==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HALOPEROXIDASE 27-MAR-98 1A8Q . COMPND 2 MOLECULE: BROMOPEROXIDASE A1; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES AUREOFACIENS; . AUTHOR B.HOFMANN,S.TOELZER,I.PELLETIER,J.ALTENBUCHNER,K.-H.VAN PEE, . 274 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11088.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 201 73.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 31 11.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 9 3.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 16 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 92 33.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.8 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 1 0 0 1 0 1 0 1 1 2 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 3 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 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 P 0 0 81 0, 0.0 12,-2.5 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 166.8 46.7 16.6 -13.5 2 2 A I E -A 12 0A 71 10,-0.2 2,-0.5 2,-0.0 10,-0.2 -0.993 360.0-162.9-121.7 135.8 43.3 15.3 -14.7 3 3 A C E -A 11 0A 1 8,-2.8 8,-3.3 -2,-0.4 2,-0.6 -0.967 18.0-143.9-110.5 127.9 42.3 12.1 -16.5 4 4 A T E -A 10 0A 83 -2,-0.5 6,-0.2 6,-0.2 2,-0.0 -0.856 19.7-141.3 -95.5 126.3 39.0 12.2 -18.2 5 5 A T > - 0 0 8 4,-2.8 3,-2.3 -2,-0.6 70,-0.1 -0.246 29.8 -94.7 -78.6 177.1 37.1 8.9 -18.0 6 6 A R T 3 S+ 0 0 102 1,-0.3 -1,-0.1 68,-0.2 69,-0.0 0.715 127.2 50.7 -60.3 -24.0 35.0 7.2 -20.6 7 7 A D T 3 S- 0 0 103 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.288 122.7-101.8 -96.3 0.9 32.0 8.8 -19.0 8 8 A G S < S+ 0 0 50 -3,-2.3 2,-0.2 1,-0.3 -2,-0.1 0.548 73.8 144.5 89.2 11.9 33.4 12.4 -19.0 9 9 A V - 0 0 13 1,-0.0 -4,-2.8 52,-0.0 2,-0.7 -0.595 47.8-131.5 -83.4 142.7 34.3 12.3 -15.3 10 10 A E E -A 4 0A 100 -2,-0.2 51,-2.3 -6,-0.2 2,-0.6 -0.849 18.8-165.0 -99.3 118.6 37.4 14.2 -14.3 11 11 A I E -A 3 0A 2 -8,-3.3 -8,-2.8 -2,-0.7 2,-0.3 -0.889 11.1-147.4-102.2 118.9 39.7 12.2 -12.1 12 12 A F E +A 2 0A 51 -2,-0.6 41,-2.5 41,-0.3 2,-0.3 -0.651 25.6 170.0 -81.9 145.2 42.4 14.3 -10.4 13 13 A Y E -B 52 0B 16 -12,-2.5 2,-0.4 -2,-0.3 39,-0.2 -0.989 33.2-130.4-153.7 156.5 45.8 12.7 -9.7 14 14 A K E -B 51 0B 22 37,-2.3 37,-2.0 -2,-0.3 2,-0.4 -0.840 21.3-172.0 -99.5 139.5 49.3 13.4 -8.6 15 15 A D E +B 50 0B 47 -2,-0.4 2,-0.4 35,-0.2 35,-0.2 -0.910 11.7 