==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JUL-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 30-MAR-12 4AP1 . COMPND 2 MOLECULE: STEROID MONOOXYGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOCOCCUS RHODOCHROUS; . AUTHOR S.FRANCESCHINI,H.L.VAN BEEK,C.MARTINOLI,A.PENNETTA,M.W.FRAAI . 523 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21484.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 359 68.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 50 9.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 41 7.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 41 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 60 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 140 26.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.0 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 2 0 2 0 0 1 1 0 1 2 2 1 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 3 3 2 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 . 5 1 1 3 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 ANTIPARALLEL BRIDGES PER LADDER . 3 1 0 1 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 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 20 A T 0 0 134 0, 0.0 127,-2.9 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 4.6 -6.9 36.0 -11.9 2 21 A S E +a 128 0A 76 125,-0.2 2,-0.2 116,-0.0 127,-0.2 -0.974 360.0 169.9-121.7 139.5 -10.1 34.2 -12.6 3 22 A Y E -a 129 0A 47 125,-3.0 127,-1.1 -2,-0.4 25,-0.2 -0.809 41.7-121.5-135.5 168.0 -10.7 31.7 -15.6 4 23 A D E S+ 0 0 35 23,-1.5 127,-2.1 1,-0.3 126,-0.5 0.932 99.1 19.3 -78.2 -48.3 -13.3 29.2 -16.8 5 24 A V E -ab 131 28A 0 22,-2.2 24,-2.0 125,-0.2 2,-0.5 -0.966 61.1-160.7-124.2 137.6 -10.8 26.3 -16.8 6 25 A V E -ab 132 29A 0 125,-2.4 127,-3.3 -2,-0.4 2,-0.4 -0.987 16.8-162.9-111.3 124.6 -7.5 25.8 -15.1 7 26 A V E -ab 133 30A 0 22,-2.3 24,-2.2 -2,-0.5 2,-0.6 -0.880 8.5-148.8-107.3 136.2 -5.5 23.0 -16.7 8 27 A V E +ab 134 31A 16 125,-2.3 127,-2.4 -2,-0.4 24,-0.2 -0.911 65.3 14.2-105.9 113.3 -2.5 21.3 -15.1 9 28 A G - 0 0 8 22,-2.8 23,-0.1 -2,-0.6 22,-0.1 0.020 58.7-132.8 106.4 149.8 0.2 20.2 -17.4 10 29 A A + 0 0 1 4,-0.1 28,-2.4 26,-0.1 29,-0.2 -0.178 63.0 109.4-133.1 36.8 1.1 20.9 -21.1 11 30 A G S > S- 0 0 13 124,-0.5 4,-2.5 27,-0.2 5,-0.3 -0.068 94.6 -54.0 -89.0-158.0 1.8 17.5 -22.7 12 31 A I H > S+ 0 0 19 26,-0.3 4,-1.5 1,-0.2 5,-0.2 0.907 140.2 42.2 -44.2 -51.4 -0.4 15.7 -25.2 13 32 A A H > S+ 0 0 12 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.954 114.9 46.3 -67.7 -53.5 -3.5 16.0 -23.0 14 33 A G H > S+ 0 0 0 121,-0.4 4,-2.3 1,-0.2 -1,-0.2 0.877 110.9 52.6 -57.0 -44.7 -3.1 19.6 -21.7 15 34 A L H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.876 110.9 46.5 -63.0 -41.1 -2.3 21.1 -25.1 16 35 A Y H X S+ 0 0 13 -4,-1.5 4,-2.9 -5,-0.3 -1,-0.2 0.901 109.2 56.8 -68.7 -36.6 -5.5 19.5 -26.6 17 36 A A H X S+ 0 0 0 -4,-2.3 4,-3.0 2,-0.2 5,-0.3 0.933 105.3 50.5 -56.7 -48.0 -7.4 20.8 -23.6 18 37 A I H X S+ 0 0 1 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.953 114.5 44.6 -57.1 -50.8 -6.4 24.4 -24.2 19 38 A H H X S+ 0 0 40 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.890 115.6 45.6 -59.3 -44.8 -7.4 24.1 -27.8 20 39 A R H X S+ 0 0 57 -4,-2.9 4,-0.6 1,-0.2 -2,-0.2 0.943 114.0 45.7 -72.3 -46.0 -10.7 22.4 -27.2 21 40 A F H ><>S+ 0 0 0 -4,-3.0 5,-2.1 -5,-0.2 3,-0.9 0.888 111.4 53.5 -64.0 -38.5 -11.9 24.6 -24.3 22 41 A R H ><5S+ 0 0 70 -4,-2.1 3,-1.9 -5,-0.3 -1,-0.2 0.879 102.0 57.3 -63.9 -41.0 -11.0 27.8 -26.1 23 42 A S H 3<5S+ 0 0 79 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.672 104.8 53.1 -63.9 -17.1 -13.0 26.9 -29.3 24 43 A Q T <<5S- 0 0 58 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.386 126.1-103.5 -98.5 -3.5 -16.1 26.6 -27.2 25 44 A G T < 5S+ 0 0 60 -3,-1.9 -3,-0.2 1,-0.3 -2,-0.1 0.431 75.0 139.3 92.4 3.0 -15.5 30.1 -25.8 26 45 A L < - 0 0 11 -5,-2.1 2,-0.5 -6,-0.2 -1,-0.3 -0.470 52.5-126.7 -71.1 147.9 -14.1 29.0 -22.4 27 46 A T - 0 0 67 -2,-0.1 -22,-2.2 2,-0.0 -23,-1.5 -0.887 31.6-162.7 -95.7 131.4 -11.1 31.1 -21.0 28 47 A V E -b 5 0A 4 -2,-0.5 2,-0.4 -24,-0.2 -22,-0.2 -0.873 20.3-172.5-116.6 144.6 -8.2 28.8 -20.1 29 48 A R E -b 6 0A 23 -24,-2.0 -22,-2.3 -2,-0.4 2,-0.4 -0.990 15.7-167.2-128.1 126.9 -5.1 29.2 -18.0 30 49 A A E -bc 7 99A 1 68,-3.4 70,-2.3 -2,-0.4 2,-0.4 -0.901 6.5-154.5-113.4 143.3 -2.6 26.3 -18.0 31 50 A F E -bc 8 100A 2 -24,-2.2 -22,-2.8 -2,-0.4 2,-0.4 -0.951 9.7-175.8-114.8 136.5 0.3 25.7 -15.7 32 51 A E - 0 0 22 68,-2.6 71,-2.6 -2,-0.4 72,-0.1 -0.991 20.9-159.5-132.0 126.6 3.4 23.7 -16.6 33 52 A A S S+ 0 0 36 -2,-0.4 71,-0.2 69,-0.3 -1,-0.1 0.813 78.8 76.8 -66.8 -33.9 6.3 22.9 -14.2 34 53 A A S S- 0 0 17 69,-0.1 68,-3.3 2,-0.1 69,-0.4 -0.042 88.9-119.9 -66.8 178.1 8.5 22.3 -17.3 35 54 A S S S+ 0 0 62 66,-0.2 2,-0.3 67,-0.1 