==== 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 OXIDOREDUCTASE 31-AUG-10 3OOX . COMPND 2 MOLECULE: PUTATIVE 2OG-FE(II) OXYGENASE FAMILY PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CAULOBACTER CRESCENTUS CB15; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 610 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28903.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 398 65.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 1.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 94 15.4 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 . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 49 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 65 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 145 23.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 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 3 3 2 0 0 0 0 1 1 0 0 4 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 6 10 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 2 0 0 0 0 0 2 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 3 A T 0 0 118 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 154.7 36.8 20.3 31.1 2 4 A S - 0 0 40 214,-0.1 214,-0.2 1,-0.1 3,-0.0 -0.967 360.0-153.9-110.3 136.1 34.8 22.4 28.6 3 5 A A S S+ 0 0 36 212,-3.0 2,-0.5 -2,-0.4 213,-0.1 0.582 80.9 60.8 -78.6 -11.8 31.1 22.9 29.2 4 6 A I S S- 0 0 3 211,-0.3 -1,-0.1 29,-0.0 213,-0.1 -0.958 78.0-139.2-128.3 117.0 30.3 23.5 25.5 5 7 A D - 0 0 134 -2,-0.5 29,-0.5 1,-0.1 -2,-0.0 -0.462 29.1-110.2 -75.0 136.3 31.0 20.8 22.8 6 8 A P - 0 0 58 0, 0.0 2,-0.5 0, 0.0 29,-0.2 -0.351 19.5-146.4 -66.7 149.2 32.4 22.0 19.5 7 9 A V E -a 35 0A 8 27,-2.6 29,-1.9 -2,-0.0 2,-0.3 -0.976 26.7-119.8-110.9 124.8 30.4 21.9 16.3 8 10 A S E > -a 36 0A 21 -2,-0.5 3,-1.9 27,-0.2 29,-0.2 -0.542 4.7-145.9 -73.8 128.9 32.5 21.2 13.3 9 11 A F T >> S+ 0 0 15 27,-3.2 3,-1.8 -2,-0.3 4,-0.5 0.682 94.3 80.7 -59.3 -19.3 32.7 23.8 10.5 10 12 A S H >> S+ 0 0 43 1,-0.3 4,-2.1 26,-0.2 3,-0.5 0.813 83.8 63.2 -59.2 -25.3 32.9 20.9 8.1 11 13 A L H <> S+ 0 0 16 -3,-1.9 4,-2.4 1,-0.2 8,-0.4 0.684 81.3 78.5 -71.4 -20.6 29.1 20.6 8.5 12 14 A Y H <4 S+ 0 0 31 -3,-1.8 4,-0.3 -4,-0.2 -1,-0.2 0.931 113.7 20.0 -55.1 -45.7 28.6 24.1 7.0 13 15 A A H << S+ 0 0 51 -4,-0.5 3,-0.3 -3,-0.5 -2,-0.2 0.837 129.3 49.2 -86.3 -42.2 29.1 22.5 3.5 14 16 A K H < S- 0 0 168 -4,-2.1 -3,-0.2 1,-0.2 -2,-0.2 0.832 135.6 -4.4 -74.0 -33.3 28.4 18.9 4.4 15 17 A D X + 0 0 71 -4,-2.4 4,-2.2 -5,-0.1 3,-0.5 -0.440 64.4 174.3-161.5 74.1 25.1 