175.3-140.2 102.5 52.1 12.0 -10.8 16 16 A W E -B 49 0B 89 33,-3.0 33,-2.5 -2,-0.4 -2,-0.0 -0.933 36.7 -10.3-114.2 140.6 55.6 12.3 -9.4 17 17 A G - 0 0 26 -2,-0.4 2,-0.3 31,-0.2 31,-0.2 -0.111 69.0 -85.0 82.5-178.2 58.9 11.1 -10.7 18 18 A Q S S+ 0 0 168 29,-0.4 2,-0.3 25,-0.2 -2,-0.0 -0.947 73.6 64.3-135.0 147.9 60.2 8.7 -13.3 19 19 A G S S- 0 0 47 -2,-0.3 28,-0.2 28,-0.1 27,-0.1 -0.844 92.3 -12.6 130.5-172.4 60.7 4.9 -13.1 20 20 A R S S- 0 0 34 26,-0.4 28,-1.9 -2,-0.3 2,-0.2 -0.544 82.0-106.9 -66.7 140.1 58.4 1.9 -12.7 21 21 A P E -c 48 0B 11 0, 0.0 68,-2.3 0, 0.0 2,-0.5 -0.410 30.4-172.1 -79.4 138.1 55.0 3.0 -11.7 22 22 A V E -cd 49 89B 0 26,-3.0 28,-2.7 -2,-0.2 2,-0.5 -0.990 12.9-162.5-122.7 114.1 53.5 2.6 -8.2 23 23 A V E -cd 50 90B 0 66,-2.5 68,-2.7 -2,-0.5 2,-0.4 -0.914 5.1-151.8-109.8 123.8 49.8 3.6 -8.2 24 24 A F E -cd 51 91B 0 26,-3.1 28,-0.9 -2,-0.5 2,-0.5 -0.785 4.3-160.5-102.5 136.2 48.2 4.3 -4.8 25 25 A I E - d 0 92B 0 66,-2.9 68,-2.5 -2,-0.4 71,-0.2 -0.944 17.4-144.7-124.2 108.6 44.5 3.7 -4.2 26 26 A H - 0 0 0 -2,-0.5 2,-0.1 26,-0.5 6,-0.1 -0.249 6.3-125.0 -78.3 168.3 43.1 5.6 -1.2 27 27 A G > - 0 0 0 4,-0.2 3,-1.6 68,-0.1 67,-0.1 -0.307 46.1 -38.3-100.7-175.7 40.4 4.6 1.4 28 28 A W T 3 S+ 0 0 13 1,-0.3 67,-0.1 -2,-0.1 -1,-0.1 -0.676 115.0 2.0 -87.4 147.6 37.2 6.3 2.6 29 29 A P T 3 S+ 0 0 0 0, 0.0 -1,-0.3 0, 0.0 158,-0.2 -0.618 114.8 74.3-102.5 47.4 36.6 9.1 3.1 30 30 A L < - 0 0 0 -3,-1.6 2,-0.3 27,-0.1 28,-0.2 0.229 59.0-137.8-100.6-148.2 39.9 10.5 2.0 31 31 A N > - 0 0 7 26,-0.1 3,-2.1 22,-0.1 -4,-0.2 -0.877 48.6 -61.3-163.0-174.7 41.8 11.2 -1.2 32 32 A G G > S+ 0 0 0 1,-0.3 3,-2.1 -2,-0.3 21,-0.1 0.688 118.4 75.7 -61.5 -17.2 45.2 10.9 -2.7 33 33 A D G > S+ 0 0 50 1,-0.3 3,-1.3 2,-0.2 -1,-0.3 0.726 79.4 75.1 -64.1 -16.1 46.7 13.3 -0.2 34 34 A A G < S+ 0 0 6 -3,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.521 97.8 47.6 -68.3 -3.9 46.5 10.3 2.3 35 35 A W G <> S+ 0 0 3 -3,-2.1 4,-2.8 1,-0.1 3,-0.3 0.191 71.1 111.8-120.1 9.1 49.5 8.9 0.5 36 36 A Q H <> S+ 0 0 83 -3,-1.3 4,-2.1 1,-0.2 5,-0.2 0.865 79.7 53.0 -57.9 -37.3 51.9 11.9 0.3 37 37 A D H > S+ 0 0 61 -4,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.907 114.6 41.5 -59.7 -45.2 54.4 10.3 2.7 38 38 A Q H > S+ 0 0 0 -3,-0.3 4,-2.6 2,-0.2 5,-0.3 0.837 109.6 58.0 -72.0 -33.8 54.5 7.1 0.6 39 39 A L H X S+ 0 0 0 -4,-2.8 4,-2.2 2,-0.2 5,-0.2 0.954 110.1 44.2 -61.2 -44.2 54.6 9.0 -2.7 40 40 A K H X S+ 0 0 122 -4,-2.1 4,-2.8 -5,-0.2 5,-0.2 0.920 111.8 54.1 -65.0 -46.8 57.8 10.8 -1.6 41 41 A A H X S+ 0 0 20 -4,-1.9 4,-1.0 1,-0.2 -1,-0.2 0.906 112.5 41.8 -55.5 -50.0 59.3 7.5 -0.3 42 42 A V H <>S+ 0 0 0 -4,-2.6 5,-2.3 2,-0.2 3,-0.2 0.891 114.2 50.2 -70.4 -33.8 58.9 5.6 -3.5 43 43 A V H ><5S+ 0 0 36 -4,-2.2 3,-1.9 -5,-0.3 -2,-0.2 0.944 108.1 53.6 -72.7 -32.0 59.9 8.5 -5.8 44 44 A D H 3<5S+ 0 0 113 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.786 107.1 53.7 -69.7 -21.8 63.1 9.0 -3.7 45 45 A A T 3<5S- 0 0 52 -4,-1.0 -1,-0.3 -3,-0.2 -2,-0.2 0.344 131.6 -92.1 -91.8 5.0 63.8 5.3 -4.2 46 46 A G T < 5S+ 0 0 48 -3,-1.9 -26,-0.4 1,-0.3 -3,-0.2 0.591 85.4 118.9 94.6 23.4 63.5 5.6 -8.0 47 47 A Y < - 0 0 30 -5,-2.3 2,-0.5 -28,-0.2 -29,-0.4 -0.571 65.1-114.9-110.8 164.6 59.9 4.8 -8.8 48 48 A R E - c 0 21B 59 -28,-1.9 -26,-3.0 -31,-0.2 2,-0.5 -0.941 33.7-155.4 -95.4 131.0 57.1 6.9 -10.4 49 49 A G E +Bc 16 22B 0 -33,-2.5 -33,-3.0 -2,-0.5 2,-0.4 -0.912 14.4 179.2-117.4 129.2 54.4 7.5 -7.8 50 50 A I E +Bc 15 23B 0 -28,-2.7 -26,-3.1 -2,-0.5 2,-0.4 -0.972 5.7 177.3-128.1 137.7 50.8 8.2 -8.8 51 51 A A E -Bc 14 24B 0 -37,-2.0 -37,-2.3 -2,-0.4 2,-0.2 -0.930 9.3-166.3-145.2 118.6 47.8 8.8 -6.6 52 52 A H E -B 13 0B 3 -28,-0.9 2,-0.5 -2,-0.4 -26,-0.5 -0.590 21.8-121.8-100.2 160.9 44.4 9.6 -7.9 53 53 A D - 0 0 2 -41,-2.5 -41,-0.3 -2,-0.2 3,-0.1 -0.927 33.7-118.9-101.2 125.6 41.3 10.9 -6.1 54 54 A R > - 0 0 3 -2,-0.5 3,-1.9 1,-0.2 6,-0.3 -0.224 47.4 -77.3 -59.5 150.7 38.3 8.6 -6.4 55 55 A R T 3 S+ 0 0 4 1,-0.3 -1,-0.2 11,-0.1 3,-0.1 -0.134 123.5 20.3 -47.4 139.0 35.2 10.1 -8.1 56 56 A G T 3 S+ 0 0 1 5,-2.0 132,-2.3 1,-0.2 2,-0.3 0.672 110.6 93.6 73.4 12.6 33.5 12.4 -5.7 57 57 A H S X S- 0 0 0 -3,-1.9 3,-2.4 130,-0.2 -1,-0.2 -0.932 86.8 -17.3-134.3 156.8 36.5 12.8 -3.5 58 58 A G T 3 S- 0 0 15 125,-0.4 -27,-0.1 -2,-0.3 -6,-0.0 -0.256 126.4 -22.6 54.6-125.5 39.3 15.3 -3.3 59 59 A H T 3 S+ 0 0 134 -47,-0.1 -1,-0.3 2,-0.0 2,-0.1 0.185 107.2 110.9-106.0 14.7 39.5 17.3 -6.5 60 60 A S S < S- 0 0 9 -3,-2.4 -49,-0.2 -6,-0.3 -6,-0.1 -0.413 87.8 -65.5 -82.8 167.2 37.8 14.8 -8.8 61 61 A T - 0 0 44 -51,-2.3 2,-2.3 1,-0.2 -5,-2.0 -0.201 46.3-124.3 -52.1 134.8 34.3 15.6 -10.2 62 62 A P - 0 0 103 0, 0.0 -1,-0.2 0, 0.0 -7,-0.1 -0.455 47.6-177.2 -79.4 74.5 31.7 15.8 -7.4 63 63 A V - 0 0 16 -2,-2.3 128,-0.2 1,-0.1 127,-0.1 -0.332 33.3-150.0 -76.5 159.2 29.5 13.1 -9.0 64 64 A W S S+ 0 0 165 126,-0.1 3,-0.2 -2,-0.1 2,-0.2 0.821 75.6 40.1 -89.3 -39.7 26.2 11.8 -8.0 65 65 A D S S+ 0 0 97 1,-0.2 3,-0.1 3,-0.0 -2,-0.1 -0.546 80.3 57.3-114.3 176.5 26.4 8.3 -9.3 66 66 A G + 0 0 18 -2,-0.2 2,-1.8 1,-0.2 -1,-0.2 0.697 48.7 149.6 81.8 23.2 28.7 5.4 -9.8 67 67 A Y + 0 0 16 -3,-0.2 2,-0.3 4,-0.1 -1,-0.2 -0.504 43.6 101.9 -88.4 69.2 29.7 4.8 -6.2 68 68 A D S > S- 0 0 60 -2,-1.8 4,-2.4 -3,-0.1 3,-0.3 -0.975 83.1-109.5-146.3 157.9 30.2 1.1 -6.7 69 69 A F H > S+ 0 0 5 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.753 113.1 57.4 -66.2 -32.9 33.3 -1.1 -7.2 70 70 A D H > S+ 0 0 58 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.938 111.6 43.7 -61.4 -42.4 32.8 -1.8 -10.9 71 71 A T H > S+ 0 0 23 -3,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.932 113.3 50.8 -67.9 -44.5 32.8 1.9 -11.7 72 72 A F H X S+ 0 0 2 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.910 111.9 48.3 -57.5 -42.9 35.8 2.6 -9.4 73 73 A A H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.867 111.4 48.9 -65.7 -35.6 37.7 -0.2 -11.1 74 74 A D H X S+ 0 0 25 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.851 109.1 52.8 -72.6 -36.3 36.8 1.1 -14.6 75 75 A D H X S+ 0 0 8 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.935 110.1 48.7 -62.5 -41.4 37.9 4.6 -13.6 76 76 A L H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 5,-0.3 0.929 109.4 53.2 -62.5 -41.7 41.2 3.1 -12.5 77 77 A N H X S+ 0 0 35 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.905 106.4 52.4 -59.1 -40.5 41.4 1.3 -15.9 78 78 A D H X S+ 0 0 30 -4,-2.1 4,-2.7 2,-0.2 -1,-0.2 0.907 110.1 48.4 -64.0 -37.9 40.9 4.6 -17.7 79 79 A L H X S+ 0 0 0 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.933 113.5 45.7 -68.9 -44.0 43.8 6.2 -15.8 80 80 A L H <>S+ 0 0 0 -4,-2.6 5,-2.4 1,-0.2 4,-0.3 0.889 117.1 45.6 -67.6 -35.2 46.2 3.3 -16.4 81 81 A T H ><5S+ 0 0 64 -4,-2.5 3,-0.7 -5,-0.3 -2,-0.2 0.913 109.9 52.3 -73.5 -42.7 45.2 3.2 -20.1 82 82 A D H 3<5S+ 0 0 99 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.878 118.4 37.5 -59.8 -42.9 45.4 6.9 -20.6 83 83 A L T 3<5S- 0 0 39 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.461 106.0-133.9 -84.9 -4.6 49.0 7.0 -19.2 84 84 A D T < 5 - 0 0 102 -3,-0.7 2,-0.3 -4,-0.3 -3,-0.2 0.915 36.2-175.1 46.7 56.6 49.7 3.6 -20.8 85 85 A L < + 0 0 4 -5,-2.4 2,-0.3 -6,-0.1 -1,-0.2 -0.617 