==== 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 BIOSYNTHETIC PROTEIN 28-JUN-02 1IXP . COMPND 2 MOLECULE: PYRIDOXINE 5'-PHOSPHATE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR M.GARRIDO-FRANCO,B.LABER,R.HUBER,T.CLAUSEN . 968 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 40989.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 716 74.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 148 15.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 0.8 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 . 4 0.4 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 . 69 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 96 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 368 38.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 19 2.0 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 5 1 0 4 7 13 0 0 4 0 3 1 0 0 2 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 8 20 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 . 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 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 2 A A 0 0 144 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 90.7 19.7 -27.3 -12.8 2 3 A E - 0 0 109 1,-0.1 2,-0.5 208,-0.0 236,-0.0 -0.242 360.0-106.3 -58.4 142.8 20.1 -24.3 -10.5 3 4 A L - 0 0 2 231,-0.1 207,-0.2 234,-0.1 2,-0.1 -0.642 44.8-138.6 -71.4 123.7 17.0 -23.5 -8.3 4 5 A L E -a 210 0A 31 205,-2.6 207,-2.3 -2,-0.5 2,-0.4 -0.494 11.5-149.7 -89.2 159.5 15.5 -20.4 -10.0 5 6 A L E -a 211 0A 0 32,-0.2 34,-3.6 205,-0.2 35,-1.0 -0.992 5.5-166.1-132.0 125.2 14.1 -17.3 -8.3 6 7 A G E -ab 212 40A 0 205,-3.0 207,-2.0 -2,-0.4 2,-0.6 -0.937 15.6-145.4-108.7 129.8 11.4 -15.1 -9.7 7 8 A V E -ab 213 41A 0 33,-2.6 35,-2.4 -2,-0.5 2,-0.8 -0.857 5.6-147.3-100.5 119.4 11.0 -11.7 -7.9 8 9 A N E - b 0 42A 17 205,-2.8 3,-0.4 -2,-0.6 210,-0.2 -0.752 13.4-174.5 -84.4 111.8 7.5 -10.4 -7.7 9 10 A I >> + 0 0 0 33,-1.6 3,-2.4 -2,-0.8 4,-1.0 0.319 46.5 117.8 -91.0 10.1 7.6 -6.6 -7.9 10 11 A D H >> S+ 0 0 8 32,-0.5 4,-1.3 1,-0.3 3,-0.9 0.857 71.6 54.2 -39.9 -52.0 3.9 -6.1 -7.2 11 12 A H H 3> S+ 0 0 57 -3,-0.4 4,-2.0 1,-0.3 -1,-0.3 0.590 92.9 68.4 -68.7 -8.9 4.4 -4.1 -4.0 12 13 A I H <> S+ 0 0 20 -3,-2.4 4,-1.5 2,-0.2 -1,-0.3 0.926 106.4 44.0 -70.1 -40.7 