==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 25-OCT-08 2W29 . COMPND 2 MOLECULE: PROBABLE TRANSCRIPTIONAL REGULATORY PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR T.SHRIVASTAVA,S.DEY,R.RAVISHANKAR . 588 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27846.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 438 74.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 142 24.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.7 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 . 2 0.3 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 . 42 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 172 29.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 2.7 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 4 0 0 4 0 0 2 4 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 2 6 2 6 2 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 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 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 4 A A 0 0 123 0, 0.0 2,-0.4 0, 0.0 206,-0.0 0.000 360.0 360.0 360.0 92.0 -5.1 43.5 -5.0 2 5 A L - 0 0 30 4,-0.0 0, 0.0 3,-0.0 0, 0.0 -0.889 360.0-167.9-125.9 101.6 -4.7 41.1 -8.0 3 6 A D > - 0 0 73 -2,-0.4 4,-2.1 1,-0.1 5,-0.1 -0.088 42.6 -88.2 -76.1-177.9 -1.1 39.9 -8.6 4 7 A D H > S+ 0 0 124 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.818 126.4 52.1 -63.5 -34.5 0.0 38.0 -11.7 5 8 A I H > S+ 0 0 44 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.943 109.7 48.2 -67.0 -51.8 -0.9 34.6 -10.4 6 9 A D H > S+ 0 0 2 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.906 109.6 54.4 -55.2 -44.2 -4.4 35.6 -9.5 7 10 A R H X S+ 0 0 70 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.935 107.9 49.4 -54.1 -52.1 -4.8 37.2 -12.9 8 11 A I H X S+ 0 0 64 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.882 109.7 51.7 -53.2 -43.6 -3.8 33.8 -14.5 9 12 A L H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.919 110.0 47.6 -65.3 -42.9 -6.3 31.9 -12.4 10 13 A V H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.887 110.5 52.0 -68.9 -37.1 -9.2 34.1 -13.3 11 14 A R H X S+ 0 0 131 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.950 113.9 44.3 -56.0 -53.2 -8.4 34.0 -17.0 12 15 A E H X S+ 0 0 56 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.857 114.0 48.2 -61.4 -37.5 -8.3 30.1 -16.9 13 16 A L H < S+ 0 0 0 -4,-2.3 188,-1.1 2,-0.2 -1,-0.2 0.868 110.9 52.5 -74.8 -29.7 -11.4 29.9 -14.8 14 17 A A H < S+ 0 0 16 -4,-2.3 3,-0.3 186,-0.2 -2,-0.2 0.952 116.1 39.9 -63.1 -49.3 -13.2 32.4 -17.3 15 18 A A H < S+ 0 0 87 -4,-2.6 184,-0.3 1,-0.2 2,-0.2 0.786 137.5 13.1 -71.5 -30.9 -12.2 30.2 -20.3 16 19 A D >< - 0 0 69 -4,-2.2 3,-1.7 -5,-0.2 184,-0.3 -0.741 59.6-175.4-151.0 102.8 -12.9 26.9 -18.4 17 20 A G T 3 S+ 0 0 0 182,-1.6 183,-0.2 1,-0.3 -4,-0.1 0.492 88.3 55.5 -83.1 -7.1 -14.8 26.9 -15.1 18 21 A R T 3 S+ 0 0 62 181,-0.3 -1,-0.3 2,-0.1 -5,-0.1 0.053 72.8 141.3-103.8 13.8 -14.3 23.1 -14.6 19 22 A A < - 0 0 5 -3,-1.7 2,-0.2 -7,-0.2 -3,-0.0 -0.395 53.3-129.5 -47.0 125.1 -10.4 23.5 -14.9 20 23 A T >> - 0 0 83 1,-0.1 4,-2.2 -2,-0.0 3,-0.7 -0.611 14.9-112.1 -81.7 157.9 -9.3 21.1 -12.2 21 24 A L H 3> S+ 0 0 45 1,-0.3 4,-3.2 2,-0.2 5,-0.2 0.853 115.4 59.0 -59.9 -39.0 -6.8 22.3 -9.6 22 25 A S H 3> S+ 0 0 68 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.908 109.5 44.7 -57.1 -38.4 -4.0 20.1 -10.9 23 26 A E H <> S+ 0 0 92 -3,-0.7 4,-1.8 2,-0.2 -2,-0.2 0.909 113.9 48.9 -70.8 -41.0 -4.3 21.8 -14.3 24 27 A L H X S+ 0 0 2 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.880 111.1 53.1 -61.1 -40.7 -4.5 25.3 -12.8 25 28 A A H X>S+ 0 0 4 -4,-3.2 5,-2.3 2,-0.2 4,-0.9 0.922 109.3 44.5 -60.6 -50.8 -1.4 24.4 -10.6 26 29 A T H <5S+ 0 0 111 -4,-1.9 3,-0.4 1,-0.2 -1,-0.2 0.866 113.6 54.1 -69.8 -29.6 0.8 23.4 -13.4 27 30 A R H <5S+ 0 0 104 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.792 116.6 34.9 -68.7 -32.6 -0.4 26.4 -15.3 28 31 A A H <5S- 0 0 14 -4,-1.8 -1,-0.2 -3,-0.1 -2,-0.2 0.363 108.9-117.6 -98.5 4.1 0.5 28.9 -12.6 29 32 A G T <5S+ 0 0 71 -4,-0.9 2,-0.3 -3,-0.4 -3,-0.2 0.921 76.0 118.0 57.6 45.5 3.7 27.1 -11.3 30 33 A L S - 0 0 72 -2,-0.3 4,-2.4 -3,-0.1 3,-0.3 -0.599 37.7-110.0 -81.3 158.7 1.2 23.5 -5.8 32 35 A V H > S+ 0 0 70 1,-0.3 4,-2.3 -2,-0.2 5,-0.1 0.816 120.1 52.4 -56.1 -35.5 -2.4 22.2 -5.9 33 36 A S H > S+ 0 0 85 2,-0.2 4,-1.3 1,-0.2 -1,-0.3 0.852 107.5 48.8 -70.4 -39.4 -2.8 23.5 -2.3 34 37 A A H > S+ 0 0 31 -3,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.911 112.9 50.1 -70.1 -33.5 -1.6 26.9 -3.0 35 38 A V H X S+ 0 0 0 -4,-2.4 4,-3.0 1,-0.2 5,-0.2 0.944 108.1 51.3 -67.6 -50.2 -4.0 27.0 -6.0 36 39 A Q H X S+ 0 0 79 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.831 111.6 49.7 -56.5 -30.2 -6.9 25.9 -4.0 37 40 A S H X S+ 0 0 76 -4,-1.3 4,-1.7 2,-0.2 -2,-0.2 0.952 110.2 46.5 -74.1 -55.9 -6.0 28.6 -1.5 38 41 A R H X S+ 0 0 44 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.909 113.0 52.8 -39.6 -55.8 -5.8 31.5 -4.1 39 42 A V H X S+ 0 0 10 -4,-3.0 4,-2.4 1,-0.2 -2,-0.2 0.901 108.2 49.2 -57.9 -47.5 -9.1 30.2 -5.6 40 43 A R H X S+ 0 0 159 -4,-1.8 4,-1.7 -5,-0.2 -1,-0.2 0.858 111.2 49.4 -56.0 -42.8 -10.9 30.3 -2.2 41 44 A R H X S+ 0 0 111 -4,-1.7 4,-2.7 2,-0.2 6,-0.2 0.936 108.3 53.6 -65.7 -44.0 -9.6 33.8 -1.6 42 45 A L H < S+ 0 0 0 -4,-2.5 6,-1.4 1,-0.2 5,-0.4 0.914 111.8 48.1 -52.7 -44.0 -10.8 34.9 -5.1 43 46 A E H < S+ 0 0 82 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.867 112.8 43.9 -66.1 -36.5 -14.2 33.5 -4.1 44 47 A S H < S+ 0 0 99 -4,-1.7 -2,-0.2 -3,-0.2 -1,-0.2 0.813 111.4 56.3 -90.0 -29.6 -14.5 35.2 -0.7 45 48 A R S < S- 0 0 83 -4,-2.7 3,-0.2 -5,-0.2 -3,-0.0 -0.170 117.2 -86.3 -75.1-172.5 -13.3 38.6 -1.8 46 49 A G S S+ 0 0 47 1,-0.2 158,-0.2 -2,-0.1 161,-0.1 0.670 101.1 93.9 -69.6 -7.5 -15.4 39.9 -4.7 47 50 A V S S+ 0 0 4 -5,-0.4 157,-2.8 -6,-0.2 2,-0.5 0.823 80.6 35.3 -79.7 -48.1 -13.6 38.3 -7.6 48 51 A V E -A 203 0A 6 -6,-1.4 155,-0.2 155,-0.2 3,-0.1 -0.915 62.4-174.1-103.5 127.5 -15.2 34.9 -8.7 49 52 A Q E - 0 0 105 153,-4.2 2,-0.3 -2,-0.5 154,-0.1 0.550 56.0 -56.4-106.8 -10.8 -18.9 35.1 -8.2 50 53 A G E -A 202 0A 17 152,-0.5 152,-3.7 2,-0.0 -1,-0.4 -0.890 52.9 -97.5 155.7-174.7 -19.8 31.5 -9.0 51 54 A Y E -A 201 0A 18 150,-0.3 114,-1.8 112,-0.3 2,-0.3 -0.986 36.3-178.2-137.2 142.9 -19.5 29.0 -11.8 52 55 A S E -A 200 0A 12 148,-2.8 148,-2.1 -2,-0.4 2,-0.5 -1.000 31.7-123.2-148.3 134.4 -22.0 28.2 -14.4 53 56 A A E -A 199 0A 0 108,-2.3 2,-0.8 -2,-0.3 146,-0.3 -0.700 38.2-126.3 -64.8 126.9 -22.6 25.9 -17.4 54 57 A R E - 0 0 28 144,-2.5 143,-4.4 -2,-0.5 144,-0.5 -0.745 34.7-157.7 -78.2 109.2 -23.4 28.2 -20.3 55 58 A I E -A 196 0A 8 -2,-0.8 141,-0.2 141,-0.2 140,-0.1 -0.688 20.2-117.0 -97.9 139.8 -26.7 26.8 -21.5 56 59 A N > - 0 0 41 139,-3.0 4,-1.3 -2,-0.3 6,-0.2 -0.667 21.2-155.5 -78.4 114.7 -28.3 27.2 -25.0 57 60 A P T >4>S+ 0 0 33 0, 0.0 5,-2.3 0, 0.0 3,-0.5 0.919 93.0 53.2 -65.3 -36.7 -31.5 29.1 -24.3 58 61 A E G >45S+ 0 0 122 1,-0.2 3,-2.6 3,-0.2 137,-0.1 0.938 101.2 57.5 -54.1 -50.1 -33.0 27.7 -27.5 59 62 A A G 345S+ 0 0 39 1,-0.3 -1,-0.2 135,-0.2 136,-0.1 0.800 