==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE/ISOMERASE INHIBITOR 13-NOV-12 4HYP . COMPND 2 MOLECULE: DNA GYRASE SUBUNIT B; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR D.C.BENSEN,C.J.CREIGHTON,L.W.TARI . 776 12 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34090.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 566 72.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 3.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 176 22.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 1.0 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 . 54 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 96 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 175 22.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 2 8 4 0 0 0 0 0 0 4 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 2 4 2 8 6 0 4 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 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 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 15 A G >> 0 0 74 0, 0.0 4,-0.9 0, 0.0 3,-0.5 0.000 360.0 360.0 360.0 169.5 -29.6 -18.5 -12.0 2 16 A L H >> + 0 0 17 76,-0.3 4,-1.7 1,-0.2 3,-0.6 0.861 360.0 62.9 -64.5 -32.4 -29.5 -16.5 -8.8 3 17 A D H 3> S+ 0 0 91 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.839 92.2 63.1 -56.3 -38.0 -32.1 -18.9 -7.5 4 18 A A H <> S+ 0 0 38 -3,-0.5 4,-1.8 1,-0.2 -1,-0.2 0.928 107.7 43.7 -51.8 -41.6 -29.7 -21.8 -7.8 5 19 A V H << S+ 0 0 0 -4,-0.9 -2,-0.2 -3,-0.6 -1,-0.2 0.824 111.4 50.5 -79.9 -30.8 -27.5 -20.0 -5.2 6 20 A R H < S+ 0 0 69 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.913 110.7 52.8 -68.4 -40.5 -30.3 -19.0 -2.8 7 21 A K H < S+ 0 0 129 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.921 128.9 16.9 -54.1 -50.8 -31.4 -22.7 -2.9 8 22 A R S >< S+ 0 0 106 -4,-1.8 3,-0.5 -5,-0.2 4,-0.5 -0.471 75.2 157.4-127.9 65.2 -27.9 -23.9 -2.0 9 23 A P T >> + 0 0 22 0, 0.0 3,-2.7 0, 0.0 4,-2.2 0.901 68.1 59.7 -58.7 -53.7 -26.0 -21.0 -0.5 10 24 A G H 3> S+ 0 0 24 1,-0.3 4,-2.2 2,-0.2 -2,-0.1 0.839 98.5 60.5 -41.3 -46.7 -23.3 -22.8 1.5 11 25 A M H <4 S+ 0 0 20 -3,-0.5 -1,-0.3 1,-0.2 4,-0.1 0.707 115.0 34.6 -57.5 -22.9 -22.0 -24.5 -1.7 12 26 A Y H <4 S+ 0 0 36 -3,-2.7 -2,-0.2 -4,-0.5 -1,-0.2 0.768 133.6 18.2-102.7 -34.7 -21.2 -21.1 -3.1 13 27 A I H < S- 0 0 3 -4,-2.2 2,-0.2 1,-0.4 -3,-0.2 0.598 106.8 -99.1-120.6 -10.2 -20.1 -18.9 -0.2 14 28 A G S < S- 0 0 25 -4,-2.2 2,-0.6 -5,-0.4 -1,-0.4 -0.730 73.0 -15.2 113.5-170.0 -19.2 -21.2 2.6 15 29 A D - 0 0 72 -2,-0.2 6,-2.1 1,-0.1 