==== 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 18-AUG-06 2I3G . COMPND 2 MOLECULE: N-ACETYL-GAMMA-GLUTAMYL-PHOSPHATE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR L.T.CHERNEY,M.M.CHERNEY,C.R.GAREN,F.MORAIDIN,M.N.G.JAMES, . 692 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26125.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 494 71.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 78 11.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 62 9.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 57 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 90 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 148 21.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 2.5 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 6 2 0 2 2 1 1 0 6 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 4 4 2 0 0 2 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 . 2 2 0 0 0 0 2 4 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 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 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 6 A V 0 0 146 0, 0.0 332,-0.2 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 121.5 -33.9 36.6 -26.5 2 7 A A - 0 0 25 330,-3.2 3,-0.1 1,-0.1 330,-0.1 -0.421 360.0-165.1 -66.4 143.0 -33.5 34.1 -23.6 3 8 A N + 0 0 121 1,-0.3 2,-0.3 -2,-0.1 -1,-0.1 0.785 69.5 5.4-100.4 -33.1 -36.4 34.2 -21.2 4 9 A A - 0 0 22 2,-0.0 2,-0.5 32,-0.0 -1,-0.3 -0.850 64.5-172.3-162.3 116.1 -35.1 32.4 -18.0 5 10 A T E -a 35 0A 4 29,-3.2 31,-2.9 -2,-0.3 2,-0.6 -0.947 11.9-158.3-125.7 121.0 -31.6 31.1 -17.5 6 11 A K E -a 36 0A 85 -2,-0.5 72,-1.6 29,-0.2 71,-1.6 -0.908 23.8-158.3-100.8 123.2 -30.4 28.9 -14.6 7 12 A V E -ab 37 78A 1 29,-3.3 31,-3.3 -2,-0.6 2,-0.3 -0.826 12.5-165.5-110.5 135.6 -26.7 29.4 -14.2 8 13 A A E - b 0 79A 0 70,-2.4 72,-2.6 -2,-0.4 2,-0.4 -0.875 8.0-152.2-109.5 159.0 -24.0 27.2 -12.7 9 14 A V E > -ab 40 80A 1 30,-2.3 32,-2.7 -2,-0.3 3,-0.6 -0.955 3.5-162.5-131.4 110.9 -20.4 28.2 -11.8 10 15 A A E 3 S+ab 41 81A 0 70,-2.9 72,-3.0 -2,-0.4 32,-0.2 -0.785 85.6 28.9 -89.1 133.5 -17.7 25.5 -11.7 11 16 A G T > S+ 0 0 9 30,-1.7 3,-1.0 -2,-0.4 6,-0.6 0.844 76.2 156.5 78.9 37.3 -14.7 26.8 -9.8 12 17 A A T < + 0 0 0 29,-2.5 30,-0.1 -3,-0.6 9,-0.1 0.740 63.7 60.7 -66.3 -26.6 -17.0 29.0 -7.6 13 18 A S T 3 S+ 0 0 18 28,-0.4 -1,-0.2 4,-0.1 29,-0.1 0.544 92.7 82.9 -81.3 -10.0 -14.5 29.2 -4.7 14 19 A G S <> S- 0 0 20 -3,-1.0 4,-2.3 68,-0.2 5,-0.2 -0.242 94.3 -99.2 -86.8 178.9 -11.7 30.8 -6.9 15 20 A Y H > S+ 0 0 93 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.941 121.4 44.9 -67.5 -51.1 -11.2 34.5 -7.8 16 21 A A H > S+ 0 0 22 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.915 115.7 48.7 -56.6 -45.2 -12.8 34.4 -11.3 17 22 A G H > S+ 0 0 0 -6,-0.6 4,-2.1 65,-0.3 -2,-0.2 0.882 111.5 50.3 -61.7 -43.0 -15.7 32.3 -9.9 18 23 A G H X S+ 0 0 1 -4,-2.3 4,-2.2 -7,-0.2 -1,-0.2 0.884 111.0 48.7 -61.0 -42.4 -16.2 34.8 -7.0 19 24 A E H X S+ 0 0 3 -4,-2.4 4,-2.3 2,-0.2 5,-0.2 0.882 107.7 53.3 -71.8 -37.4 -16.2 37.7 -9.4 20 25 A I H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.955 111.5 48.4 -56.5 -47.4 -18.8 36.1 -11.8 21 26 A L H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.892 108.2 53.2 -61.4 -42.7 -21.0 35.6 -8.8 22 27 A R H X S+ 0 0 80 -4,-2.2 4,-1.1 1,-0.2 -1,-0.2 0.925 113.4 43.4 -55.0 -47.7 -20.5 39.2 -7.7 23 28 A L H X S+ 0 0 10 -4,-2.3 4,-0.8 2,-0.2 3,-0.2 0.887 111.2 53.5 -72.0 -35.8 -21.6 40.5 -11.1 24 29 A L H >< S+ 0 0 0 -4,-2.8 3,-0.8 1,-0.2 6,-0.3 0.914 105.4 55.0 -64.0 -41.1 -24.5 38.0 -11.4 25 30 A L H 3< S+ 0 0 36 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.829 113.4 42.5 -56.9 -33.1 -25.8 39.3 -8.0 26 31 A G H 3< S+ 0 0 59 -4,-1.1 -1,-0.2 -3,-0.2 -2,-0.2 0.503 90.2 112.0 -91.8 -3.8 -25.8 42.8 -9.4 27 32 A H S XX S- 0 0 1 -3,-0.8 4,-1.6 -4,-0.8 3,-0.8 -0.409 71.1-131.9 -74.2 136.6 -27.2 41.9 -12.8 28 33 A P H 3> S+ 0 0 55 0, 0.0 4,-2.0 0, 0.0 6,-0.2 0.788 106.3 61.1 -62.1 -24.8 -30.8 43.2 -13.6 29 34 A A H 34>S+ 0 0 6 2,-0.2 6,-2.1 1,-0.2 5,-1.3 0.805 102.9 51.5 -70.6 -30.1 -31.8 39.7 -14.8 30 35 A Y H X45S+ 0 0 82 -3,-0.8 3,-0.8 -6,-0.3 -1,-0.2 0.921 110.1 49.8 -65.2 -45.5 -31.1 38.4 -11.3 31 36 A A H 3<5S+ 0 0 85 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.858 114.8 41.9 -62.1 -40.3 -33.2 41.1 -9.8 32 37 A D T 3<5S- 0 0 111 -4,-2.0 -1,-0.2 1,-0.0 -2,-0.2 0.338 115.3-109.8 -96.7 9.2 -36.2 40.5 -12.1 33 38 A G T < 5S+ 0 0 33 -3,-0.8 -3,-0.2 -4,-0.3 -4,-0.1 0.449 