109.0 47.7 -53.9 -32.1 -32.3 24.0 -26.6 60 63 A V G <<5S- 0 0 4 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.278 128.1 -93.9 -96.2 12.3 -34.3 24.4 -23.4 61 64 A G T < 5S+ 0 0 34 -3,-2.6 2,-1.1 1,-0.2 -3,-0.2 0.566 82.8 128.5 93.6 9.2 -37.3 26.1 -25.1 62 65 A H < + 0 0 16 -5,-2.3 48,-0.2 1,-0.2 -1,-0.2 -0.808 21.3 162.2 -95.9 90.9 -36.7 29.9 -24.8 63 66 A L + 0 0 121 -2,-1.1 2,-0.4 46,-0.4 47,-0.2 0.563 57.9 56.1 -86.4 -6.8 -37.1 30.9 -28.4 64 67 A L E +B 109 0B 32 45,-2.4 45,-2.5 -3,-0.1 2,-0.4 -0.977 58.5 179.8-131.4 126.7 -37.6 34.6 -27.7 65 68 A S E +BC 108 135B 14 70,-0.5 70,-2.7 -2,-0.4 2,-0.3 -0.942 8.8 177.3-117.6 147.3 -35.3 36.9 -25.9 66 69 A A E -BC 107 134B 0 41,-2.1 41,-2.2 -2,-0.4 2,-0.5 -0.974 28.6-132.2-142.3 154.9 -35.9 40.6 -25.3 67 70 A F E -BC 106 133B 17 66,-2.9 66,-2.8 -2,-0.3 2,-0.5 -0.916 27.0-165.4 -94.2 139.5 -34.3 43.7 -23.6 68 71 A V E -BC 105 132B 0 37,-2.5 37,-2.8 -2,-0.5 2,-0.4 -0.959 8.1-159.0-126.8 114.1 -36.9 45.5 -21.5 69 72 A A E -BC 104 131B 4 62,-2.9 62,-2.0 -2,-0.5 2,-0.4 -0.750 18.6-163.7 -81.7 137.8 -36.1 49.0 -20.3 70 73 A I E -BC 103 130B 0 33,-2.6 33,-2.3 -2,-0.4 32,-2.0 -0.958 14.1-172.4-128.1 141.8 -38.4 49.9 -17.2 71 74 A T E - C 0 129B 23 58,-1.9 58,-2.5 -2,-0.4 30,-0.1 -0.992 30.4-111.0-134.2 125.3 -39.2 53.1 -15.6 72 75 A P E - C 0 128B 13 0, 0.0 56,-0.3 0, 0.0 55,-0.1 -0.285 12.7-141.6 -52.6 134.6 -41.2 53.6 -12.2 73 76 A L S S+ 0 0 96 54,-2.4 55,-0.1 1,-0.3 54,-0.1 0.843 102.0 30.6 -61.2 -38.7 -44.7 55.1 -12.5 74 77 A D S > S+ 0 0 66 53,-0.4 3,-0.7 1,-0.1 -1,-0.3 -0.853 70.6 179.7-121.3 94.5 -44.0 57.0 -9.3 75 78 A P T 3 + 0 0 75 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.515 69.1 77.0 -73.5 -0.4 -40.2 57.8 -9.1 76 79 A S T 3 S+ 0 0 76 2,-0.1 3,-0.1 492,-0.0 -2,-0.0 0.874 77.5 81.8 -77.8 -40.1 -40.4 59.7 -5.7 77 80 A Q S < S- 0 0 99 -3,-0.7 3,-0.1 1,-0.1 -3,-0.0 -0.432 102.7 -95.3 -57.3 133.2 -40.7 56.4 -3.6 78 81 A P - 0 0 108 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.315 57.2-100.6 -54.9 143.2 -37.3 54.8 -3.0 79 82 A D + 0 0 49 1,-0.1 -3,-0.0 -4,-0.1 0, 0.0 -0.593 44.8 171.5 -94.6 125.7 -37.1 52.3 -5.7 80 83 A D >> + 0 0 86 -2,-0.5 4,-2.2 46,-0.2 3,-0.7 0.365 39.5 115.7 -94.0 -10.4 -37.8 48.6 -5.2 81 84 A A H 3> S+ 0 0 0 1,-0.3 4,-2.0 2,-0.2 5,-0.2 0.771 72.4 46.8 -64.6 -44.7 -37.7 47.2 -8.6 82 85 A P H 3> S+ 0 0 9 0, 0.0 