7,-0.5 -0.590 53.4-162.7 -78.0 114.4 -21.0 -22.4 5.8 16 30 A T S S+ 0 0 30 -2,-0.6 139,-1.8 1,-0.2 140,-0.2 0.446 83.6 50.0 -82.0 -3.2 -24.0 -20.0 6.3 17 31 A D S S+ 0 0 77 137,-0.2 140,-1.4 138,-0.2 139,-0.6 0.848 106.9 46.5 -97.9 -46.4 -24.5 -21.0 9.9 18 32 A D S S- 0 0 83 138,-0.2 -2,-0.1 137,-0.1 140,-0.1 0.316 110.6-103.6 -90.6 6.9 -21.1 -20.7 11.6 19 33 A G S > S+ 0 0 4 -4,-0.5 4,-1.9 138,-0.2 5,-0.2 0.216 95.6 106.2 95.6 -16.0 -20.1 -17.2 10.2 20 34 A T H > S+ 0 0 77 -5,-0.4 4,-1.9 2,-0.2 -4,-0.2 0.941 85.2 40.5 -57.8 -55.9 -17.6 -18.6 7.6 21 35 A G H > S+ 0 0 0 -6,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.890 111.8 56.7 -60.9 -42.8 -19.9 -17.9 4.6 22 36 A L H 4 S+ 0 0 2 -7,-0.5 4,-0.4 1,-0.3 -1,-0.2 0.866 114.1 39.0 -65.3 -34.9 -21.1 -14.5 6.0 23 37 A H H >X S+ 0 0 8 -4,-1.9 4,-1.0 2,-0.2 3,-0.9 0.788 108.6 62.3 -80.1 -28.7 -17.5 -13.3 6.2 24 38 A H H 3X S+ 0 0 40 -4,-1.9 4,-1.1 1,-0.2 3,-0.4 0.900 90.7 69.6 -66.1 -32.0 -16.6 -15.0 2.9 25 39 A M H 3< S+ 0 0 0 -4,-2.2 3,-0.5 1,-0.2 -1,-0.2 0.832 94.7 54.9 -45.8 -42.5 -19.2 -12.6 1.3 26 40 A V H X> S+ 0 0 0 -3,-0.9 4,-2.8 -4,-0.4 3,-1.7 0.922 105.9 51.3 -60.8 -45.1 -16.9 -9.7 2.0 27 41 A F H 3X S+ 0 0 10 -4,-1.0 4,-1.1 -3,-0.4 -1,-0.2 0.631 102.2 59.2 -75.8 -10.7 -14.0 -11.4 0.1 28 42 A E H 3< S+ 0 0 0 -4,-1.1 -1,-0.3 -3,-0.5 73,-0.2 0.302 112.3 41.2 -97.3 8.2 -16.1 -12.1 -3.0 29 43 A V H X> S+ 0 0 9 -3,-1.7 4,-0.9 -4,-0.1 3,-0.8 0.618 117.2 46.0-101.5 -50.6 -16.7 -8.3 -3.3 30 44 A V H 3X S+ 0 0 0 -4,-2.8 4,-3.0 1,-0.2 3,-0.5 0.835 98.1 75.3 -57.8 -33.8 -13.1 -7.3 -2.4 31 45 A D H 3X S+ 0 0 9 -4,-1.1 4,-1.6 1,-0.3 -1,-0.2 0.877 98.8 43.7 -46.2 -50.0 -11.8 -10.0 -4.9 32 46 A N H <> S+ 0 0 63 -3,-0.8 4,-2.1 2,-0.2 -1,-0.3 0.774 110.9 53.9 -68.9 -33.0 -12.8 -7.8 -7.8 33 47 A A H X S+ 0 0 3 -4,-0.9 4,-2.4 -3,-0.5 -2,-0.2 0.958 108.0 49.7 -67.2 -47.6 -11.3 -4.7 -6.3 34 48 A I H X S+ 0 0 0 -4,-3.0 4,-2.7 1,-0.2 -2,-0.2 0.865 112.3 50.2 -56.7 -38.9 -8.0 -6.4 -5.7 35 49 A D H X S+ 0 0 58 -4,-1.6 4,-1.9 -5,-0.3 -1,-0.2 0.868 107.9 50.9 -67.2 -37.5 -8.2 -7.4 -9.4 36 50 A E H <>S+ 0 0 31 -4,-2.1 6,-1.8 2,-0.2 5,-1.6 0.865 113.0 47.5 -64.9 -35.0 -9.0 -3.9 -10.5 37 51 A A H ><5S+ 0 0 11 -4,-2.4 3,-2.0 4,-0.2 -2,-0.2 0.932 110.5 52.0 -67.5 -46.0 -5.9 -2.9 -8.5 38 52 A L H 3<5S+ 0 0 75 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.769 100.7 60.2 -64.1 -31.5 -3.8 -5.6 -10.0 39 53 A A T 3<5S- 0 0 57 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.431 122.8-108.6 -76.2 4.6 -4.8 -4.5 -13.5 40 54 A G