88.8 111.6 87.0 0.9 -36.0 36.7 -11.8 34 39 A R S S+ 0 0 80 -2,-0.2 3,-1.5 24,-0.2 -1,-0.2 0.569 100.2 0.9-103.5 -97.1 -12.8 20.4 -6.1 44 49 A T T 3 S+ 0 0 144 1,-0.3 -2,-0.0 23,-0.1 0, 0.0 0.743 123.4 69.9 -72.0 -20.9 -11.6 20.0 -2.5 45 50 A S T > S+ 0 0 29 2,-0.1 3,-2.1 21,-0.1 -1,-0.3 0.644 70.8 123.5 -68.3 -15.3 -13.8 22.9 -1.3 46 51 A A T < + 0 0 36 -3,-1.5 20,-0.2 1,-0.2 3,-0.1 -0.207 68.7 31.0 -52.3 135.7 -16.9 20.8 -1.9 47 52 A G T 3 S+ 0 0 61 18,-3.0 -1,-0.2 1,-0.4 2,-0.1 0.031 99.4 102.0 99.4 -22.1 -19.0 20.5 1.3 48 53 A S S < S- 0 0 19 -3,-2.1 17,-3.2 1,-0.1 -1,-0.4 -0.422 77.8-105.7 -85.4 163.6 -18.0 23.9 2.6 49 54 A T B > -G 64 0B 46 15,-0.2 3,-1.1 -2,-0.1 4,-0.2 -0.625 23.0-120.4 -87.1 156.3 -20.2 27.0 2.5 50 55 A L G >> S+ 0 0 0 13,-2.3 4,-3.0 10,-0.4 3,-2.1 0.838 110.6 66.3 -64.4 -32.7 -19.5 29.8 -0.1 51 56 A G G 34 S+ 0 0 19 10,-2.5 -1,-0.3 1,-0.3 11,-0.1 0.786 90.5 64.7 -57.3 -31.9 -19.0 32.3 2.8 52 57 A E G <4 S+ 0 0 132 -3,-1.1 -1,-0.3 9,-0.3 -2,-0.2 0.615 117.9 26.1 -65.1 -14.9 -15.9 30.4 3.9 53 58 A H T <4 S+ 0 0 33 -3,-2.1 -2,-0.2 -4,-0.2 -1,-0.2 0.691 133.4 29.1-115.3 -37.4 -14.4 31.4 0.5 54 59 A H >< + 0 0 3 -4,-3.0 3,-2.3 1,-0.1 6,-0.2 -0.655 58.4 171.0-131.4 72.2 -16.1 34.7 -0.5 55 60 A P T 3 S+ 0 0 95 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.649 77.2 66.5 -63.1 -12.3 -17.2 36.5 2.6 56 61 A H T 3 S+ 0 0 105 1,-0.2 2,-0.8 -3,-0.1 -5,-0.1 0.627 88.0 69.2 -74.7 -17.8 -18.0 39.6 0.4 57 62 A L X + 0 0 4 -3,-2.3 3,-1.8 1,-0.2 4,-0.3 -0.437 60.5 157.7-100.8 58.4 -20.9 37.6 -1.2 58 63 A T G > + 0 0 101 -2,-0.8 3,-1.4 1,-0.3 4,-0.3 0.800 63.7 64.8 -59.0 -33.5 -23.1 37.5 1.8 59 64 A P G 3 S+ 0 0 79 0, 0.0 -1,-0.3 0, 0.0 3,-0.1 0.776 116.5 32.3 -62.7 -18.8 -26.4 36.9 -0.1 60 65 A L G X S+ 0 0 2 -3,-1.8 3,-1.8 -6,-0.2 -10,-0.4 0.229 85.3 112.8-114.1 7.9 -24.9 33.5 -1.1 61 66 A A T < S+ 0 0 31 -3,-1.4 -10,-2.5 -4,-0.3 -9,-0.3 0.809 75.7 53.6 -52.8 -36.3 -22.8 32.8 2.0 62 67 A H T 3 S+ 0 0 128 -4,-0.3 -1,-0.3 -12,-0.2 2,-0.1 0.526 79.4 117.4 -79.4 -13.0 -25.0 29.8 3.0 63 68 A R < - 0 0 67 -3,-1.8 -13,-2.3 1,-0.1 2,-0.5 -0.360 64.6-130.9 -60.5 132.8 -24.7 28.0 -0.3 64 69 A V B -G 49 0B 82 -15,-0.2 -24,-0.4 -14,-0.1 -15,-0.2 -0.756 19.0-124.1 -88.0 126.3 -23.0 24.7 