66,-0.1 0.626 90.4 24.5 -94.8 -19.0 10.1 25.1 -19.4 36 55 A G S S- 0 0 15 3,-0.1 3,-0.4 1,-0.1 -26,-0.1 -0.925 89.2 -87.6-139.8 166.1 8.4 24.0 -22.7 37 56 A V S S+ 0 0 0 -2,-0.3 -26,-0.2 1,-0.2 50,-0.1 -0.211 85.5 77.4 -63.5 160.4 5.4 22.2 -24.0 38 57 A G > - 0 0 1 -28,-2.4 3,-1.6 48,-0.1 -26,-0.3 0.220 64.4-152.5 125.1 -17.8 5.6 18.4 -24.5 39 58 A G T >> S+ 0 0 10 -3,-0.4 3,-2.8 1,-0.3 4,-2.0 -0.180 82.5 7.8 54.4-133.0 5.2 16.7 -21.1 40 59 A V H 3> S+ 0 0 46 1,-0.3 4,-2.9 2,-0.2 -1,-0.3 0.873 133.3 57.1 -45.1 -40.0 6.9 13.3 -21.0 41 60 A W H <4 S+ 0 0 27 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.564 107.3 47.1 -72.2 -12.4 8.4 14.1 -24.4 42 61 A Y H <4 S+ 0 0 41 -3,-2.8 -1,-0.2 -4,-0.1 -2,-0.2 0.855 122.1 30.7 -91.7 -49.0 10.0 17.3 -23.3 43 62 A W H < S+ 0 0 66 -4,-2.0 2,-1.3 1,-0.2 120,-0.4 0.823 107.1 68.9 -85.7 -28.0 11.6 16.0 -20.1 44 63 A N < + 0 0 10 -4,-2.9 -1,-0.2 -5,-0.4 117,-0.1 -0.649 59.3 142.4 -92.2 84.5 12.3 12.4 -21.0 45 64 A R + 0 0 44 -2,-1.3 -1,-0.1 115,-0.3 3,-0.1 -0.182 13.2 142.3-124.3 42.1 15.1 12.9 -23.6 46 65 A Y > - 0 0 10 114,-0.3 3,-1.7 1,-0.1 33,-0.2 -0.430 65.1 -76.6 -79.5 157.5 17.7 10.1 -23.1 47 66 A P T 3 S+ 0 0 28 0, 0.0 143,-0.2 0, 0.0 -1,-0.1 -0.282 116.8 16.1 -56.7 131.4 19.3 8.5 -26.2 48 67 A G T 3 S+ 0 0 19 1,-0.3 2,-0.3 -3,-0.1 280,-0.1 0.486 82.2 155.9 90.7 2.8 17.1 6.1 -28.1 49 68 A A < + 0 0 4 -3,-1.7 30,-2.3 29,-0.0 2,-0.3 -0.470 14.5 151.2 -68.8 124.8 13.8 7.2 -26.4 50 69 A R B -I 78 0B 42 -2,-0.3 28,-0.2 28,-0.3 276,-0.2 -0.988 43.6-101.0-149.3 162.6 10.8 6.3 -28.6 51 70 A C - 0 0 7 26,-1.8 4,-0.1 -2,-0.3 28,-0.0 -0.235 18.1-145.2 -72.6 168.5 7.0 5.5 -28.5 52 71 A D S S+ 0 0 38 2,-0.1 220,-0.6 219,-0.0 2,-0.4 0.271 77.6 77.6-123.1 6.5 5.7 1.9 -28.9 53 72 A V S S- 0 0 17 24,-0.1 24,-0.3 219,-0.1 -2,-0.1 -0.941 99.9 -92.7-109.3 137.1 2.5 2.7 -30.7 54 73 A E >> - 0 0 31 -2,-0.4 4,-3.3 1,-0.1 3,-0.8 -0.241 33.1-128.6 -48.2 132.8 2.8 3.5 -34.5 55 74 A S T 34 S+ 0 0 1 20,-2.8 -1,-0.1 1,-0.3 21,-0.1 0.755 107.3 63.2 -65.7 -24.8 3.1 7.2 -34.9 56 75 A I T 34 S+ 0 0 18 19,-0.3 -1,-0.3 1,-0.1 3,-0.1 0.929 116.4 32.3 -63.0 -40.3 0.4 7.3 -37.4 57 76 A D T <4 S+ 0 0 1 -3,-0.8 2,-2.2 1,-0.2 -2,-0.2 0.949 110.7 65.9 -73.6 -55.8 -1.9 6.1 -34.6 58 77 A Y S < S+ 0 0 33 -4,-3.3 2,-0.3 375,-0.1 -1,-0.2 -0.496 93.3 76.3 -73.6 77.0 -0.1 7.8 -31.7 59 78 A S S S- 0 0 3 -2,-2.2 2,-0.2 -3,-0.1 375,-0.0 -0.948 89.1 -68.2-174.1 170.4 -0.9 11.4 -32.9 60 79 A Y - 0 0 3 -2,-0.3 374,-0.1 1,-0.1 3,-0.1 -0.482 29.8-179.5 -80.1 141.3 -3.8 13.9 -32.9 61 80 A S + 0 0 15 -2,-0.2 -1,-0.1 372,-0.1 171,-0.0 0.405 64.3 90.3-111.0 -2.0 -6.9 13.3 -35.1 62 81 A F S S+ 0 0 43 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.711 84.1 53.9 -69.0 -22.8 -8.7 16.5 -34.1 63 82 A S > - 0 0 5 1,-0.2 4,-2.1 -3,-0.1 -1,-0.2 -0.901 64.2-166.2-119.7 103.1 -7.2 18.6 -36.9 64 83 A P H > S+ 0 0 74 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.854 90.2 52.2 -56.1 -36.7 -7.7 17.1 -40.4 65 84 A E H > S+ 0 0 101 2,-0.2 4,-3.6 1,-0.2 5,-0.3 0.990 107.2 49.7 -64.9 -58.5 -5.1 19.5 -41.8 66 85 A L H > S+ 0 0 0 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.891 109.3 55.0 -41.7 -49.4 -2.3 18.7 -39.3 67 86 A E H < S+ 0 0 26 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.936 117.3 34.1 -51.7 -54.3 -3.0 15.0 -40.0 68 87 A Q H < S+ 0 0 96 -4,-2.0 -2,-0.2 -3,-0.2 -1,-0.2 0.924 120.0 50.4 -64.2 -45.6 -2.4 15.5 -43.8 69 88 A E H < S+ 0 0 94 -4,-3.6 2,-0.4 -5,-0.2 -2,-0.2 0.801 94.3 79.7 -73.1 -33.7 0.2 18.2 -43.4 70 89 A W < - 0 0 36 -4,-3.0 2,-0.7 -5,-0.3 15,-0.0 -0.649 63.5-155.7 -84.4 124.1 2.6 16.4 -40.9 71 90 A N - 0 0 96 -2,-0.4 2,-0.2 2,-0.0 -3,-0.1 -0.865 7.0-147.9 -98.3 108.0 5.0 13.7 -42.2 72 91 A W - 0 0 18 -2,-0.7 144,-0.1 1,-0.1 3,-0.0 -0.506 7.0-148.2 -67.2 138.6 6.2 11.2 -39.7 73 92 A S S S+ 0 0 60 -2,-0.2 2,-0.2 142,-0.1 143,-0.2 0.705 70.1 2.3 -86.7 -24.9 9.7 10.1 -40.6 74 93 A E S S- 0 0 42 141,-0.2 3,-0.2 1,-0.1 -19,-0.2 -0.880 81.5 -90.5-150.5 179.7 9.6 6.5 -39.3 75 94 A K S S+ 0 0 47 139,-1.1 -20,-2.8 1,-0.3 2,-0.7 0.967 116.8 28.5 -65.7 -57.7 7.2 3.9 -37.8 76 95 A Y S S- 0 0 0 -22,-0.2 -1,-0.3 -21,-0.1 -22,-0.1 -0.912 91.0-138.4-105.6 106.3 7.9 4.6 -34.1 77 96 A A - 0 0 2 -2,-0.7 -26,-1.8 -24,-0.3 2,-0.1 -0.294 12.6-126.3 -62.0 144.6 8.9 8.3 -33.7 78 97 A T B >> -I 50 0B 33 -28,-0.2 4,-2.3 1,-0.1 3,-1.1 -0.410 31.1-100.0 -82.1 165.2 11.8 9.2 -31.4 79 98 A Q H 3> S+ 0 0 16 -30,-2.3 4,-3.2 1,-0.3 5,-0.2 0.875 120.8 55.6 -61.1 -35.8 11.3 11.8 -28.6 80 99 A P H 3> S+ 0 0 70 0, 0.0 4,-1.6 0, 0.0 -1,-0.3 0.789 112.2 46.4 -67.9 -19.2 13.0 14.7 -30.5 81 100 A E H <> S+ 0 0 61 -3,-1.1 4,-2.4 2,-0.2 -2,-0.2 0.911 113.4 44.8 -81.9 -48.7 10.5 14.0 -33.3 82 101 A I H X S+ 0 0 5 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.883 114.0 53.4 -61.0 -40.9 7.4 13.8 -31.1 83 102 A L H X S+ 0 0 14 -4,-3.2 4,-2.3 -5,-0.3 5,-0.3 0.962 107.6 48.7 -58.6 -50.9 8.7 16.9 -29.3 84 103 A A H X S+ 0 0 33 -4,-1.6 4,-2.1 1,-0.2 -2,-0.2 0.910 111.2 53.0 -56.5 -42.9 9.1 18.8 -32.6 85 104 A Y H X S+ 0 0 8 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.907 109.2 45.9 -55.8 -50.4 5.5 17.7 -33.5 86 105 A L H X S+ 0 0 1 -4,-2.4 4,-2.9 2,-0.2 -1,-0.2 0.855 111.3 52.5 -68.5 -32.4 3.9 19.0 -30.2 87 106 A E H X S+ 0 0 72 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.865 108.5 52.2 -69.0 -35.2 5.8 22.2 -30.5 88 107 A H H X S+ 0 0 41 -4,-2.1 4,-3.3 -5,-0.3 -2,-0.2 0.939 108.2 50.4 -61.6 -48.1 4.4 22.5 -34.0 89 108 A V H X S+ 0 0 2 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.968 111.6 46.8 -53.8 -53.4 0.9 21.9 -32.5 90 109 A A H <>S+ 0 0 2 -4,-2.9 5,-1.7 1,-0.2 6,-0.4 0.873 114.6 49.8 -54.8 -38.4 1.5 24.6 -29.9 91 110 A D H ><5S+ 0 0 98 -4,-2.3 3,-1.3 1,-0.2 -2,-0.2 0.974 111.4 46.8 -60.1 -56.2 2.8 26.8 -32.8 92 111 A R H 3<5S+ 0 0 106 -4,-3.3 -2,-0.2 1,-0.3 -1,-0.2 0.818 120.0 37.3 -62.2 -37.8 -0.2 26.2 -35.1 93 112 A F T 3<5S- 0 0 29 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.164 102.7-120.8-106.6 15.0 -2.8 26.8 -32.4 94 113 A D T < 5 + 0 0 90 -3,-1.3 4,-0.2 -4,-0.3 3,-0.2 0.833 59.1 150.4 50.7 45.6 -1.3 29.7 -30.5 95 114 A L > < + 0 0 1 -5,-1.7 3,-1.5 -6,-0.2 4,-0.3 0.843 50.0 70.3 -79.9 -39.7 -1.3 27.6 -27.3 96 115 A R G > S+ 0 0 80 -6,-0.4 3,-2.4 1,-0.3 -1,-0.2 0.830 83.4 71.3 -49.8 -42.6 1.7 29.0 -25.3 97 116 A R G 3 S+ 0 0 165 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.807 103.5 42.9 -48.6 -33.7 0.1 32.4 -24.6 98 117 A D G < S+ 0 0 35 -3,-1.5 -68,-3.4 -4,-0.2 2,-0.4 0.413 101.1 87.3 -95.9 -0.2 -2.3 30.7 -22.1 99 118 A I E < -c 30 0A 4 -3,-2.4 2,-0.6 -4,-0.3 -68,-0.2 -0.817 61.4-157.1 -92.7 138.4 0.4 28.5 -20.6 100 119 A R E -c 31 0A 94 -70,-2.3 -68,-2.6 -2,-0.4 3,-0.5 -0.976 21.0-158.0-108.9 111.7 2.6 29.7 -17.7 101 120 A F + 0 0 46 -2,-0.6 -66,-0.2 1,-0.2 -68,-0.2 -0.210 67.8 34.9 -82.8 174.6 5.9 27.6 -17.8 102 121 A D S S+ 0 0 83 -68,-3.3 2,-0.5 1,-0.2 -69,-0.3 0.676 91.8 121.6 53.6 24.6 8.3 27.0 -14.9 103 122 A T - 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0 0 13 -2,-0.3 2,-0.3 108,-0.1 110,-0.1 -0.788 18.0-159.4-106.8 147.1 15.1 -8.6 -16.6 206 225 A N - 0 0 38 -26,-0.3 2,-0.2 -2,-0.3 113,-0.1 -0.881 27.3 -96.4-124.6 158.3 12.0 -7.5 -18.5 