6.7 -1.6 -5.6 13 14 A A H X>S+ 0 0 15 -4,-1.5 3,-1.5 1,-0.2 5,-0.9 0.952 108.0 53.5 -70.9 -48.4 3.6 3.9 -6.0 17 18 A N H 3<5S+ 0 0 58 -4,-3.6 -1,-0.2 1,-0.3 -2,-0.2 0.665 89.4 78.2 -62.2 -19.4 -0.2 3.8 -6.1 18 19 A A T 3<5S+ 0 0 84 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.1 0.838 114.2 18.7 -60.6 -30.8 -0.6 5.1 -2.5 19 20 A R T <45S- 0 0 212 -3,-1.5 -1,-0.2 -4,-0.4 -2,-0.2 0.407 99.8-124.8-119.6 -1.4 0.2 8.6 -3.8 20 21 A G T <5 + 0 0 66 -4,-0.9 -3,-0.2 1,-0.2 2,-0.1 0.798 65.5 130.9 63.6 27.3 -0.5 8.3 -7.6 21 22 A T S > - 0 0 8 1,-0.1 3,-1.6 -2,-0.1 4,-1.4 -0.814 15.2-147.4 -98.9 122.0 8.5 2.7 -10.9 26 27 A P H 3> S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.831 97.9 68.5 -52.6 -29.3 8.2 -1.1 -11.2 27 28 A V H 3> S+ 0 0 0 1,-0.2 4,-1.1 2,-0.2 522,-0.0 0.862 100.5 45.2 -59.8 -37.2 10.3 -0.8 -14.3 28 29 A Q H <> S+ 0 0 35 -3,-1.6 4,-2.1 2,-0.2 3,-0.4 0.937 110.3 52.7 -71.0 -50.0 13.4 0.3 -12.4 29 30 A A H X S+ 0 0 7 -4,-1.4 4,-2.8 1,-0.2 5,-0.3 0.893 103.5 58.7 -53.6 -43.6 13.0 -2.4 -9.7 30 31 A A H X S+ 0 0 1 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.910 106.2 48.8 -54.1 -43.8 12.8 -5.1 -12.5 31 32 A F H X S+ 0 0 8 -4,-1.1 4,-1.4 -3,-0.4 -2,-0.2 0.958 111.7 48.9 -61.9 -48.6 16.2 -4.0 -13.8 32 33 A I H < S+ 0 0 48 -4,-2.1 3,-0.3 1,-0.2 -2,-0.2 0.936 114.1 44.7 -56.0 -50.8 17.8 -4.1 -10.3 33 34 A A H ><>S+ 0 0 0 -4,-2.8 5,-2.5 1,-0.2 3,-1.6 0.884 107.9 56.1 -64.4 -40.8 16.4 -7.5 -9.4 34 35 A E H 3<5S+ 0 0 20 -4,-2.2 3,-0.4 1,-0.3 -1,-0.2 0.820 113.3 43.4 -62.4 -29.2 17.3 -9.2 -12.8 35 36 A Q T 3<5S+ 0 0 124 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.351 111.9 56.3 -96.3 4.4 20.9 -8.1 -12.2 36 37 A A T < 5S- 0 0 14 -3,-1.6 198,-0.3 -4,-0.1 -1,-0.2 0.141 133.1 -62.8-123.5 20.4 20.8 -9.2 -8.6 37 38 A G T 5S+ 0 0 22 -3,-0.4 2,-0.4 1,-0.4 -32,-0.2 0.369 90.1 129.2 119.0 -5.6 19.8 -12.8 -8.7 38 39 A A < - 0 0 3 -5,-2.5 -1,-0.4 -6,-0.1 -32,-0.2 -0.683 34.6-171.3 -85.1 132.3 16.3 -12.9 -10.2 39 40 A D S S+ 0 0 39 -34,-3.6 2,-0.3 -2,-0.4 -33,-0.2 0.486 75.8 6.8 -98.8 -6.3 15.8 -15.2 -13.1 40 41 A G E -b 6 0A 0 -35,-1.0 -33,-2.6 26,-0.1 2,-0.4 -0.969 69.1-124.9-167.5 158.8 12.4 -13.8 -13.8 41 42 A I E -bc 7 68A 0 26,-2.0 28,-1.9 -2,-0.3 2,-0.4 -0.916 21.7-155.2-114.0 136.2 10.1 -11.0 -12.7 42 43 A T E +bc 8 69A 0 -35,-2.4 -33,-1.6 -2,-0.4 -32,-0.5 -0.943 13.3 177.3-115.3 134.9 6.6 -11.7 -11.6 43 44 A V E - c 0 70A 0 26,-2.1 28,-2.9 -2,-0.4 2,-0.7 -1.000 19.6-147.1-136.1 135.4 3.7 -9.3 -11.7 44 45 A H E - c 0 71A 26 -2,-0.4 2,-1.1 26,-0.2 8,-0.4 -0.916 7.6-157.6-105.1 115.3 0.1 -9.9 -10.7 45 46 A L - 0 0 0 26,-2.0 28,-0.4 -2,-0.7 8,-0.1 -0.799 19.3-163.3 -92.7 94.7 -2.3 -7.9 -12.9 46 47 A R > - 0 0 69 -2,-1.1 3,-0.8 6,-0.4 49,-0.0 -0.363 27.2-119.2 -76.1 160.6 -5.3 -7.7 -10.6 47 48 A E T 3 S+ 0 0 136 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.863 116.7 45.6 -69.1 -34.4 -8.7 -6.9 -12.0 48 49 A D T 3 S- 0 0 94 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.373 106.5-129.7 -88.2 3.6 -9.0 -3.8 -9.7 49 50 A R < + 0 0 49 -3,-0.8 -2,-0.1 1,-0.1 -4,-0.1 0.857 41.0 170.3 47.5 45.8 -5.4 -2.8 -10.6 50 51 A R S S- 0 0 89 3,-0.0 -1,-0.1 -33,-0.0 3,-0.1 0.871 74.6 -22.6 -48.9 -45.7 -4.5 -2.4 -6.9 51 52 A H S S+ 0 0 8 1,-0.4 -40,-0.1 -7,-0.2 -6,-0.1 0.414 123.2 60.3-131.4 -89.5 -0.8 -2.0 -7.9 52 53 A I S S- 0 0 0 -8,-0.4 -1,-0.4 4,-0.1 -6,-0.4 -0.283 71.9-162.1 -51.3 133.6 0.7 -3.4 -11.2 53 54 A T > - 0 0 37 -3,-0.1 4,-2.1 -8,-0.1 5,-0.2 -0.608 35.1 -99.6-114.6 175.7 -1.2 -1.6 -14.0 54 55 A D H > S+ 0 0 78 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.888 125.4 55.3 -64.3 -36.1 -1.7 -2.3 -17.7 55 56 A R H > S+ 0 0 52 2,-0.2 4,-2.8 1,-0.2 5,-0.4 0.971 106.2 51.3 -56.0 -55.9 1.0 0.3 -18.4 56 57 A D H > S+ 0 0 0 1,-0.2 4,-3.2 2,-0.2 5,-0.3 0.925 112.5 44.4 -44.3 -58.8 3.4 -1.6 -16.1 57 58 A V H X S+ 0 0 5 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.893 113.4 52.6 -55.5 -45.6 2.7 -4.9 -17.9 58 59 A R H < S+ 0 0 118 -4,-2.7 4,-0.2 -5,-0.2 -1,-0.2 0.897 118.1 33.0 -60.2 -47.7 3.0 -3.2 -21.3 59 60 A I H >X S+ 0 0 0 -4,-2.8 3,-1.8 2,-0.2 4,-1.4 0.894 115.2 56.7 -78.4 -42.2 6.4 -1.5 -20.7 60 61 A L H >X S+ 0 0 0 -4,-3.2 4,-3.1 -5,-0.4 3,-0.5 0.901 101.0 60.2 -52.8 -42.2 7.9 -4.3 -18.5 61 62 A R H 3< S+ 0 0 105 -4,-2.0 -1,-0.3 -5,-0.3 -2,-0.2 0.740 112.0 39.9 -59.7 -21.3 7.2 -6.7 -21.4 62 63 A Q H <4 S+ 0 0 68 -3,-1.8 -1,-0.3 -4,-0.2 -2,-0.2 0.616 121.1 40.7-102.9 -16.4 9.5 -4.5 -23.4 63 64 A T H << S+ 0 0 6 -4,-1.4 -2,-0.2 -3,-0.5 -3,-0.2 0.707 81.6 106.3-105.7 -26.1 12.2 -3.9 -20.7 64 65 A L < - 0 0 26 -4,-3.1 4,-0.1 -5,-0.2 -33,-0.1 -0.310 48.7-164.1 -56.1 136.0 12.6 -7.2 -18.9 65 66 A D S S+ 0 0 85 -35,-0.1 -1,-0.2 2,-0.1 443,-0.1 0.623 83.2 32.3 -95.6 -19.5 15.9 -8.8 -19.9 66 67 A T S S- 0 0 52 1,-0.1 2,-0.3 0, 0.0 -26,-0.1 0.677 112.7 -65.9 -99.8 -99.6 14.9 -12.2 -18.5 67 68 A R - 0 0 45 -28,-0.1 -26,-2.0 2,-0.0 2,-0.3 -0.982 34.4-113.0-162.8 151.8 11.2 -13.1 -18.7 68 69 A M E -c 41 0A 6 -2,-0.3 21,-2.4 -28,-0.2 2,-0.5 -0.631 12.2-165.2 -91.0 141.0 7.7 -12.3 -17.4 69 70 A N E -cd 42 89A 6 -28,-1.9 -26,-2.1 -2,-0.3 2,-0.8 -0.964 16.7-155.8-121.5 106.0 5.5 -14.4 -15.2 70 71 A L E -cd 43 90A 0 19,-2.2 21,-2.9 -2,-0.5 2,-0.4 -0.762 1.8-159.0 -88.5 107.8 2.0 -13.0 -15.3 71 72 A E E +cd 44 91A 22 -28,-2.9 -26,-2.0 -2,-0.8 2,-0.3 -0.744 33.0 145.4 -84.3 134.4 -0.1 -13.8 -12.3 72 73 A M E - d 0 92A 0 19,-2.2 21,-1.9 -2,-0.4 -26,-0.1 -0.981 47.7-103.1-166.0 156.7 -3.7 -13.5 -13.2 73 74 A A - 0 0 7 -28,-0.4 2,-1.4 -2,-0.3 5,-0.1 -0.408 43.2-103.3 -81.9 159.9 -7.2 -14.9 -12.6 74 75 A V S S+ 0 0 8 19,-0.5 2,-0.3 -2,-0.1 -1,-0.1 -0.716 73.1 127.7 -89.1 92.6 -8.9 -17.1 -15.1 75 76 A T S > S- 0 0 60 -2,-1.4 4,-2.7 1,-0.1 5,-0.3 -0.954 72.5-107.2-141.3 156.8 -11.4 -14.7 -16.6 76 77 A E H > S+ 0 0 117 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.944 117.8 51.1 -51.9 -52.7 -12.1 -13.6 -20.2 77 78 A E H > S+ 0 0 77 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.936 114.4 40.9 -48.7 -59.3 -10.4 -10.2 -19.7 78 79 A M H > S+ 0 0 3 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.838 113.7 53.4 -62.4 -35.5 -7.1 -11.6 -18.3 79 80 A L H X S+ 0 0 15 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.932 111.7 46.4 -65.6 -43.0 -7.1 -14.5 -20.7 80 81 A A H X S+ 0 0 42 -4,-2.8 4,-1.9 -5,-0.3 -2,-0.2 0.943 112.8 49.7 -62.3 -48.6 -7.4 -12.1 -23.6 81 82 A I H X S+ 0 0 36 -4,-2.8 4,-2.7 -5,-0.2 -2,-0.2 0.913 111.1 48.1 -57.2 -48.0 -4.7 -9.8 -22.1 82 83 A A H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.877 109.8 52.1 -63.0 -39.1 -2.2 -12.6 -21.6 83 84 A V H < S+ 0 0 39 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.874 113.5 45.6 -64.9 -34.7 -2.7 -13.9 -25.1 84 85 A E H < S+ 0 0 158 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.900 116.5 45.2 -71.2 -43.9 -2.1 -10.4 -26.4 85 86 A T H < S- 0 0 27 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.755 87.9-152.4 -74.3 -29.8 1.0 -10.0 -24.1 86 87 A K < - 0 0 100 -4,-2.6 -3,-0.1 -5,-0.2 -4,-0.1 0.916 19.3-170.8 56.6 47.1 2.6 -13.4 -24.7 87 88 A P - 0 0 2 0, 0.0 41,-0.2 0, 0.0 -18,-0.1 -0.259 31.0-122.7 -63.6 160.6 4.4 -13.6 -21.3 88 89 A H S S+ 0 0 88 -20,-0.5 40,-1.9 39,-0.1 2,-0.3 0.905 95.3 21.1 -71.9 -36.7 6.8 -16.4 -21.0 89 90 A F E -de 69 128A 18 -21,-2.4 -19,-2.2 38,-0.2 2,-0.4 -0.892 64.8-164.3-129.1 158.3 4.9 -17.7 -18.0 90 91 A C E -de 70 129A 0 38,-1.8 40,-2.4 -2,-0.3 2,-0.6 -0.991 5.4-159.2-143.1 131.4 1.4 -17.3 -16.7 91 92 A C E -de 71 130A 0 -21,-2.9 -19,-2.2 -2,-0.4 2,-0.3 -0.903 11.1-149.2-119.8 106.0 0.3 -18.2 -13.2 92 93 A L E +de 72 131A 0 38,-2.2 40,-2.2 -2,-0.6 -19,-0.2 -0.538 24.7 175.7 -74.6 128.0 -3.4 -18.7 -12.8 93 94 A V - 0 0 11 -21,-1.9 -19,-0.5 -2,-0.3 2,-0.1 -0.893 32.8-105.0-132.2 159.6 -4.7 -17.8 -9.3 94 95 A P + 0 0 20 0, 0.0 12,-0.1 0, 0.0 3,-0.1 -0.494 32.1 170.0 -78.5 156.4 -8.0 -17.5 -7.5 95 96 A E + 0 0 73 1,-0.2 2,-0.3 -2,-0.1 -22,-0.0 0.273 64.0 45.8-145.3 3.0 -9.4 -14.1 -7.0 96 97 A K S > S- 0 0 56 1,-0.0 4,-0.8 0, 0.0 3,-0.2 -0.875 89.2-102.2-140.4 170.0 -12.9 -15.0 -5.7 97 98 A R T 4 S+ 0 0 86 -2,-0.3 7,-0.1 1,-0.2 -1,-0.0 0.686 115.3 53.9 -69.5 -21.8 -14.4 -17.5 -3.2 98 99 A Q T 4 S+ 0 0 160 1,-0.2 -1,-0.2 9,-0.0 0, 0.0 0.800 112.1 41.7 -83.4 -32.2 -15.6 -20.0 -5.9 99 100 A E T 4 S+ 0 0 10 -3,-0.2 8,-3.5 7,-0.1 2,-0.2 0.546 106.8 81.2 -88.8 -13.9 -12.2 -20.5 -7.6 100 101 A V B < -I 106 0B 41 -4,-0.8 6,-0.2 6,-0.2 2,-0.1 -0.629 69.8-143.8 -94.8 154.6 -10.5 -20.5 -4.2 101 102 A T - 0 0 34 4,-1.0 3,-0.4 -2,-0.2 -1,-0.1 -0.287 42.7 -83.7-101.0-171.1 -10.2 -23.5 -1.9 102 103 A T S S+ 0 0 117 1,-0.2 -2,-0.0 -2,-0.1 -1,-0.0 0.593 133.5 41.9 -72.9 -9.7 -10.3 -23.6 1.9 103 104 A E S S- 0 0 66 2,-0.1 -1,-0.2 53,-0.0 54,-0.1 0.473 122.5 -99.0-114.6 -7.0 -6.6 -22.8 1.8 104 105 A G S S+ 0 0 26 -3,-0.4 2,-0.2 1,-0.3 -2,-0.1 0.649 77.3 132.2 98.3 16.5 -6.5 -20.1 -0.9 105 106 A G - 0 0 0 -12,-0.1 -4,-1.0 1,-0.1 2,-0.4 -0.529 68.2 -87.1 -96.5 168.3 -5.4 -22.3 -3.8 106 107 A L B -I 100 0B 0 26,-2.5 2,-1.4 -14,-0.2 28,-0.3 -0.608 38.8-128.8 -74.2 128.4 -7.0 -22.4 -7.3 107 108 A D + 0 0 40 -8,-3.5 4,-0.1 -2,-0.4 -1,-0.1 -0.660 48.1 152.5 -81.3 94.8 -9.8 -24.9 -7.3 108 109 A V > + 0 0 0 -2,-1.4 3,-1.9 2,-0.2 7,-0.2 0.901 62.4 60.7 -89.5 -46.6 -8.8 -27.0 -10.3 109 110 A A T 3 S+ 0 0 16 1,-0.3 -1,-0.1 -3,-0.3 3,-0.1 0.537 110.8 43.2 -59.7 -9.8 -10.4 -30.4 -9.5 110 111 A G T 3 S+ 0 0 56 1,-0.1 -1,-0.3 -11,-0.1 -2,-0.2 0.419 118.0 42.6-114.7 -2.8 -13.8 -28.7 -9.5 111 112 A Q <> + 0 0 35 -3,-1.9 4,-2.6 -4,-0.1 5,-0.3 -0.103 66.6 146.5-134.4 36.6 -13.4 -26.6 -12.6 112 113 A R H > S+ 0 0 72 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.787 72.3 48.5 -45.9 -42.5 -11.7 -29.0 -15.0 113 114 A D H > S+ 0 0 120 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.968 112.6 46.7 -66.9 -50.7 -13.4 -27.7 -18.1 114 115 A K H > S+ 0 0 82 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.915 117.8 44.1 -55.7 -45.4 -12.7 -24.0 -17.4 115 116 A M H X S+ 0 0 0 -4,-2.6 4,-2.5 -7,-0.2 -1,-0.2 0.863 111.6 53.4 -69.7 -34.9 -9.0 -24.8 -16.5 116 117 A R H X S+ 0 0 99 -4,-2.3 4,-2.1 -5,-0.3 5,-0.2 0.936 111.4 45.5 -64.6 -45.3 -8.7 -27.2 -19.5 117 118 A D H X S+ 0 0 109 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.927 113.1 50.6 -62.0 -47.8 -9.8 -24.4 -21.9 118 119 A A H X S+ 0 0 1 -4,-2.2 4,-2.8 -5,-0.2 5,-0.3 0.913 110.3 49.9 -58.3 -45.9 -7.6 -21.8 -20.3 119 120 A C H X S+ 0 0 5 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.924 112.6 43.1 -63.2 -46.7 -4.5 -24.0 -20.5 120 121 A K H X S+ 0 0 132 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.906 115.3 52.2 -65.5 -38.9 -4.8 -25.0 -24.1 121 122 A R H X S+ 0 0 90 -4,-2.3 4,-1.4 -5,-0.2 -2,-0.2 0.939 112.9 42.2 -62.0 -50.7 -5.6 -21.4 -25.0 122 123 A L H <>S+ 0 0 0 -4,-2.8 5,-2.7 1,-0.2 -1,-0.2 0.874 114.7 53.0 -66.1 -34.6 -2.6 -20.0 -23.1 123 124 A A H ><5S+ 0 0 56 -4,-2.4 3,-1.7 -5,-0.3 -2,-0.2 0.871 104.5 53.8 -68.9 -36.5 -0.5 -22.7 -24.5 124 125 A D H 3<5S+ 0 0 111 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.848 103.7 57.8 -66.6 -28.4 -1.6 -21.9 -28.1 125 126 A A T 3<5S- 0 0 11 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.530 125.9-108.0 -76.1 -3.5 -0.5 -18.4 -27.3 126 127 A G T < 5S+ 0 0 60 -3,-1.7 2,-0.4 1,-0.3 -3,-0.2 0.603 74.3 141.7 87.1 14.6 2.9 -19.9 -26.6 127 128 A I < - 0 0 6 -5,-2.7 2,-0.7 -6,-0.2 -1,-0.3 -0.728 