T < 5S+ 0 0 42 -3,-2.0 -3,-0.2 2,-0.2 -2,-0.1 0.333 98.3 90.9 92.1 -5.4 -3.1 -1.2 -12.6 41 55 A H < + 0 0 80 -5,-1.6 2,-0.5 1,-0.1 -4,-0.2 0.850 69.0 69.2 -95.3 -39.6 -6.3 1.0 -12.2 42 56 A C + 0 0 4 -6,-1.8 -2,-0.2 -9,-0.2 19,-0.2 -0.722 47.7 172.2 -88.1 125.3 -7.3 0.7 -8.6 43 57 A K + 0 0 132 -2,-0.5 137,-1.4 1,-0.2 2,-0.3 0.807 65.4 22.6 -93.3 -41.4 -4.9 2.3 -6.1 44 58 A E E -a 180 0A 50 135,-0.1 16,-0.8 2,-0.0 2,-0.4 -0.950 54.1-160.5-134.8 151.0 -7.0 2.0 -2.9 45 59 A I E -aB 181 59A 1 135,-2.5 137,-3.3 -2,-0.3 2,-0.6 -0.985 6.5-163.9-131.2 119.5 -9.8 -0.1 -1.4 46 60 A I E -aB 182 58A 42 12,-2.4 12,-2.0 -2,-0.4 2,-0.5 -0.910 5.7-168.3-102.2 108.1 -11.8 1.0 1.6 47 61 A V E -aB 183 57A 0 135,-3.6 137,-2.1 -2,-0.6 2,-0.4 -0.867 13.2-170.4 -94.9 131.9 -13.8 -1.9 3.3 48 62 A T E -aB 184 56A 13 8,-3.3 8,-2.1 -2,-0.5 2,-0.6 -0.984 21.8-151.1-130.5 134.4 -16.4 -0.5 5.8 49 63 A I E -aB 185 55A 0 135,-2.3 137,-2.5 -2,-0.4 138,-0.5 -0.910 26.8-147.8-100.4 116.6 -18.6 -2.2 8.4 50 64 A H > - 0 0 17 4,-2.7 3,-2.5 -2,-0.6 4,-0.2 -0.529 24.2-111.4 -91.8 151.9 -21.7 -0.2 8.9 51 65 A A T 3 S+ 0 0 82 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.751 119.8 57.1 -49.6 -25.4 -23.8 0.3 12.1 52 66 A D T 3 S- 0 0 83 2,-0.0 -1,-0.3 1,-0.0 3,-0.1 0.084 122.1-106.0 -93.3 21.9 -26.5 -1.8 10.4 53 67 A N S < S+ 0 0 28 -3,-2.5 2,-0.2 1,-0.2 -2,-0.1 0.710 79.0 131.2 52.9 26.7 -24.2 -4.7 9.8 54 68 A S - 0 0 0 -4,-0.2 -4,-2.7 94,-0.2 2,-0.4 -0.610 48.4-142.3 -86.0 162.4 -23.9 -4.1 6.1 55 69 A V E -BC 49 147A 0 92,-1.8 92,-2.0 -6,-0.2 2,-0.3 -0.995 12.9-165.9-126.3 123.6 -20.3 -4.0 4.5 56 70 A S E -BC 48 146A 13 -8,-2.1 -8,-3.3 -2,-0.4 2,-0.4 -0.841 3.6-163.9-104.3 149.3 -19.3 -1.6 1.8 57 71 A V E -BC 47 145A 6 88,-1.9 88,-2.3 -2,-0.3 2,-0.4 -0.990 7.9-171.3-129.8 122.9 -16.2 -1.9 -0.4 58 72 A Q E -BC 46 144A 62 -12,-2.0 -12,-2.4 -2,-0.4 2,-0.2 -0.968 4.8-179.2-117.3 126.5 -15.1 1.2 -2.4 59 73 A D E -B 45 0A 16 84,-2.9 -14,-0.2 -2,-0.4 84,-0.1 -0.720 26.9-138.9-114.2 174.7 -12.3 1.1 -5.0 60 74 A D + 0 0 60 -16,-0.8 -17,-0.2 -2,-0.2 82,-0.2 -0.119 62.0 112.8-125.7 39.6 -10.8 3.7 -7.2 61 75 A G S S- 0 0 3 -19,-0.2 -24,-0.1 82,-0.1 -28,-0.0 0.388 88.1 -61.6 -81.5-141.4 -10.4 1.9 -10.4 62 76 A R S S- 0 0 109 79,-0.1 80,-0.2 52,-0.1 53,-0.2 0.678 74.3-115.3 -83.4 -22.9 -12.2 2.4 -13.8 63 77 A G - 0 0 4 78,-0.2 80,-0.1 51,-0.1 3,-0.1 0.552 39.0 -75.0 85.0 119.0 -15.6 1.7 -12.5 64 78 A I - 0 0 35 1,-0.1 9,-0.1 2,-0.1 78,-0.1 -0.078 67.7 -85.8 -37.5 136.0 -17.6 -1.3 -13.8 65 79 A P - 0 0 39 0, 