207 226 A Y + 0 0 13 -2,-0.3 118,-1.8 115,-0.2 2,-0.3 -0.514 41.6 177.5 -72.9 133.7 10.5 -8.6 -21.9 208 227 A S E -p 325 0F 0 -2,-0.2 118,-0.2 116,-0.2 116,-0.1 -0.976 14.8-148.1-131.4 150.0 11.3 -6.4 -24.8 209 228 A I E -p 326 0F 0 116,-3.0 118,-1.6 -2,-0.3 63,-0.1 -0.978 29.4-100.4-120.6 134.3 10.3 -6.9 -28.5 210 229 A P E -p 327 0F 37 0, 0.0 118,-0.2 0, 0.0 61,-0.2 -0.257 25.9-143.4 -41.5 121.9 12.3 -5.9 -31.6 211 230 A A - 0 0 2 116,-2.8 3,-0.2 59,-0.1 117,-0.1 0.741 13.5-151.7 -60.0 -32.5 10.8 -2.7 -33.0 212 231 A G - 0 0 47 115,-0.3 2,-0.6 1,-0.2 116,-0.1 0.913 22.8-163.7 51.8 46.5 11.3 -3.8 -36.6 213 232 A N + 0 0 46 -138,-0.1 -1,-0.2 -139,-0.0 -2,-0.1 -0.506 16.4 172.6 -72.7 109.0 11.6 -0.1 -37.4 214 233 A V - 0 0 99 -2,-0.6 -139,-1.1 -3,-0.2 2,-0.4 -0.910 34.1-121.1-110.1 140.3 11.2 0.6 -41.1 215 234 A P - 0 0 93 0, 0.0 -141,-0.2 0, 0.0 -142,-0.1 -0.724 47.1 -95.9 -74.2 137.3 11.0 4.1 -42.7 216 235 A L - 0 0 42 -2,-0.4 2,-0.2 -143,-0.2 5,-0.0 -0.242 33.7-112.8 -65.6 135.8 7.7 4.4 -44.5 217 236 A D >> - 0 0 94 1,-0.1 4,-2.1 2,-0.0 3,-1.2 -0.472 20.5-130.2 -65.5 131.4 7.5 3.8 -48.3 218 237 A D H 3> S+ 0 0 138 1,-0.3 4,-1.1 2,-0.2 5,-0.2 0.870 108.1 52.4 -47.2 -48.3 6.6 7.0 -50.3 219 238 A A H 3> S+ 0 0 75 1,-0.2 4,-0.7 2,-0.2 -1,-0.3 0.726 112.8 45.1 -65.9 -24.6 3.8 5.2 -52.2 220 239 A T H <> S+ 0 0 71 -3,-1.2 4,-3.1 2,-0.2 5,-0.3 0.769 98.7 70.8 -86.9 -30.8 2.2 4.1 -48.9 221 240 A R H X S+ 0 0 64 -4,-2.1 4,-1.3 1,-0.2 -2,-0.2 0.844 107.7 36.3 -57.8 -38.4 2.6 7.5 -47.2 222 241 A A H X S+ 0 0 69 -4,-1.1 4,-1.4 2,-0.2 -1,-0.2 0.832 114.9 56.4 -80.3 -35.0 -0.1 9.0 -49.4 223 242 A E H X S+ 0 0 55 -4,-0.7 4,-1.1 2,-0.2 -2,-0.2 0.836 110.8 44.1 -66.1 -35.9 -2.2 5.7 -49.4 224 243 A Q H >< S+ 0 0 45 -4,-3.1 3,-0.7 2,-0.2 -1,-0.2 0.951 110.3 54.8 -71.0 -47.5 -2.4 5.7 -45.7 225 244 A K H 3< S+ 0 0 25 -4,-1.3 3,-0.4 -5,-0.3 4,-0.2 0.719 107.6 51.3 -58.9 -25.0 -3.1 9.5 -45.5 226 245 A A H 3< S+ 0 0 84 -4,-1.4 3,-0.3 1,-0.2 -1,-0.3 0.834 113.2 44.7 -76.5 -34.9 -6.1 8.8 -47.9 227 246 A N S > S+ 0 0 14 -3,-0.4 4,-2.6 2,-0.2 3,-0.6 0.941 72.7 55.8 -60.7 -52.0 -6.9 8.0 -42.3 229 248 A A H 3> S+ 0 0 62 -3,-0.3 4,-2.3 1,-0.3 -1,-0.2 0.914 112.3 42.8 -47.6 -51.2 -10.6 8.5 -41.6 230 249 A E H 3> S+ 0 0 58 1,-0.2 4,-1.3 2,-0.2 -1,-0.3 0.735 112.2 55.0 -69.9 -23.3 -11.2 4.7 -41.8 231 250 A R H - 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