8.5 179.2 -86.3 137.7 51.3 2.3 -17.6 86 86 A R + 0 0 140 -2,-0.3 26,-0.1 1,-0.2 25,-0.1 -0.932 59.3 27.4-132.5 158.6 52.9 -1.1 -17.5 87 87 A D S S+ 0 0 76 -2,-0.3 25,-0.2 23,-0.3 2,-0.2 0.900 86.2 173.8 59.7 38.5 54.7 -3.2 -14.9 88 88 A V E - e 0 112B 0 23,-2.7 25,-3.1 -3,-0.2 26,-1.4 -0.506 32.9-149.6 -83.6 146.5 52.7 -1.4 -12.3 89 89 A T E -de 22 114B 0 -68,-2.3 -66,-2.5 -2,-0.2 2,-0.4 -0.972 15.6-154.6-104.9 125.9 52.5 -2.1 -8.5 90 90 A L E -de 23 115B 0 24,-1.6 26,-2.4 -2,-0.5 2,-0.5 -0.825 8.9-169.7 -98.6 134.3 49.0 -1.2 -7.2 91 91 A V E -de 24 116B 0 -68,-2.7 -66,-2.9 -2,-0.4 2,-0.4 -0.991 10.2-176.5-125.7 121.1 49.0 -0.3 -3.5 92 92 A A E -de 25 117B 0 24,-2.7 26,-3.2 -2,-0.5 2,-0.4 -0.924 14.7-155.9-125.6 146.4 45.6 0.1 -1.8 93 93 A H E > - e 0 118B 8 -68,-2.5 3,-2.1 -2,-0.4 26,-0.2 -0.954 58.3 -40.4-117.4 141.4 44.3 1.0 1.6 94 94 A S T > S+ 0 0 9 24,-1.9 3,-2.1 -2,-0.4 27,-1.3 -0.104 133.8 4.9 55.0-126.2 41.0 0.1 3.2 95 95 A M T >> S+ 0 0 0 1,-0.3 3,-1.3 2,-0.2 4,-1.1 0.772 120.7 76.0 -65.6 -15.8 38.1 0.2 0.7 96 96 A G H <> S+ 0 0 0 -3,-2.1 4,-2.2 1,-0.3 -1,-0.3 0.830 83.3 67.8 -57.4 -28.5 40.7 1.0 -2.0 97 97 A G H <> S+ 0 0 0 -3,-2.1 4,-2.7 1,-0.2 -1,-0.3 0.841 96.0 53.2 -64.2 -28.7 41.5 -2.8 -1.7 98 98 A G H <> S+ 0 0 0 -3,-1.3 4,-2.4 -4,-0.4 -1,-0.2 0.829 107.1 50.8 -72.9 -37.7 38.1 -3.5 -3.2 99 99 A E H X S+ 0 0 2 -4,-1.1 4,-2.0 2,-0.2 -2,-0.2 0.927 113.1 46.8 -60.0 -41.5 38.9 -1.2 -6.2 100 100 A L H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.971 114.4 46.5 -66.0 -48.7 42.2 -3.1 -6.6 101 101 A A H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.898 113.9 46.7 -62.2 -45.4 40.5 -6.5 -6.4 102 102 A R H X S+ 0 0 41 -4,-2.4 4,-2.3 1,-0.2 5,-0.3 0.872 107.7 57.7 -71.1 -29.2 37.7 -5.6 -8.8 103 103 A Y H X>S+ 0 0 4 -4,-2.0 4,-2.9 -5,-0.2 5,-0.6 0.948 109.4 45.3 -60.0 -45.1 40.2 -4.1 -11.2 104 104 A V H X5S+ 0 0 3 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.929 114.2 49.8 -62.6 -43.2 42.0 -7.5 -11.3 105 105 A G H <5S+ 0 0 27 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.866 122.6 30.3 -63.4 -39.1 38.6 -9.3 -11.6 106 106 A R H <5S+ 0 0 120 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.787 134.9 22.1 -91.0 -40.0 37.4 -7.1 -14.5 107 107 A H H <5S- 0 0 67 -4,-2.9 3,-0.4 -5,-0.3 -3,-0.2 0.491 96.1-137.6-111.2 -11.0 40.5 -6.1 -16.4 108 108 A G << - 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