51.3-134.5 -94.7 134.6 2.6 -19.4 -22.9 128 129 A Q E -e 89 0A 64 -40,-1.9 -38,-1.8 -2,-0.4 2,-0.3 -0.800 30.6-143.6 -88.1 114.5 3.8 -21.9 -20.3 129 130 A V E -e 90 0A 1 -2,-0.7 21,-2.0 -40,-0.2 2,-0.4 -0.596 18.8-171.8 -88.6 138.7 1.0 -22.2 -17.7 130 131 A S E -ef 91 150A 3 -40,-2.4 -38,-2.2 -2,-0.3 2,-0.6 -0.995 13.8-148.9-126.5 125.9 1.3 -22.7 -14.0 131 132 A L E -ef 92 151A 0 19,-1.6 21,-1.9 -2,-0.4 2,-0.7 -0.885 15.8-138.3 -97.8 118.9 -1.8 -23.5 -11.9 132 133 A F E + f 0 152A 12 -40,-2.2 -26,-2.5 -2,-0.6 2,-0.3 -0.704 42.6 155.9 -78.9 112.3 -1.4 -22.0 -8.4 133 134 A I E - f 0 153A 0 19,-2.1 21,-2.2 -2,-0.7 -26,-0.1 -0.883 43.6 -94.3-140.2 167.1 -2.7 -24.7 -6.0 134 135 A D - 0 0 6 -28,-0.3 2,-3.4 -2,-0.3 6,-0.1 -0.301 52.6 -94.7 -73.3 162.2 -2.6 -26.1 -2.4 135 136 A A S S+ 0 0 1 19,-0.4 2,-0.5 4,-0.1 -1,-0.1 -0.390 83.3 137.0 -75.7 64.6 -0.3 -29.0 -1.5 136 137 A D > - 0 0 51 -2,-3.4 4,-2.8 1,-0.1 5,-0.2 -0.966 53.2-150.6-117.3 122.4 -3.4 -31.2 -2.3 137 138 A E H > S+ 0 0 106 -2,-0.5 4,-2.6 1,-0.2 5,-0.2 0.868 97.8 56.1 -65.5 -30.1 -2.8 -34.4 -4.3 138 139 A E H > S+ 0 0 119 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.943 112.7 40.8 -63.6 -45.8 -6.3 -34.2 -5.7 139 140 A Q H > S+ 0 0 12 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.900 113.6 54.5 -68.0 -40.2 -5.7 -30.7 -7.1 140 141 A I H X S+ 0 0 0 -4,-2.8 4,-1.8 2,-0.2 -2,-0.2 0.903 110.9 45.9 -58.3 -43.2 -2.2 -31.7 -8.1 141 142 A K H X S+ 0 0 86 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.918 112.8 48.7 -65.8 -47.4 -3.7 -34.6 -10.1 142 143 A A H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.894 107.4 56.9 -59.8 -41.6 -6.4 -32.5 -11.7 143 144 A A H <>S+ 0 0 0 -4,-2.8 5,-1.6 2,-0.2 4,-0.3 0.925 109.8 44.7 -55.5 -47.0 -3.7 -29.9 -12.7 144 145 A A H ><5S+ 0 0 26 -4,-1.8 3,-2.0 1,-0.2 -2,-0.2 0.953 110.9 54.4 -63.0 -47.7 -1.9 -32.6 -14.5 145 146 A E H 3<5S+ 0 0 88 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.753 104.4 53.7 -60.1 -28.5 -5.1 -33.9 -16.1 146 147 A V T 3<5S- 0 0 5 -4,-2.0 -1,-0.3 -3,-0.2 -2,-0.2 0.435 119.3-107.2 -87.7 2.5 -6.0 -30.5 -17.6 147 148 A G T < 5 + 0 0 54 -3,-2.0 -3,-0.2 -4,-0.3 -18,-0.2 0.630 60.5 155.5 89.3 13.5 -2.6 -30.1 -19.3 148 149 A A < - 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