0.0 65 70 A V - 0 0 1 -17,-3.2 -18,-3.0 -2,-0.5 -24,-0.2 -0.489 30.9-156.7 -66.9 133.0 -20.2 24.1 -2.5 66 71 A E E -c 41 0A 80 -26,-2.8 -24,-2.1 -20,-0.2 -20,-0.1 -0.691 25.0 -85.7-109.9 165.8 -20.8 20.9 -4.5 67 72 A P E -c 42 0A 54 0, 0.0 2,-1.3 0, 0.0 -24,-0.2 -0.357 43.0-109.3 -69.0 152.8 -18.4 18.6 -6.4 68 73 A T + 0 0 39 -26,-1.4 2,-0.3 -27,-0.1 -58,-0.0 -0.693 68.7 135.5 -82.6 92.5 -17.5 19.5 -10.0 69 74 A E > - 0 0 106 -2,-1.3 4,-2.6 1,-0.1 3,-0.4 -0.982 66.2-117.2-142.6 148.1 -19.4 16.7 -11.8 70 75 A A H > S+ 0 0 28 -2,-0.3 4,-1.8 1,-0.2 -1,-0.1 0.855 114.0 55.3 -53.5 -41.0 -21.8 16.3 -14.8 71 76 A A H 4 S+ 0 0 91 2,-0.2 -1,-0.2 1,-0.2 -3,-0.0 0.888 112.0 43.2 -62.4 -39.2 -24.7 15.2 -12.6 72 77 A V H 4 S+ 0 0 29 -3,-0.4 -33,-0.2 1,-0.2 -2,-0.2 0.912 116.1 47.7 -72.0 -42.2 -24.4 18.3 -10.4 73 78 A L H >< S+ 0 0 2 -4,-2.6 3,-0.5 -35,-0.1 -2,-0.2 0.674 90.6 104.3 -74.9 -18.6 -23.9 20.6 -13.4 74 79 A G T 3< + 0 0 41 -4,-1.8 3,-0.1 -5,-0.2 21,-0.0 -0.213 68.9 39.5 -61.0 155.7 -26.9 19.1 -15.4 75 80 A G T 3 S+ 0 0 64 1,-0.3 2,-0.4 2,-0.0 -1,-0.2 0.740 86.5 117.3 72.1 24.2 -30.1 21.1 -15.6 76 81 A H < - 0 0 14 -3,-0.5 -1,-0.3 1,-0.1 -69,-0.2 -0.983 56.4-151.5-118.9 138.2 -28.5 24.4 -16.0 77 82 A D S S+ 0 0 75 -71,-1.6 23,-2.8 -2,-0.4 2,-0.3 0.740 86.4 27.2 -76.6 -26.1 -29.0 26.5 -19.1 78 83 A A E -bd 7 100A 0 -72,-1.6 -70,-2.4 21,-0.2 2,-0.4 -0.991 66.5-167.3-139.5 140.3 -25.6 28.2 -18.8 79 84 A V E -bd 8 101A 0 21,-2.9 23,-2.8 -2,-0.3 2,-0.5 -0.977 8.2-154.6-132.8 116.9 -22.4 27.0 -17.1 80 85 A F E -bd 9 102A 0 -72,-2.6 -70,-2.9 -2,-0.4 2,-0.7 -0.818 8.3-153.8 -87.8 130.5 -19.4 29.2 -16.3 81 86 A L E +bd 10 103A 0 21,-3.3 23,-3.0 -2,-0.5 24,-0.5 -0.905 23.1 166.3-106.7 104.1 -16.1 27.3 -16.1 82 87 A A + 0 0 15 -72,-3.0 -65,-0.3 -2,-0.7 -68,-0.2 -0.477 38.2 118.1-114.0 57.9 -13.7 29.2 -13.8 83 88 A L S S- 0 0 28 -2,-0.2 4,-0.1 1,-0.1 5,-0.1 -0.785 75.7 -79.6-119.6 159.9 -11.1 26.4 -13.4 84 89 A P - 0 0 100 0, 0.0 3,-0.4 0, 0.0 4,-0.2 -0.303 67.3 -89.3 -50.6 143.7 -7.4 26.0 -14.2 85 90 A H S S+ 0 0 69 1,-0.2 -3,-0.0 2,-0.1 19,-0.0 -0.020 105.2 55.6 -52.6 163.3 -7.1 25.1 -17.9 86 91 A G S S+ 0 0 42 -3,-0.1 -1,-0.2 36,-0.0 4,-0.1 0.599 92.9 72.1 89.9 12.5 -7.2 21.5 -19.1 87 92 A H S > S+ 