19.3 6.3 16 18 A F H > S+ 0 0 26 -3,-0.3 4,-2.9 -4,-0.3 5,-0.3 0.855 79.4 60.3 -62.3 -35.7 24.2 22.9 6.7 17 19 A T H > S+ 0 0 109 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.927 110.2 41.7 -58.4 -44.7 20.8 22.1 8.3 18 20 A R H > S+ 0 0 116 -3,-0.5 4,-3.0 2,-0.2 5,-0.3 0.894 112.0 55.8 -66.8 -41.3 22.5 20.2 11.1 19 21 A F H X S+ 0 0 0 -4,-2.2 4,-2.7 -8,-0.4 5,-0.3 0.947 110.0 45.5 -52.6 -53.9 25.2 22.9 11.4 20 22 A A H X S+ 0 0 1 -4,-2.9 4,-2.4 1,-0.2 5,-0.3 0.915 114.2 48.5 -62.0 -44.3 22.6 25.6 12.0 21 23 A Q H X S+ 0 0 111 -4,-2.0 4,-2.4 -5,-0.3 -2,-0.2 0.941 115.3 42.9 -60.5 -49.9 20.6 23.5 14.5 22 24 A E H X S+ 0 0 69 -4,-3.0 4,-1.5 2,-0.2 -2,-0.2 0.935 119.5 42.1 -67.6 -45.6 23.7 22.5 16.6 23 25 A L H X S+ 0 0 0 -4,-2.7 4,-2.3 -5,-0.3 -1,-0.2 0.934 116.6 49.1 -62.9 -47.5 25.2 26.0 16.6 24 26 A G H X S+ 0 0 1 -4,-2.4 4,-2.7 -5,-0.3 -2,-0.2 0.895 108.2 52.6 -58.1 -44.3 21.9 27.7 17.1 25 27 A A H X S+ 0 0 37 -4,-2.4 4,-1.9 -5,-0.3 -1,-0.2 0.866 109.4 50.5 -62.7 -37.6 20.9 25.5 20.0 26 28 A S H X>S+ 0 0 16 -4,-1.5 4,-2.8 2,-0.2 6,-0.7 0.945 111.1 47.4 -66.6 -46.5 24.2 26.2 21.7 27 29 A F H X5S+ 0 0 0 -4,-2.3 4,-2.1 4,-0.2 -2,-0.2 0.910 112.2 50.4 -58.6 -43.8 23.8 30.0 21.3 28 30 A E H <5S+ 0 0 88 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.877 117.1 40.0 -65.3 -36.3 20.2 29.8 22.6 29 31 A R H <5S+ 0 0 106 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.905 137.8 7.9 -76.2 -45.5 21.2 27.8 25.7 30 32 A Y H <5S- 0 0 52 -4,-2.8 -3,-0.2 2,-0.4 -2,-0.2 0.517 88.4-118.6-119.2 -13.7 24.5 29.5 26.7 31 33 A G S <> - 0 0 77 1,-0.2 4,-2.1 -2,-0.1 3,-0.5 -0.525 30.6-156.8 -65.9 110.0 44.6 29.7 6.8 42 44 A Q H 3> S+ 0 0 74 -2,-0.6 4,-3.2 1,-0.2 5,-0.2 0.847 89.6 58.3 -62.0 -37.0 46.5 29.0 10.0 43 45 A A H 3> S+ 0 0 69 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.892 109.2 45.3 -60.2 -33.8 49.7 30.4 8.7 44 46 A R H <> S+ 0 0 65 -3,-0.5 4,-1.9 2,-0.2 -2,-0.2 0.860 111.6 51.5 -80.4 -32.5 48.1 33.7 8.0 45 47 A I H X S+ 0 0 5 -4,-2.1 4,-2.5 2,-0.2 3,-0.3 0.975 112.3 48.3 -58.5 -50.3 46.3 33.7 11.4 46 48 A D H X S+ 0 0 76 -4,-3.2 4,-2.8 1,-0.3 -2,-0.2 0.847 108.0 54.1 -62.7 -35.9 49.8 33.1 12.9 47 49 A A H X S+ 0 0 27 -4,-1.9 4,-2.2 2,-0.2 -1,-0.3 0.890 108.5 49.0 -62.8 -41.8 51.4 35.9 10.8 48 50 A A H X S+ 0 0 0 -4,-1.9 4,-2.3 -3,-0.3 -2,-0.2 0.941 112.5 48.1 -62.8 -43.9 48.8 38.3 12.2 49 51 A V H X S+ 0 0 32 -4,-2.5 4,-2.9 1,-0.2 -2,-0.2 0.914 110.2 52.1 -63.9 -40.8 49.5 37.1 15.7 50 52 A D H X S+ 0 0 96 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.892 