0.823 126.9 35.9 -96.8 -39.4 27.1 50.1 13.2 91 91 A I S >< S- 0 0 16 -4,-3.5 3,-0.7 -5,-0.1 -1,-0.2 -0.913 75.0-147.4-129.6 103.5 30.1 52.2 14.2 92 92 A P T 3 S+ 0 0 90 0, 0.0 117,-0.1 0, 0.0 -3,-0.1 -0.219 78.2 27.7 -68.4 157.8 32.6 51.0 16.8 93 93 A E T 3 S+ 0 0 126 1,-0.2 2,-0.4 19,-0.1 -5,-0.1 0.744 77.8 163.5 64.6 26.5 34.4 53.4 19.2 94 94 A T < + 0 0 0 -3,-0.7 -1,-0.2 1,-0.2 116,-0.2 -0.646 10.1 160.8 -77.6 130.5 31.6 56.0 19.0 95 95 A R + 0 0 53 114,-2.5 15,-2.4 112,-0.5 2,-0.4 0.522 62.1 45.0-123.9 -17.2 31.9 58.5 21.9 96 96 A T E -Ef 109 210B 0 113,-2.1 115,-2.7 13,-0.2 2,-0.5 -0.991 61.3-171.7-133.7 127.1 29.9 61.5 20.6 97 97 A I E -Ef 108 211B 0 11,-2.5 11,-2.9 -2,-0.4 2,-0.6 -0.976 4.4-166.2-120.5 128.9 26.5 61.3 19.0 98 98 A I E -Ef 107 212B 0 113,-2.9 115,-2.9 -2,-0.5 2,-0.7 -0.952 6.1-172.8-116.3 113.1 24.8 64.3 17.4 99 99 A D E -Ef 106 213B 9 7,-2.5 7,-2.2 -2,-0.6 2,-0.7 -0.908 2.4-176.9-111.1 105.7 21.2 63.8 16.7 100 100 A I E +E 105 0B 0 113,-2.0 116,-1.6 -2,-0.7 117,-0.4 -0.905 17.3 168.1-105.2 110.2 19.6 66.6 14.7 101 101 A G - 0 0 16 3,-2.6 29,-2.8 -2,-0.7 30,-0.3 -0.226 50.3 -74.7-108.0-161.2 15.9 66.0 14.2 102 102 A G S S+ 0 0 16 28,-0.2 29,-0.9 1,-0.2 32,-0.1 0.777 123.9 10.2 -70.1 -27.9 12.8 67.9 13.1 103 103 A Q S S+ 0 0 57 1,-0.2 2,-0.3 27,-0.2 -1,-0.2 0.319 125.8 26.9-139.6 4.4 12.4 70.0 16.2 104 104 A D - 0 0 28 20,-0.1 -3,-2.6 22,-0.0 2,-0.4 -0.990 56.5-136.0-158.4 170.4 15.5 69.6 18.3 105 105 A A E -EG 100 122B 1 17,-2.1 17,-2.5 -2,-0.3 2,-0.4 -0.998 20.7-171.1-132.9 138.5 19.2 68.8 18.5 106 106 A K E -EG 99 121B 11 -7,-2.2 -7,-2.5 -2,-0.4 2,-0.5 -0.969 11.0-160.0-129.0 141.3 20.8 66.5 21.0 107 107 A V E -EG 98 120B 0 13,-3.0 13,-1.9 -2,-0.4 2,-0.4 -0.986 12.8-168.1-122.3 123.0 24.5 65.8 21.8 108 108 A L E -EG 97 119B 3 -11,-2.9 -11,-2.5 -2,-0.5 2,-0.5 -0.899 8.7-159.3-107.0 132.8 25.3 62.5 23.7 109 109 A K E -EG 96 118B 34 9,-2.6 8,-3.6 -2,-0.4 9,-1.4 -0.951 18.3-163.4-107.5 132.5 28.6 61.7 25.2 110 110 A L E - G 0 116B 4 -15,-2.4 6,-0.2 -2,-0.5 2,-0.1 -0.827 12.8-131.5-115.8 152.8 29.1 58.0 25.8 111 111 A D > - 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0 0 31 -5,-2.0 2,-0.2 1,-0.1 -1,-0.1 -0.438 50.6 -87.6 -59.9 149.7 -11.0 77.4 18.6 450 181 B K >> - 0 0 117 1,-0.1 4,-2.0 -25,-0.1 3,-0.6 -0.473 31.3-134.9 -66.5 132.2 -12.5 80.8 19.0 451 182 B I H 3> S+ 0 0 61 1,-0.3 4,-2.8 2,-0.2 5,-0.2 0.876 104.9 57.0 -55.7 -40.3 -10.3 83.5 17.4 452 183 B E H 3> S+ 0 0 33 1,-0.2 4,-2.0 2,-0.2 -29,-0.3 0.880 108.4 47.3 -61.9 -36.0 -10.7 85.8 20.5 453 184 B D H <> S+ 