0 0 100 -3,-0.4 4,-3.3 -4,-0.1 5,-0.2 0.541 76.4 73.4-122.5 -22.0 -10.5 20.5 -17.6 88 93 A S H > S+ 0 0 3 2,-0.2 4,-3.4 1,-0.2 5,-0.2 0.823 94.7 51.2 -75.9 -29.7 -13.0 22.3 -19.7 89 94 A A H > S+ 0 0 36 2,-0.2 4,-1.7 3,-0.2 -1,-0.2 0.982 116.9 40.9 -65.0 -56.4 -12.7 20.1 -22.8 90 95 A V H > S+ 0 0 96 1,-0.2 4,-0.7 2,-0.2 -2,-0.2 0.926 123.0 41.8 -48.8 -51.9 -13.2 17.0 -20.7 91 96 A L H >X S+ 0 0 13 -4,-3.3 3,-1.1 1,-0.2 4,-0.7 0.914 110.4 54.8 -68.6 -44.9 -16.0 18.8 -18.7 92 97 A A H 3< S+ 0 0 11 -4,-3.4 3,-0.4 1,-0.3 -1,-0.2 0.790 103.1 58.7 -58.9 -32.8 -17.6 20.5 -21.7 93 98 A Q H 3< S+ 0 0 169 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.754 102.7 53.6 -65.9 -29.6 -18.0 17.1 -23.3 94 99 A Q H << S+ 0 0 102 -3,-1.1 -1,-0.2 -4,-0.7 -2,-0.2 0.657 93.7 86.0 -84.0 -17.7 -20.1 15.8 -20.4 95 100 A L S < S- 0 0 12 -4,-0.7 -21,-0.1 -3,-0.4 -24,-0.1 -0.472 97.2 -84.9 -83.3 153.0 -22.7 18.6 -20.4 96 101 A S > - 0 0 56 -2,-0.1 3,-2.0 1,-0.1 -1,-0.1 -0.366 43.4-124.6 -52.4 131.2 -25.8 18.7 -22.5 97 102 A P T 3 S+ 0 0 96 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.736 106.1 58.4 -58.0 -29.2 -24.7 20.1 -25.9 98 103 A E T 3 S+ 0 0 125 2,-0.1 -2,-0.1 0, 0.0 2,-0.0 0.518 79.7 115.0 -81.8 -5.0 -27.2 23.0 -25.9 99 104 A T S < S- 0 0 8 -3,-2.0 2,-0.7 1,-0.1 -21,-0.2 -0.365 75.3-120.0 -60.0 136.6 -25.9 24.4 -22.6 100 105 A L E -d 78 0A 0 -23,-2.8 -21,-2.9 47,-0.1 2,-0.5 -0.790 35.3-163.4 -75.8 116.4 -24.3 27.8 -23.0 101 106 A I E -de 79 147A 0 45,-2.7 47,-2.2 -2,-0.7 2,-0.6 -0.914 10.2-170.4-112.5 123.6 -20.7 27.0 -21.8 102 107 A I E -de 80 148A 0 -23,-2.8 -21,-3.3 -2,-0.5 2,-0.6 -0.933 7.5-162.4-120.4 106.0 -18.5 30.0 -20.9 103 108 A D E -de 81 149A 3 45,-3.0 47,-2.9 -2,-0.6 -21,-0.2 -0.804 15.5-173.4-101.0 118.1 -14.9 29.0 -20.3 104 109 A C + 0 0 12 -23,-3.0 -22,-0.1 -2,-0.6 -1,-0.1 0.693 65.9 79.8 -78.1 -21.7 -12.6 31.4 -18.4 105 110 A G S S- 0 0 10 -24,-0.5 3,-0.4 -21,-0.1 45,-0.2 -0.112 91.5-103.5 -81.8-175.8 -9.5 29.3 -19.1 106 111 A A S >> S+ 0 0 5 1,-0.2 3,-2.1 2,-0.1 4,-0.7 0.560 86.1 101.5 -86.4 -11.3 -7.3 29.0 -22.2 107 112 A D T 34 S+ 0 0 8 1,-0.3 18,-0.5 2,-0.1 19,-0.2 0.748 94.2 28.0 -56.1 -33.5 -8.4 25.7 -23.7 108 113 A F T 34 S+ 0 0 13 -3,-0.4 20,-2.8 42,-0.1 -1,-0.3 0.226 