108.8 50.0 -62.7 -40.0 53.3 37.5 15.1 51 53 A S H X S+ 0 0 8 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.883 110.9 50.0 -63.6 -40.7 52.8 41.1 13.9 52 54 A A H X S+ 0 0 2 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.947 111.5 48.0 -58.6 -50.8 50.7 41.8 17.0 53 55 A K H X S+ 0 0 87 -4,-2.9 4,-1.5 1,-0.2 -2,-0.2 0.899 112.2 50.1 -57.7 -41.4 53.5 40.3 19.2 54 56 A A H < S+ 0 0 42 -4,-2.4 4,-0.5 -5,-0.2 -1,-0.2 0.922 109.8 50.5 -65.6 -42.1 56.1 42.3 17.3 55 57 A F H >< S+ 0 0 0 -4,-2.7 3,-1.6 1,-0.2 -2,-0.2 0.941 110.7 47.7 -58.9 -49.7 54.1 45.5 17.8 56 58 A F H 3< S+ 0 0 6 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.749 104.7 61.9 -69.0 -21.8 53.7 45.1 21.5 57 59 A A T 3< S+ 0 0 84 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.568 83.7 104.8 -76.4 -10.0 57.5 44.3 21.8 58 60 A L S < S- 0 0 32 -3,-1.6 5,-0.0 -4,-0.5 -3,-0.0 -0.266 89.2 -81.7 -64.9 158.1 58.3 47.8 20.5 59 61 A P >> - 0 0 83 0, 0.0 4,-2.2 0, 0.0 3,-0.6 -0.274 41.2-114.7 -57.6 149.4 59.5 50.5 23.0 60 62 A V H 3> S+ 0 0 72 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.896 115.5 51.5 -54.7 -46.1 56.7 52.2 25.0 61 63 A E H 34 S+ 0 0 140 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.846 108.9 51.5 -66.2 -27.5 57.4 55.6 23.4 62 64 A T H X4 S+ 0 0 33 -3,-0.6 3,-1.0 1,-0.2 4,-0.3 0.918 111.6 47.0 -70.5 -44.9 57.2 54.1 19.9 63 65 A K H >< S+ 0 0 12 -4,-2.2 3,-2.0 1,-0.2 13,-0.2 0.884 104.4 62.3 -62.0 -37.3 53.9 52.4 20.8 64 66 A K G >< S+ 0 0 95 -4,-2.5 3,-1.3 1,-0.3 -1,-0.2 0.592 81.5 78.6 -73.5 -9.9 52.6 55.7 22.2 65 67 A Q G < S+ 0 0 116 -3,-1.0 -1,-0.3 -4,-0.4 -2,-0.2 0.783 100.2 44.7 -56.0 -27.8 52.9 57.4 18.9 66 68 A Y G < S+ 0 0 30 -3,-2.0 10,-2.3 -4,-0.3 3,-0.4 0.243 96.9 102.0-106.6 10.5 49.7 55.6 18.2 67 69 A A B < +c 76 0A 30 -3,-1.3 10,-0.1 8,-0.2 3,-0.1 -0.472 65.5 37.3 -90.3 165.2 47.9 56.4 21.5 68 70 A G S S+ 0 0 74 8,-0.6 2,-0.7 1,-0.2 3,-0.3 0.722 75.7 146.4 68.1 22.1 45.2 58.9 22.2 69 71 A V S > >S- 0 0 39 5,-0.4 3,-1.8 -3,-0.4 5,-1.3 -0.833 78.4 -28.2 -95.2 113.7 43.5 58.3 18.9 70 72 A K G > 5S- 0 0 155 -2,-0.7 3,-1.8 1,-0.3 -1,-0.2 0.879 119.6 -56.2 51.4 44.4 39.7 58.7 19.1 71 73 A G G 3 5S- 0 0 85 1,-0.3 -1,-0.3 -3,-0.3 -4,-0.0 0.654 103.3 -55.3 66.4 19.9 39.6 57.7 22.7 72 74 A G G < 5S+ 0 0 7 -3,-1.8 -1,-0.3 2,-0.3 -2,-0.2 0.357 109.0 119.9 91.1 1.9 41.3 54.4 22.0 73 75 A A T < 5S+ 0 0 48 -3,-1.8 2,-0.3 -4,-0.3 -3,-0.2 0.716 82.2 29.3 -70.8 -20.2 38.8 53.3 19.4 74 76 A R S S- 0 0 54 1,-0.1 3,-1.4 2,-0.1 -2,-0.1 -0.315 76.3-106.6 -71.2 144.2 38.0 51.2 42.2 85 87 A K T 3 S+ 0 0 134 1,-0.2 -1,-0.1 -2,-0.1 3,-0.1 -0.326 106.2 35.0 -61.7 149.2 38.4 49.3 45.5 86 88 A G T 3 S+ 0 0 81 1,-0.3 -1,-0.2 -2,-0.0 2,-0.2 0.359 88.8 125.8 80.8 -6.4 38.6 45.5 45.2 87 89 A A S < S- 0 0 38 -3,-1.4 -1,-0.3 -5,-0.1 4,-0.1 -0.590 71.4-101.9 -78.4 145.3 40.6 45.9 41.9 88 90 A D - 0 0 69 -2,-0.2 -6,-0.3 1,-0.1 -1,-0.1 -0.319 25.9-120.0 -63.1 151.3 43.9 44.1 41.8 89 91 A H S S+ 0 0 158 1,-0.2 2,-0.5 -8,-0.1 -1,-0.1 0.917 103.8 37.3 -58.4 -41.9 46.9 46.4 42.3 90 92 A Y + 0 0 119 -9,-0.1 -1,-0.2 2,-0.1 2,-0.2 -0.955 54.8 156.9-115.3 127.1 48.1 45.3 38.9 91 93 A D + 0 0 55 -2,-0.5 2,-0.7 -11,-0.4 -11,-0.4 -0.682 25.2 178.5-141.4 80.3 45.8 44.8 35.9 92 94 A L + 0 0 50 -2,-0.2 2,-0.3 82,-0.2 -13,-0.1 -0.795 15.2 137.4 -99.2 111.5 48.3 45.3 33.1 93 95 A K - 0 0 51 -2,-0.7 2,-0.3 80,-0.2 -13,-0.3 -0.987 30.5-156.0-148.8 148.6 47.1 44.9 29.6 94 96 A E E - E 0 172A 2 78,-2.2 78,-2.3 -2,-0.3 2,-0.3 -0.930 13.0-155.3-129.3 151.5 47.7 46.8 26.4 95 97 A F E -DE 77 171A 31 -18,-2.1 -18,-2.4 -2,-0.3 2,-0.4 -0.921 17.7-165.2-129.0 152.6 45.5 47.0 23.3 96 98 A W E -DE 76 170A 1 74,-2.2 74,-2.9 -2,-0.3 2,-0.5 -0.995 18.9-161.4-128.4 131.7 45.5 47.7 19.5 97 99 A H E -DE 75 169A 15 -22,-2.3 -22,-2.2 -2,-0.4 2,-0.5 -0.966 7.5-171.9-117.2 129.6 42.2 48.4 17.8 98 100 A X E - E 0 168A 1 70,-2.7 70,-2.6 -2,-0.5 2,-0.1 -0.980 8.4-173.0-114.3 125.2 41.5 48.1 14.1 99 101 A G - 0 0 0 -2,-0.5 2,-0.2 68,-0.2 68,-0.2 -0.315 42.6 -57.2 -97.1-170.3 38.2 49.3 12.7 100 102 A R - 0 0 24 66,-0.3 2,-0.7 -2,-0.1 -1,-0.1 -0.496 43.0-133.1 -72.4 136.3 36.8 49.0 9.2 101 103 A D - 0 0 77 -2,-0.2 13,-0.1 13,-0.1 -1,-0.1 -0.832 30.7-159.3 -85.2 115.4 38.8 50.5 6.3 102 104 A L - 0 0 15 -2,-0.7 3,-0.1 10,-0.1 0, 0.0 -0.690 18.0-107.8 -97.9 149.2 36.2 52.4 4.3 103 105 A P > - 0 0 33 0, 0.0 3,-1.9 0, 0.0 6,-0.1 -0.330 52.2 -77.6 -67.2 157.4 36.5 53.4 0.7 104 106 A P T 3 S+ 0 0 111 0, 0.0 310,-0.0 0, 0.0 0, 0.0 -0.248 118.7 17.5 -51.0 139.3 37.0 57.1 -0.1 105 107 A G T 3 S+ 0 0 56 1,-0.2 309,-0.1 -3,-0.1 0, 0.0 0.393 84.1 161.4 79.7 -2.4 33.8 59.1 0.2 106 108 A H X - 0 0 6 -3,-1.9 3,-1.7 1,-0.1 4,-0.2 -0.259 45.7-129.0 -57.9 140.4 31.9 56.5 2.3 107 109 A R G > S+ 0 0 51 1,-0.3 3,-0.5 2,-0.1 -1,-0.1 0.660 105.1 60.0 -63.3 -22.8 28.9 57.8 4.1 108 110 A F G >> S+ 0 0 7 1,-0.2 4,-2.0 2,-0.1 3,-1.7 0.543 76.6 91.6 -84.6 -6.6 30.1 56.3 7.4 109 111 A R G <4 S+ 0 0 87 -3,-1.7 -1,-0.2 1,-0.3 -2,-0.1 0.808 74.2 67.6 -60.9 -29.1 33.3 58.3 