4,-0.6 0, 0.0 -1,-0.3 0.901 116.4 47.9 -57.2 -40.8 -34.8 44.7 -8.8 83 86 A A H X4 S+ 0 0 65 -3,-0.7 3,-1.1 1,-0.2 4,-0.4 0.963 113.4 47.2 -66.0 -50.6 -35.9 43.1 -5.4 84 87 A R H 3< S+ 0 0 121 -4,-2.2 3,-0.4 1,-0.2 -1,-0.2 0.803 115.9 44.2 -62.3 -26.4 -39.5 42.8 -6.5 85 88 A L H >< S+ 0 0 0 -4,-2.0 3,-1.4 -5,-0.2 6,-0.2 0.499 88.2 91.2 -94.5 -1.3 -38.6 41.3 -9.9 86 89 A E T << S+ 0 0 99 -3,-1.1 -1,-0.2 -4,-0.6 -2,-0.1 0.851 84.0 53.5 -65.2 -27.1 -36.1 38.9 -8.5 87 90 A H T 3 S+ 0 0 121 -4,-0.4 2,-0.7 -3,-0.4 -1,-0.3 0.535 82.6 93.4 -91.5 -10.0 -38.7 36.3 -8.1 88 91 A I X - 0 0 0 -3,-1.4 3,-1.1 1,-0.1 -3,-0.0 -0.808 67.5-156.4 -76.9 118.1 -39.9 36.4 -11.7 89 92 A E T 3 S+ 0 0 106 -2,-0.7 -1,-0.1 1,-0.3 -2,-0.0 0.761 82.2 64.5 -79.1 -26.9 -37.8 33.6 -13.1 90 93 A E T 3 S+ 0 0 48 17,-0.1 18,-1.5 -3,-0.1 2,-0.7 0.624 79.3 96.8 -81.3 3.3 -37.7 34.5 -16.7 91 94 A V E < +D 107 0B 0 -3,-1.1 16,-0.2 -6,-0.2 3,-0.1 -0.768 49.1 174.6 -83.0 114.9 -35.9 37.6 -15.7 92 95 A E E + 0 0 17 14,-2.1 199,-2.1 -2,-0.7 2,-0.3 0.778 60.8 15.4 -90.7 -34.9 -32.1 36.7 -16.3 93 96 A S E -D 106 0B 1 13,-1.3 13,-1.7 196,-0.2 2,-0.4 -1.000 54.4-165.7-145.8 154.0 -30.4 40.1 -15.7 94 97 A C E +DE 105 288B 0 194,-1.9 193,-2.4 -2,-0.3 194,-1.0 -0.965 13.0 172.5-144.1 115.8 -31.2 43.4 -14.1 95 98 A Y E -DE 104 286B 13 9,-2.7 9,-2.4 -2,-0.4 2,-0.3 -0.933 26.5-137.5-119.3 144.5 -29.1 46.6 -14.5 96 99 A S E -DE 103 285B 0 189,-1.9 188,-2.3 -2,-0.4 189,-0.9 -0.804 33.5-167.4 -94.5 155.7 -29.8 50.1 -13.4 97 100 A V E - E 0 283B 8 5,-2.4 186,-0.2 -2,-0.3 2,-0.2 -0.825 20.1-116.0-143.8 155.9 -28.8 52.6 -16.2 98 101 A A S S+ 0 0 10 184,-2.0 2,-0.4 -2,-0.3 3,-0.3 -0.530 74.9 43.8 -86.0 170.1 -28.3 56.2 -16.8 99 102 A T S S- 0 0 101 1,-0.2 477,-0.1 -2,-0.2 182,-0.0 -0.737 113.2 -24.5 99.3-136.4 -30.5 58.3 -19.1 100 103 A E S S+ 0 0 170 -2,-0.4 -1,-0.2 475,-0.1 2,-0.1 0.911 119.2 54.9 -95.7 -34.5 -34.1 58.3 -19.4 101 104 A E - 0 0 35 -3,-0.3 -30,-0.2 1,-0.1 -4,-0.1 -0.476 69.1-142.0 -90.4 163.9 -35.1 54.8 -18.1 102 105 A S S S+ 0 0 34 -32,-2.0 -5,-2.4 1,-0.2 2,-0.3 0.861 73.6 15.9 -96.6 -40.3 -34.2 53.4 -14.8 103 106 A Y E -BD 70 96B 8 -33,-2.3 -33,-2.6 -7,-0.3 2,-0.5 -0.957 53.4-150.3-135.1 153.9 -33.4 49.7 -15.5 104 107 A V E -BD 69 95B 14 -9,-2.4 -9,-2.7 -2,-0.3 2,-0.4 -0.989 18.8-168.3-116.8 131.1 -32.7 47.4 -18.3 105 108 A L E -BD 68 94B 0 -37,-2.8 -37,-2.5 -2,-0.5 2,-0.5 -0.877 15.8-146.6-107.3 148.3 -33.8 43.7 -18.0 106 109 A L E -BD 67 93B 7 -13,-1.7 -14,-2.1 -2,-0.4 -13,-1.3 -0.964 28.2-179.3-106.3 139.7 -32.9 40.7 -20.2 107 110 A V E -BD 66 91B 1 -41,-2.2 -41,-2.1 -2,-0.5 2,-0.4 -0.942 16.5-158.7-140.3 143.4 -35.7 38.3 -20.4 108 111 A R E +B 65 0B 24 -18,-1.5 2,-0.3 -2,-0.3 -43,-0.2 -0.999 18.4 166.9-132.5 144.8 -36.3 34.9 -22.1 109 112 A V E -B 64 0B 7 -45,-2.5 -45,-2.4 -2,-0.4 -46,-0.4 -0.914 43.3-114.1-152.8 159.6 -39.6 33.4 -23.0 110 113 A A S S- 0 0 52 -2,-0.3 2,-0.3 -48,-0.2 -47,-0.3 0.828 85.9 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0.627 124.4 46.7 -41.3 -20.3 -21.7 8.2 -11.7 181 36 B S T > S+ 0 0 85 2,-0.1 4,-0.9 3,-0.1 -1,-0.2 0.867 113.3 45.5 -89.4 -52.7 -21.6 6.3 -15.0 182 37 B A H >> S+ 0 0 26 1,-0.2 4,-1.5 2,-0.2 3,-0.6 0.905 113.9 48.4 -60.6 -49.6 -25.2 7.2 -16.0 183 38 B V H 3X S+ 0 0 0 -4,-3.0 4,-1.8 1,-0.2 -1,-0.2 0.890 106.6 58.6 -52.2 -43.0 -24.8 11.0 -15.1 184 39 B Q H 3> S+ 0 0 112 -5,-0.4 4,-1.1 -4,-0.3 -1,-0.2 0.763 106.1 47.9 -68.8 -23.8 -21.5 11.2 -17.0 185 40 B S H S+ 0 0 1 -4,-2.8 6,-1.6 -5,-0.3 5,-1.3 0.792 110.3 46.6 -65.3 -32.1 -25.7 17.4 -23.6 191 46 B E H <5S+ 0 0 91 -4,-1.5 -1,-0.2 4,-0.2 -2,-0.2 0.752 114.3 47.4 -81.9 -25.4 -22.4 18.9 -24.6 192 47 B S H <5S+ 0 0 108 -4,-1.1 -2,-0.2 -5,-0.1 -3,-0.2 0.969 106.3 57.0 -80.7 -61.6 -22.5 17.3 -28.1 193 48 B R T <5S- 0 0 53 -4,-2.4 2,-2.0 1,-0.1 3,-0.5 -0.481 118.8-102.8 -49.9 136.5 -26.1 18.2 -28.9 194 49 B G T 5S+ 0 0 49 1,-0.2 -135,-0.2 -2,-0.1 -3,-0.1 0.042 90.5 113.4 -66.9 41.2 -25.5 22.1 -28.4 195 50 B V S - 0 0 36 -157,-2.8 4,-0.8 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137.5 13.1 -71.4 -30.9 -8.9 75.6 -0.3 312 19 C D >< - 0 0 67 -4,-2.2 3,-1.7 -5,-0.2 184,-0.3 -0.741 59.6-175.4-150.9 102.9 -5.8 77.8 -0.5 313 20 C G T 3 S+ 0 0 0 182,-2.7 183,-0.2 1,-0.3 -4,-0.1 0.491 88.3 55.5 -83.1 -7.1 -3.3 77.5 -3.4 314 21 C R T 3 S+ 0 0 63 181,-0.3 -1,-0.3 2,-0.1 -5,-0.1 0.054 72.8 141.3-104.0 13.9 -0.9 80.0 -2.0 315 22 C A < - 0 0 4 -3,-1.7 2,-0.2 -7,-0.2 -3,-0.0 -0.394 53.3-129.4 -47.0 124.9 -0.7 78.0 1.4 316 23 C T >> - 0 0 81 1,-0.1 4,-2.2 -2,-0.0 3,-0.7 -0.612 14.9-112.2 -81.7 157.9 3.0 78.4 2.2 317 24 C L H 3> S+ 0 0 43 1,-0.3 4,-3.2 2,-0.2 5,-0.2 0.854 115.4 59.0 -59.9 -38.9 5.0 75.3 3.0 318 25 C S H 3> S+ 0 0 70 