100.4 86.3-114.3 15.4 -10.6 27.2 -26.4 109 114 A R T <4 S+ 0 0 20 -3,-2.1 2,-0.2 18,-0.2 -2,-0.1 0.871 72.0 74.4 -80.5 -41.4 -8.9 30.5 -27.0 110 115 A L < - 0 0 1 -4,-0.7 16,-0.1 16,-0.2 107,-0.1 -0.490 51.9-165.6 -91.5 148.6 -6.2 29.7 -29.5 111 116 A T + 0 0 92 -2,-0.2 2,-0.5 1,-0.1 -1,-0.1 0.423 69.9 75.9-111.1 -1.8 -6.7 29.0 -33.2 112 117 A D > - 0 0 79 1,-0.1 4,-2.5 14,-0.1 5,-0.1 -0.947 60.5-160.1-118.0 117.4 -3.3 27.5 -34.1 113 118 A A H > S+ 0 0 53 -2,-0.5 4,-2.3 1,-0.2 11,-0.2 0.813 91.7 49.9 -62.9 -37.8 -2.6 23.9 -33.0 114 119 A A H > S+ 0 0 65 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.871 112.0 48.5 -73.9 -36.5 1.2 24.1 -33.2 115 120 A V H > S+ 0 0 39 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.925 112.0 50.7 -61.8 -46.7 1.2 27.3 -31.1 116 121 A W H X S+ 0 0 3 -4,-2.5 4,-2.9 1,-0.2 5,-0.4 0.945 111.9 46.1 -54.4 -54.1 -1.1 25.7 -28.6 117 122 A E H X S+ 0 0 113 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.885 110.4 54.1 -60.4 -41.8 1.0 22.6 -28.2 118 123 A R H < S+ 0 0 156 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.941 120.4 30.0 -58.4 -48.7 4.2 24.6 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158 B C H > S+ 0 0 17 2,-0.2 4,-1.8 1,-0.2 5,-0.2 0.935 111.5 48.2 -68.9 -46.4 17.1 56.9 -10.1 500 159 B Y H > S+ 0 0 6 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.940 110.9 50.8 -62.6 -46.3 15.5 55.7 -13.4 501 160 B P H > S+ 0 0 0 0, 0.0 4,-3.2 0, 0.0 5,-0.3 0.880 106.1 57.2 -54.7 -38.6 18.8 56.2 -15.4 502 161 B T H X S+ 0 0 1 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.941 112.5 39.7 -56.7 -51.3 20.7 54.2 -12.8 503 162 B A H X S+ 0 0 0 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.943 119.0 46.3 -64.7 -50.1 18.5 51.2 -13.3 504 163 B A H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 5,-0.2 0.910 113.0 49.2 -58.5 -48.6 18.2 51.5 -17.1 505 164 B L H X S+ 0 0 0 -4,-3.2 4,-2.8 -5,-0.2 -1,-0.2 0.908 111.6 47.3 -63.1 -43.9 21.9 52.1 -17.7 506 165 B L H < S+ 0 0 0 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.874 113.9 50.0 -65.0 -36.8 23.0 49.1 -15.5 507 166 B A H < S+ 0 0 0 -4,-2.0 4,-0.2 -5,-0.2 -2,-0.2 0.869 126.0 22.7 -64.6 -36.4 20.5 47.0 -17.4 508 167 B L H X S+ 0 0 0 -4,-2.0 4,-2.2 -5,-0.1 3,-0.3 