7.5 110 112 A A G <4 S+ 0 0 106 -3,-0.5 -1,-0.3 -4,-0.2 -2,-0.1 0.753 119.6 19.2 -63.2 -22.2 31.7 61.1 9.5 111 113 A H T <4 S+ 0 0 78 -3,-1.7 2,-0.6 1,-0.2 -2,-0.2 0.493 115.0 71.6-126.2 -5.0 31.4 58.8 12.5 112 114 A X S < S- 0 0 3 -4,-2.0 -1,-0.2 -13,-0.0 -10,-0.1 -0.940 78.1-138.5-116.3 109.9 33.9 55.9 11.8 113 115 A A - 0 0 24 -2,-0.6 -14,-0.1 1,-0.1 -3,-0.1 -0.296 20.3-101.9 -71.8 150.3 37.4 57.0 12.2 114 116 A D - 0 0 99 -5,-0.1 -1,-0.1 1,-0.1 2,-0.1 -0.292 39.9-108.6 -61.2 148.1 40.3 56.1 9.9 115 117 A N - 0 0 17 -15,-0.1 2,-0.3 -16,-0.1 -1,-0.1 -0.423 25.3-147.1 -68.5 152.9 42.7 53.4 11.0 116 118 A V - 0 0 41 -2,-0.1 -41,-0.2 -50,-0.1 -50,-0.0 -0.807 13.1-153.8-112.9 164.0 46.2 54.2 12.0 117 119 A W - 0 0 55 -2,-0.3 2,-0.9 -19,-0.0 3,-0.1 -0.994 19.6-115.8-142.6 143.1 49.1 51.8 11.4 118 120 A P > - 0 0 4 0, 0.0 3,-1.9 0, 0.0 6,-0.2 -0.715 18.8-163.4 -85.9 107.0 52.5 51.2 13.0 119 121 A A T 3 S+ 0 0 82 -2,-0.9 5,-0.0 1,-0.3 6,-0.0 0.776 85.0 68.3 -55.9 -28.9 55.3 52.0 10.4 120 122 A E T 3 S+ 0 0 74 1,-0.2 -1,-0.3 -58,-0.1 -58,-0.0 0.617 96.5 53.5 -70.1 -15.1 57.8 50.1 12.5 121 123 A I S X S- 0 0 22 -3,-1.9 3,-1.8 1,-0.1 4,-0.5 -0.851 73.7-171.6-120.1 86.5 56.2 46.7 11.8 122 124 A P T 3 S+ 0 0 123 0, 0.0 4,-0.4 0, 0.0 3,-0.3 0.814 81.3 46.6 -54.0 -36.0 56.1 46.8 8.0 123 125 A A T 3> S+ 0 0 47 1,-0.2 4,-2.8 2,-0.1 5,-0.3 0.529 88.4 91.9 -83.9 -4.4 53.9 43.6 7.6 124 126 A F H <>>S+ 0 0 0 -3,-1.8 4,-3.0 -6,-0.2 5,-0.5 0.921 82.3 49.7 -60.4 -52.0 51.3 44.6 10.3 125 127 A K H >5S+ 0 0 111 -4,-0.5 4,-1.9 -3,-0.3 5,-0.2 0.944 118.3 40.4 -55.6 -49.1 48.8 46.4 8.0 126 128 A H H >5S+ 0 0 111 -4,-0.4 4,-2.1 2,-0.2 -2,-0.2 0.954 120.2 41.4 -63.5 -50.2 48.7 43.5 5.6 127 129 A D H X5S+ 0 0 28 -4,-2.8 4,-1.5 1,-0.2 -79,-0.3 0.914 119.4 43.1 -69.4 -44.3 48.8 40.6 8.1 128 130 A V H X5S+ 0 0 1 -4,-3.0 4,-2.2 -5,-0.3 -1,-0.2 0.873 112.1 53.6 -72.7 -37.4 46.3 42.2 10.6 129 131 A S H XS+ 0 0 0 -4,-2.9 5,-2.8 7,-0.2 -2,-0.2 0.949 111.7 46.3 -56.7 -48.4 19.5 33.0 10.4 148 150 A T H ><5S+ 0 0 47 -4,-2.3 3,-1.7 1,-0.2 -1,-0.2 0.905 110.5 53.5 -63.5 -40.0 18.5 29.5 9.5 149 151 A Y H 3<5S+ 0 0 45 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.903 108.2 50.6 -60.3 -38.6 18.1 28.5 13.2 150 152 A L T 3<5S- 0 0 14 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.333 120.7-111.5 -80.9 4.5 15.8 31.5 13.6 151 153 A K T < 5S+ 0 0 184 -3,-1.7 2,-0.2 1,-0.2 -3,-0.2 0.817 75.8 132.2 64.1 34.9 13.7 30.3 10.6 152 154 A L S - 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