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.908 109.5 44.7 -57.1 -38.4 5.5 76.3 6.6 319 26 C E H <> S+ 0 0 93 -3,-0.7 4,-1.8 2,-0.2 -2,-0.2 0.909 113.9 48.9 -70.8 -41.1 1.7 76.4 7.1 320 27 C L H X S+ 0 0 2 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.881 111.1 53.2 -61.0 -40.6 1.2 73.1 5.2 321 28 C A H X>S+ 0 0 5 -4,-3.2 5,-2.3 2,-0.2 4,-0.9 0.922 109.3 44.5 -60.8 -50.9 4.0 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39.2-143.6 -80.0 146.5 -36.3 66.1 -12.1 574 133 D T E -Q 514 0D 32 -2,-0.3 2,-0.4 -60,-0.2 -60,-0.2 -0.875 22.7-179.5-113.3 147.5 -32.7 65.1 -13.2 575 134 D R E -Q 513 0D 87 -62,-1.7 -62,-3.3 -2,-0.3 2,-0.4 -0.954 18.7-160.8-136.8 127.3 -31.1 64.6 -16.6 576 135 D S E -Q 512 0D 22 -2,-0.4 2,-0.4 -64,-0.2 -64,-0.2 -0.916 16.2-167.0-120.7 142.2 -27.5 63.7 -16.7 577 136 D T E -Q 511 0D 25 -66,-2.4 -66,-2.5 -2,-0.4 2,-0.3 -0.982 25.3-135.9-116.1 119.8 -24.8 63.8 -19.4 578 137 D I E -Q 510 0D 8 -2,-0.4 -184,-1.7 -68,-0.2 2,-0.4 -0.596 9.9-133.3 -87.7 132.1 -21.6 61.8 -18.5 579 138 D I E -N 393 0D 6 -70,-2.5 -70,-0.5 -2,-0.3 -186,-0.2 -0.721 19.7-176.3 -82.6 130.3 -18.2 63.3 -19.1 580 139 D L E - 0 0 9 -188,-2.3 2,-0.3 -2,-0.4 -316,-0.2 0.765 67.6 -6.6 -95.4 -32.5 -15.8 60.9 -20.9 581 140 D N E -N 392 0D 18 -189,-0.8 -189,-1.8 -320,-0.1 2,-0.6 -0.976 54.6-135.7-164.0 143.5 -12.7 63.1 -20.8 582 141 D T E -N 391 0D 49 -2,-0.3 -191,-0.2 -191,-0.2 3,-0.1 -0.930 18.1-178.5-104.8 113.6 -11.5 66.6 -19.9 583 142 D F E S- 0 0 81 -193,-2.5 2,-0.3 -2,-0.6 -1,-0.2 0.869 73.3 -13.9 -82.9 -34.8 -9.3 67.9 -22.6 584 143 D Y E -N 390 0D 24 -194,-0.9 -194,-1.8 3,-0.0 -1,-0.4 -0.963 65.4-161.3-165.0 151.1 -8.6 71.3 -20.8 585 144 D S + 0 0 30 -2,-0.3 -196,-0.2 -196,-0.2 -3,-0.0 -0.950 61.9 1.3-139.3 146.0 -10.3 72.9 -17.9 586 145 D D + 0 0 44 -2,-0.3 2,-1.3 1,-0.2 -197,-0.2 0.763 57.1 167.6 40.8 50.3 -10.3 76.6 -16.6 587 146 D R - 0 0 61 -199,-1.9 2,-0.2 -3,-0.1 -1,-0.2 -0.778 27.7-152.6 -82.9 90.1 -8.1 78.4 -19.1 588 147 D Q - 0 0 51 -2,-1.3 2,-0.5 -130,-0.2 -202,-0.1 -0.525 3.8-149.7 -67.4 127.8 -9.2 81.9 -17.9 589 148 D H - 0 0 37 -2,-0.2 -201,-0.0 -203,-0.1 -1,-0.0 -0.905 7.4-162.1 -99.3 123.2 -8.9 84.4 -20.7 590 149 D I 0 0 11 -2,-0.5 -233,-0.1 -135,-0.0 -135,-0.0 -0.940 360.0 360.0-107.5 111.9 -8.1 88.0 -19.7 591 150 D P 0 0 83 0, 0.0 -233,-0.0 0, 0.0 -1,-0.0 0.182 360.0 360.0 -68.9 360.0 -9.1 90.1 -22.8