0.737 96.4 81.0-108.5 -31.7 21.6 48.0 -20.9 509 168 B F H X S+ 0 0 10 -4,-2.8 4,-3.0 1,-0.2 5,-0.3 0.858 90.6 54.0 -60.9 -40.5 25.1 49.4 -21.1 510 169 B P H > S+ 0 0 6 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.929 112.6 44.2 -60.4 -41.9 27.0 46.0 -21.3 511 170 B A H 4>S+ 0 0 0 -3,-0.3 5,-2.7 -4,-0.2 6,-0.5 0.920 118.4 43.7 -63.0 -46.2 25.0 44.7 -24.2 512 171 B L H ><5S+ 0 0 2 -4,-2.2 3,-1.3 3,-0.2 -1,-0.2 0.881 111.4 53.0 -68.1 -41.9 25.2 48.1 -26.1 513 172 B A H 3<5S+ 0 0 51 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.805 109.5 49.6 -62.0 -33.9 28.9 48.6 -25.4 514 173 B A T 3<5S- 0 0 48 -4,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.319 114.5-120.9 -83.9 4.9 29.6 45.1 -26.8 515 174 B D T < 5S+ 0 0 96 -3,-1.3 -3,-0.2 1,-0.1 -2,-0.1 0.848 74.8 129.9 52.1 44.5 27.5 46.0 -29.9 516 175 B L < + 0 0 11 -5,-2.7 85,-0.6 -6,-0.1 2,-0.3 0.406 63.3 38.9-107.1 -2.3 25.2 43.1 -29.2 517 176 B I S S- 0 0 7 -6,-0.5 82,-0.2 82,-0.1 81,-0.1 -0.962 91.0 -92.5-139.5 161.5 21.9 45.0 -29.4 518 177 B E - 0 0 83 80,-2.8 -2,-0.1 -2,-0.3 58,-0.0 -0.370 33.9-121.2 -66.3 151.2 20.4 47.8 -31.5 519 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39.9-106.3 -63.0 166.6 7.7 53.4 -5.6 529 188 B T G > S+ 0 0 34 58,-3.0 3,-1.7 56,-0.3 59,-0.2 0.640 104.8 80.9 -81.1 -14.4 6.4 56.8 -4.6 530 189 B S G > S+ 0 0 10 58,-2.1 3,-1.8 1,-0.3 -1,-0.2 0.759 77.6 75.0 -64.5 -20.5 9.4 58.1 -2.5 531 190 B G G < S+ 0 0 42 -3,-0.9 -1,-0.3 1,-0.3 -2,-0.1 0.726 88.5 59.8 -63.7 -20.4 11.1 59.0 -5.8 532 191 B A G < S- 0 0 57 -3,-1.7 -1,-0.3 1,-0.2 3,-0.3 0.403 109.3-123.1 -89.2 1.1 8.8 62.0 -6.1 533 192 B G < - 0 0 31 -3,-1.8 -1,-0.2 1,-0.2 -2,-0.0 -0.058 26.4 -78.9 80.8 175.6 9.9 63.6 -2.8 534 193 B R S S+ 0 0 99 -3,-0.1 2,-0.2 2,-0.1 -1,-0.2 0.364 79.7 125.2-102.7 6.9 7.9 64.5 0.2 535 194 B A S S- 0 0 77 -3,-0.3 2,-0.5 1,-0.1 5,-0.1 -0.517 72.4-108.3 -59.9 130.5 6.4 67.8 -0.9 536 195 B A + 0 0 107 -2,-0.2 2,-0.3 3,-0.0 -1,-0.1 -0.514 50.6 161.3 -71.9 114.8 2.6 67.4 -0.4 537 196 B T > - 0 0 64 -2,-0.5 3,-1.3 1,-0.1 4,-0.3 -0.970 45.5-124.9-126.3 152.2 0.7 67.0 -3.7 538 197 B T G > S+ 0 0 103 -2,-0.3 3,-1.4 1,-0.3 6,-0.2 0.896 109.6 58.0 -61.9 -36.5 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