0.0 8,-1.5 0, 0.0 -1,-0.1 -0.215 37.5-168.0 -55.4 143.1 -18.9 -0.7 -17.3 66 80 A T + 0 0 28 6,-0.2 8,-0.1 -3,-0.1 -2,-0.1 0.574 50.6 105.8-110.7 -15.1 -22.2 1.1 -17.5 67 81 A G 0 0 44 4,-0.2 5,-2.9 1,-0.1 6,-0.2 -0.026 360.0 360.0 -67.5 168.0 -23.1 0.6 -21.1 68 82 A I 0 0 169 3,-0.3 3,-0.2 4,-0.1 -1,-0.1 -0.411 360.0 360.0-131.3 360.0 -25.7 -1.7 -22.5 69 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 70 88 A V 0 0 101 0, 0.0 5,-0.0 0, 0.0 -3,-0.0 0.000 360.0 360.0 360.0 143.5 -29.6 -4.1 -19.7 71 89 A S > - 0 0 13 -3,-0.2 4,-2.3 1,-0.1 -3,-0.3 -0.141 360.0-115.9 -62.1 156.2 -26.3 -2.5 -18.5 72 90 A A H > S+ 0 0 23 -5,-2.9 4,-2.3 1,-0.2 -6,-0.2 0.937 115.6 54.8 -53.6 -53.3 -22.9 -4.2 -18.2 73 91 A A H > S+ 0 0 0 -8,-1.5 4,-2.5 1,-0.2 -1,-0.2 0.875 107.9 48.4 -45.1 -51.0 -22.9 -3.7 -14.4 74 92 A E H > S+ 0 0 22 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.940 107.2 55.2 -63.2 -47.0 -26.3 -5.3 -14.0 75 93 A V H >X S+ 0 0 59 -4,-2.3 4,-2.4 1,-0.2 3,-0.5 0.942 110.5 47.1 -45.1 -58.2 -25.2 -8.3 -16.1 76 94 A I H 3< S+ 0 0 16 -4,-2.3 23,-0.3 1,-0.3 7,-0.3 0.886 116.3 44.2 -50.8 -51.8 -22.2 -8.8 -13.7 77 95 A M H 3< S+ 0 0 1 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.762 123.3 34.5 -62.1 -32.2 -24.5 -8.4 -10.6 78 96 A T H << S+ 0 0 36 -4,-2.7 2,-0.5 -3,-0.5 -76,-0.3 0.526 104.0 70.5-113.9 -7.0 -27.3 -10.7 -11.9 79 97 A V >< - 0 0 43 -4,-2.4 3,-1.0 -5,-0.3 4,-0.4 -0.966 64.3-147.6-115.9 126.5 -25.6 -13.4 -14.0 80 98 A L T 3 S+ 0 0 40 -2,-0.5 3,-0.4 1,-0.2 17,-0.3 0.868 100.3 39.5 -49.8 -46.2 -23.6 -16.2 -12.3 81 99 A H T > S+ 0 0 144 1,-0.2 3,-1.5 2,-0.1 -1,-0.2 0.547 88.1 97.9 -85.5 -4.3 -21.2 -16.6 -15.3 82 100 A A G X + 0 0 5 -3,-1.0 3,-1.8 -7,-0.3 -1,-0.2 0.808 67.7 69.8 -58.2 -40.0 -20.8 -12.9 -16.1 83 101 A G G > S+ 0 0 25 -4,-0.4 3,-1.2 -3,-0.4 -1,-0.3 0.688 82.4 72.7 -52.6 -28.1 -17.6 -12.2 -14.2 84 102 A G G < S+ 0 0 40 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.1 0.541 84.7 68.2 -67.8 -7.9 -15.5 -14.3 -16.7 85 103 A K G < 0 0 168 -3,-1.8 -1,-0.3 -4,-0.2 -2,-0.1 0.095 360.0 360.0-100.6 22.5 -15.8 -11.6 -19.3 86 104 A F < 0 0 157 -3,-1.2 -3,-0.0 0, 0.0 0, 0.0 -0.864 360.0 360.0-145.9 360.0 -13.6 -9.1 -17.4 87 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 88 114 A K 0 0 98 0, 0.0 193,-0.1 0, 0.0 192,-0.0 0.000 360.0 360.0 360.0 78.2 -3.6 -15.5 -11.7 89 115 A V - 0 0 54 1,-0.1 2,-0.3 204,-0.1 -54,-0.0 0.502 360.0 -54.4-138.9 -75.0 -3.6 -13.9 -8.3 90 116 A S + 0 0 15 -59,-0.1 2,-0.9 202,-0.1 -1,-0.1 -0.911 60.2 76.1-173.2-178.9 -6.1 -13.4 -5.3 91 117 A G S S+ 0 0 5 -2,-0.3 2,-0.1 200,-0.1 -60,-0.1 -0.696 85.1 24.2 89.3 -83.4 -9.1 -12.6 -3.0 92 118 A G S S- 0 0 2 -2,-0.9 199,-2.0 1,-0.1 2,-0.3 -0.264 87.7 -64.8-115.3-168.5 -11.9 -15.1 -3.6 93 119 A L B > -I 290 0B 24 197,-0.2 3,-2.2 -81,-0.1 197,-0.2 -0.632 62.1 -96.3 -86.7 134.9 -12.9 -18.6 -4.7 94 120 A H T 3 S+ 0 0 54 195,-2.1 194,-0.1 -2,-0.3 -1,-0.1 -0.308 106.9 12.6 -57.2 124.4 -12.4 -19.4 -8.4 95 121 A G T 3 S+ 0 0 21 1,-0.2 2,-0.6 192,-0.1 -1,-0.3 0.423 96.0 115.1 89.7 2.0 -15.5 -18.9 -10.4 96 122 A V < + 0 0 11 -3,-2.2 -1,-0.2 -13,-0.1 2,-0.1 -0.928 40.9 178.5-104.7 116.0 -17.5 -17.0 -7.8 97 123 A G >> - 0 0 5 -2,-0.6 3,-1.2 -17,-0.3 4,-0.7 -0.365 49.7 -82.5-100.1-174.6 -18.3 -13.4 -8.7 98 124 A V H 3> S+ 0 0 5 1,-0.2 4,-2.5 2,-0.2 5,-0.1 0.605 116.5 78.9 -64.2 -15.9 -20.3 -10.6 -7.0 99 125 A S H 3> S+ 0 0 2 -23,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.859 90.1 52.3 -63.9 -34.4 -23.5 -12.1 -8.3 100 126 A V H <> S+ 0 0 3 -3,-1.2 4,-1.2 2,-0.2 -1,-0.2 0.878 110.5 49.5 -64.2 -38.9 -23.4 -14.8 -5.6 101 127 A V H < S+ 0 0 0 -4,-0.7 3,-0.3 -73,-0.2 -2,-0.2 0.928 111.4 48.2 -66.4 -40.6 -23.1 -12.0 -3.1 102 128 A N H >< S+ 0 0 0 -4,-2.5 3,-1.4 1,-0.2 24,-0.4 0.917 109.5 51.3 -66.4 -42.2 -26.0 -10.1 -4.7 103 129 A A H 3< S+ 0 0 1 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.729 113.4 46.6 -65.3 -24.7 -28.3 -13.2 -4.7 104 130 A L T 3< S+ 0 0 0 -4,-1.2 46,-2.3 -3,-0.3 2,-0.4 0.254 98.1 88.4-101.9 7.6 -27.5 -13.8 -1.0 105 131 A S E < -D 149 0A 0 -3,-1.4 20,-0.8 44,-0.2 21,-0.3 -0.901 64.6-151.2-109.8 137.0 -28.0 -10.1 0.0 106 132 A Q E S+ 0 0 80 42,-2.0 2,-0.3 -2,-0.4 19,-0.3 0.816 93.2 14.3 -75.3 -28.2 -31.4 -8.7 1.0 107 133 A K E +D 148 0A 71 41,-1.2 41,-2.9 17,-0.2 2,-0.3 -0.991 66.0 178.8-139.1 142.5 -30.1 -5.5 -0.3 108 134 A L E -DE 147 123A 0 15,-1.7 15,-2.4 -2,-0.3 2,-0.5 -0.948 10.3-162.6-137.9 128.2 -27.2 -4.6 -2.4 109 135 A E E -DE 146 122A 24 37,-3.2 37,-2.8 -2,-0.3 2,-0.5 -0.938 5.1-164.4-111.9 129.9 -26.4 -1.0 -3.5 110 136 A L E +DE 145 121A 0 11,-3.1 11,-1.6 -2,-0.5 2,-0.4 -0.956 8.6 179.3-117.8 125.2 -24.1 -0.4 -6.4 111 137 A V E -DE 144 120A 10 33,-2.2 33,-1.7 -2,-0.5 2,-0.5 -0.975 6.3-171.7-129.3 116.1 -22.6 3.0 -7.1 112 138 A I E -DE 143 119A 0 7,-1.8 7,-1.8 -2,-0.4 2,-0.7 -0.927 11.2-160.5-109.2 128.1 -20.2 3.5 -10.1 113 139 A Q E +DE 142 118A 30 29,-3.7 29,-2.6 -2,-0.5 2,-0.4 -0.922 35.1 144.1-107.6 112.0 -18.1 6.6 -10.7 114 140 A R E > - 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