0 0 13 -3,-0.6 -26,-1.8 2,-0.2 4,-1.7 0.845 109.9 53.2 -73.3 -34.2 -9.4 83.0 22.7 454 185 B I H X S+ 0 0 3 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.953 111.0 46.4 -60.5 -49.7 -6.4 82.4 20.3 455 186 B V H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 5,-0.2 0.914 107.0 57.6 -63.1 -41.6 -5.5 86.0 20.4 456 187 B A H X S+ 0 0 9 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.922 108.5 46.5 -55.4 -41.7 -5.8 86.1 24.2 457 188 B G H X S+ 0 0 1 -4,-1.7 4,-2.1 1,-0.2 -28,-0.3 0.858 109.3 54.9 -71.8 -32.3 -3.2 83.3 24.5 458 189 B I H X S+ 0 0 0 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.929 107.8 49.6 -62.6 -44.5 -0.9 85.1 22.0 459 190 B H H X S+ 0 0 5 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.920 109.3 52.3 -62.3 -42.2 -1.0 88.2 24.1 460 191 B T H X S+ 0 0 9 -4,-2.1 4,-2.8 -5,-0.2 -1,-0.2 0.877 105.1 54.8 -61.1 -40.8 -0.1 86.1 27.2 461 192 B S H X S+ 0 0 8 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.958 111.5 44.9 -57.7 -49.6 2.9 84.5 25.4 462 193 B V H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 5,-0.3 0.938 113.5 49.4 -59.1 -47.0 4.3 88.0 24.6 463 194 B A H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 5,-0.3 0.893 108.8 53.0 -64.0 -39.6 3.6 89.3 28.2 464 195 B K H X S+ 0 0 96 -4,-2.8 4,-1.3 2,-0.2 -1,-0.2 0.930 111.6 46.5 -59.8 -44.9 5.3 86.2 29.7 465 196 B R H X S+ 0 0 70 -4,-2.1 4,-1.1 -5,-0.2 3,-0.3 0.969 118.3 39.5 -59.7 -55.8 8.4 86.8 27.7 466 197 B V H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.870 110.6 58.1 -69.7 -33.4 8.7 90.5 28.3 467 198 B S H X S+ 0 0 4 -4,-2.7 4,-2.5 -5,-0.3 -1,-0.2 0.871 100.2 58.6 -68.6 -29.4 7.7 90.4 32.0 468 199 B S H X S+ 0 0 64 -4,-1.3 4,-1.4 -3,-0.3 -1,-0.2 0.917 106.1 49.2 -64.2 -40.8 10.6 88.0 32.6 469 200 B L H X S+ 0 0 1 -4,-1.1 4,-1.4 1,-0.2 3,-0.3 0.939 111.2 49.3 -56.2 -52.2 12.9 90.7 31.4 470 201 B V H X S+ 0 0 1 -4,-2.2 4,-1.5 1,-0.2 -2,-0.2 0.863 107.9 53.4 -58.2 -39.6 11.2 93.3 33.6 471 202 B K H < S+ 0 0 118 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.824 101.6 60.9 -71.6 -27.7 11.5 91.1 36.7 472 203 B R H < S+ 0 0 160 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.935 112.4 35.5 -63.6 -46.4 15.2 90.6 36.2 473 204 B I H < S- 0 0 16 -4,-1.4 -1,-0.2 1,-0.0 -2,-0.2 0.714 120.4-114.0 -78.6 -19.6 15.9 94.3 36.5 474 205 B G < - 0 0 27 -4,-1.5 2,-0.2 -5,-0.2 -3,-0.1 0.465 25.3 -96.3 91.9 125.6 13.2 94.7 39.2 475 206 B V - 0 0 54 -4,-0.1 2,-0.4 24,-0.1 4,-0.1 -0.544 40.0-178.9 -73.1 137.8 10.0 96.7 38.7 476 207 B Q - 0 0 109 -2,-0.2 -112,-0.4 2,-0.1 -111,-0.2 -0.970 33.6 -89.2-136.6 122.6 10.1 100.3 40.1 477 208 B R S S+ 0 0 139 -2,-0.4 2,-0.1 -113,-0.2 26,-0.1 -0.415 102.9 54.2 -76.3 152.9 7.0 102.5 39.8 478 209 B N S S- 0 0 35 -113,-0.1 -114,-2.5 24,-0.1 -113,-2.0 0.523 74.4-172.6 -76.6 142.1 6.0 104.3 37.9 479 210 B V E -n 365 0D 2 23,-0.5 25,-2.8 -115,-0.2 2,-0.4 -0.881 4.2-173.7-100.2 127.3 6.2 101.7 35.1 480 211 B V E -np 366 504D 0 -115,-2.6 -113,-2.8 -2,-0.5 2,-0.4 -0.965 13.4-149.6-125.3 138.8 5.4 103.0 31.6 481 212 B M E +n 367 0D 0 23,-1.6 2,-0.2 -2,-0.4 -113,-0.2 -0.922 22.7 164.9-107.9 135.5 5.1 101.1 28.3 482 213 B V E +n 368 0D 0 -115,-2.5 -113,-2.1 -2,-0.4 28,-0.2 -0.764 25.9 83.1-133.1 179.0 6.0 102.7 25.0 483 214 B G S > S- 0 0 4 26,-2.0 3,-0.9 -115,-0.2 4,-0.3 -0.187 89.1 -74.3 102.4 157.9 6.6 101.3 21.5 484 215 B G G > S+ 0 0 24 1,-0.2 3,-1.9 26,-0.2 4,-0.2 0.874 129.8 59.3 -54.1 -40.0 4.3 100.4 18.7 485 216 B V G > S+ 0 0 14 -116,-1.7 3,-2.2 1,-0.3 -1,-0.2 0.790 90.1 71.2 -67.4 -24.2 3.2 97.2 20.5 486 217 B A G < S+ 0 0 5 -3,-0.9 -1,-0.3 -117,-0.4 -2,-0.2 0.629 82.9 71.5 -66.4 -12.4 2.0 99.4 23.5 487 218 B R G < S+ 0 0 171 -3,-1.9 2,-0.9 -4,-0.3 -1,-0.3 0.668 78.1 91.3 -72.6 -17.1 -0.9 100.5 21.2 488 219 B N <> - 0 0 15 -3,-2.2 4,-1.9 -4,-0.2 3,-0.3 -0.733 64.3-165.2 -82.7 105.2 -2.2 96.9 21.7 489 220 B S H > S+ 0 0 50 -2,-0.9 4,-2.6 1,-0.2 5,-0.2 0.823 86.3 58.1 -64.2 -32.9 -4.4 97.3 24.7 490 221 B G H > S+ 0 0 4 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.908 105.8 48.9 -62.2 -43.7 -4.5 93.5 25.1 491 222 B I H > S+ 0 0 0 -3,-0.3 4,-2.7 -6,-0.2 -2,-0.2 0.913 110.3 51.4 -62.0 -42.6 -0.8 93.4 25.5 492 223 B V H X S+ 0 0 21 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.950 111.4 47.0 -63.1 -46.5 -0.8 96.2 28.0 493 224 B R H X S+ 0 0 102 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.948 113.2 48.5 -57.7 -49.3 -3.5 94.3 30.1 494 225 B A H X S+ 0 0 4 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.901 111.5 50.7 -60.1 -39.7 -1.6 91.1 29.9 495 226 B M H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 5,-0.4 0.928 108.2 51.2 -62.5 -44.4 1.7 92.8 30.9 496 227 B A H X>S+ 0 0 31 -4,-2.5 4,-1.1 1,-0.2 5,-1.0 0.912 111.8 49.0 -63.1 -38.1 0.0 94.5 33.9 497 228 B R H <5S+ 0 0 122 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.946 113.0 46.1 -62.1 -49.3 -1.2 91.0 34.9 498 229 B E H <5S+ 0 0 44 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.833 119.2 37.2 -69.9 -35.5 2.2 89.3 34.6 499 230 B I H <5S- 0 0 11 -4,-2.5 -1,-0.2 2,-0.2 -2,-0.2 0.584 99.5-136.7 -92.8 -10.1 4.4 91.9 36.4 500 231 B N T <5 + 0 0 144 -4,-1.1 2,-0.3 -5,-0.4 -3,-0.2 0.902 65.4 107.5 59.7 46.1 1.6 92.6 38.9 501 232 B T S S+ 0 0 51 1,-0.1 3,-1.7 2,-0.0 4,-0.3 -0.424 70.5 154.9-121.6 56.3 1.0 108.3 21.9 509 240 B P G > S+ 0 0 10 0, 0.0 -26,-2.0 0, 0.0 3,-0.8 0.827 71.7 50.3 -54.3 -39.0 3.0 105.2 23.0 510 241 B Q G 3 S+ 0 0 27 1,-0.2 -26,-0.2 -28,-0.2 3,-0.2 0.592 109.2 53.4 -78.1 -8.3 4.7 104.7 19.6 511 242 B L G <> S+ 0 0 13 -3,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.278 71.7 100.0-114.2 7.8 5.8 108.4 19.4 512 243 B T H <> S+ 0 0 0 -3,-0.8 4,-2.2 -4,-0.3 -157,-0.4 0.779 83.3 54.2 -69.8 -28.0 7.6 108.9 22.7 513 244 B G H > S+ 0 0 0 -3,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.910 110.7 44.3 -67.2 -46.0 11.0 108.5 21.0 514 245 B A H > S+ 0 0 0 2,-0.2 4,-1.7 -4,-0.2 -229,-0.3 0.818 113.6 52.4 -70.1 -29.6 10.3 111.2 18.3 515 246 B L H X S+ 0 0 1 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.943 109.0 48.9 -68.7 -47.7 8.9 113.4 21.1 516 247 B G H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 5,-0.2 0.906 110.4 51.4 -56.7 -43.4 12.1 113.0 23.1 517 248 B A H X S+ 0 0 0 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.880 108.5 51.2 -63.1 -38.3 14.2 113.8 20.1 518 249 B A H X S+ 0 0 0 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.823 107.9 53.0 -68.4 -32.0 12.1 117.0 19.4 519 250 B L H X S+ 0 0 4 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.842 107.9 49.2 -71.7 -36.1 12.7 118.0 23.1 520 251 B Y H X S+ 0 0 63 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.827 109.4 54.7 -67.8 -31.0 16.4 117.6 22.7 521 252 B A H X S+ 0 0 0 -4,-1.6 4,-1.9 -5,-0.2 -2,-0.2 0.907 106.2 50.1 -63.6 -41.0 15.9 119.7 19.6 522 253 B F H X S+ 0 0 44 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.892 107.7 53.8 -66.6 -39.7 14.2 122.3 21.7 523 254 B D H X S+ 0 0 68 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.949 109.1 49.1 -53.1 -52.3 17.2 122.2 24.1 524 255 B E H X S+ 0 0 58 -4,-2.1 4,-1.4 1,-0.2 -2,-0.2 0.841 107.3 54.7 -57.5 -38.5 19.4 122.9 21.1 525 256 B A H < S+ 0 0 2 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.893 109.3 46.4 -68.4 -40.2 17.3 125.8 19.9 526 257 B K H >< S+ 0 0 131 -4,-2.0 3,-0.6 1,-0.2 -1,-0.2 0.922 106.8 60.0 -62.2 -43.8 17.6 127.6 23.3 527 258 B E H 3< S+ 0 0 130 -4,-2.3 2,-0.8 1,-0.3 -2,-0.2 0.806 100.5 55.8 -58.4 -32.4 21.3 126.9 23.3 528 259 B S T 3< 0 0 65 -4,-1.4 -1,-0.3 -3,-0.1 -2,-0.1 -0.441 360.0 360.0 -95.0 57.4 21.6 128.9 20.1 529 260 B Q < 0 0 186 -2,-0.8 -3,-0.1 -3,-0.6 -2,-0.0 -0.321 360.0 360.0 -61.5 360.0 20.0 131.9 21.6