==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 04-FEB-11 3QMM . COMPND 2 MOLECULE: LIPASE ESTA; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR R.SANKARANARAYANAN,M.Z.KAMAL . 358 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14240.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 257 71.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 60 16.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.1 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 . 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 . 27 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 93 26.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.2 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 0 0 0 0 2 0 2 2 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 2 2 6 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 . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 H 0 0 111 0, 0.0 29,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 143.9 16.2 -15.1 38.0 2 4 A N - 0 0 52 169,-0.2 67,-0.2 1,-0.1 31,-0.1 -0.386 360.0 -86.6 -75.3 158.0 12.8 -15.5 36.4 3 5 A P - 0 0 1 0, 0.0 67,-2.5 0, 0.0 2,-0.5 -0.376 48.8-129.9 -61.2 147.9 12.6 -17.5 33.2 4 6 A V E -ab 34 70A 0 29,-2.0 31,-3.4 65,-0.2 2,-0.6 -0.913 17.6-162.5-108.7 128.1 13.3 -15.1 30.3 5 7 A V E -ab 35 71A 0 65,-3.1 67,-1.8 -2,-0.5 2,-0.5 -0.942 10.1-154.2-108.5 121.2 11.0 -15.0 27.3 6 8 A M E -ab 36 72A 4 29,-2.8 31,-1.9 -2,-0.6 2,-0.6 -0.830 4.0-157.9-100.6 132.0 12.5 -13.4 24.2 7 9 A V E - b 0 73A 0 65,-2.7 67,-2.8 -2,-0.5 70,-0.2 -0.913 7.7-150.8-117.2 112.6 10.2 -11.7 21.7 8 10 A H - 0 0 7 -2,-0.6 3,-0.1 29,-0.4 6,-0.1 -0.160 11.0-128.1 -76.4 167.0 11.4 -11.1 18.1 9 11 A G > - 0 0 6 1,-0.2 3,-1.9 67,-0.2 35,-0.1 -0.134 51.2 -38.1-100.1-162.3 10.4 -8.4 15.6 10 12 A I T 3 S+ 0 0 97 1,-0.3 -1,-0.2 33,-0.1 33,-0.2 -0.364 131.0 4.5 -62.7 132.3 9.1 -8.3 12.1 11 13 A G T 3 S+ 0 0 54 31,-1.4 -1,-0.3 1,-0.2 31,-0.1 0.493 110.6 128.1 71.4 1.3 10.6 -10.9 9.8 12 14 A G < - 0 0 16 -3,-1.9 2,-0.3 30,-0.2 -1,-0.2 -0.118 43.5-156.7 -83.3-178.5 12.4 -12.2 12.9 13 15 A S > - 0 0 6 -3,-0.1 3,-2.3 25,-0.1 4,-0.2 -0.976 37.8-101.6-153.6 160.3 12.7 -15.6 14.5 14 16 A S G > S+ 0 0 28 -2,-0.3 3,-1.4 1,-0.3 24,-0.1 0.802 117.1 69.8 -55.4 -27.3 13.3 -17.1 17.9 15 17 A S G > S+ 0 0 10 1,-0.3 3,-1.6 2,-0.1 -1,-0.3 0.716 75.7 81.4 -64.4 -22.1 16.9 -17.7 16.6 16 18 A N G < S+ 0 0 6 -3,-2.3 3,-0.4 1,-0.3 -1,-0.3 0.656 85.0 62.4 -59.4 -15.3 17.6 -14.0 16.6 17 19 A F G <> + 0 0 3 -3,-1.4 4,-3.1 -4,-0.2 -1,-0.3 0.231 63.6 106.1 -98.9 15.8 18.4 -14.2 20.3 18 20 A E H <> S+ 0 0 14 -3,-1.6 4,-2.5 1,-0.2 5,-0.2 0.853 81.6 52.4 -63.6 -32.9 21.3 -16.6 20.4 19 21 A G H > S+ 0 0 2 -3,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.949 114.5 40.6 -66.1 -48.2 23.7 -13.7 21.2 20 22 A I H > S+ 0 0 0 138,-0.4 4,-2.9 -4,-0.2 5,-0.2 0.920 115.7 51.4 -66.2 -44.2 21.7 -12.5 24.1 21 23 A K H X S+ 0 0 19 -4,-3.1 4,-2.6 1,-0.2 5,-0.2 0.955 111.2 46.5 -58.2 -52.5 21.0 -16.0 25.3 22 24 A S H X S+ 0 0 11 -4,-2.5 4,-2.1 -5,-0.2 -1,-0.2 0.893 112.9 51.3 -59.0 -40.1 24.6 -17.1 25.3 23 25 A Y H X S+ 0 0 30 -4,-2.0 4,-1.1 -5,-0.2 -1,-0.2 0.943 109.7 48.2 -62.8 -47.7 25.6 -13.8 27.0 24 26 A L H ><>S+ 0 0 0 -4,-2.9 5,-2.3 1,-0.2 3,-0.7 0.917 109.3 53.6 -60.1 -42.3 23.0 -14.3 29.8 25 27 A V H ><5S+ 0 0 32 -4,-2.6 3,-1.9 1,-0.3 -1,-0.2 0.930 106.2 52.8 -57.1 -44.9 24.2 -17.9 30.3 26 28 A S H 3<5S+ 0 0 80 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.754 107.9 53.4 -63.2 -22.3 27.8 -16.6 30.7 27 29 A Q T <<5S- 0 0 76 -4,-1.1 -1,-0.3 -3,-0.7 -2,-0.2 0.328 132.6 -85.7 -95.3 6.8 26.4 -14.3 33.4 28 30 A G T < 5S+ 0 0 56 -3,-1.9 -3,-0.2 1,-0.4 -2,-0.1 0.289 82.8 134.0 112.3 -13.8 24.8 -17.0 35.4 29 31 A W < - 0 0 11 -5,-2.3 2,-0.5 -6,-0.1 -1,-0.4 -0.391 64.8-103.9 -68.6 150.0 21.3 -17.4 33.8 30 32 A S > - 0 0 70 1,-0.2 3,-2.3 3,-0.1 -1,-0.1 -0.654 21.4-143.5 -79.3 121.9 20.3 -21.0 33.2 31 33 A R G > S+ 0 0 74 -2,-0.5 3,-1.1 1,-0.3 -1,-0.2 0.890 100.5 49.1 -50.1 -45.8 20.6 -21.9 29.5 32 34 A D G 3 S+ 0 0 71 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.297 103.7 60.3 -83.2 13.6 17.5 -24.1 29.6 33 35 A K G < S+ 0 0 69 -3,-2.3 -29,-2.0 -31,-0.1 2,-0.5 0.028 84.0 92.1-122.6 22.7 15.4 -21.4 31.3 34 36 A L E < -a 4 0A 13 -3,-1.1 2,-0.3 -31,-0.2 -29,-0.2 -0.987 59.6-177.4-118.0 117.2 15.8 -18.9 28.5 35 37 A Y E -a 5 0A 47 -31,-3.4 -29,-2.8 -2,-0.5 2,-0.4 -0.857 17.6-160.0-121.0 154.8 13.0 -19.2 26.0 36 38 A A E -a 6 0A 26 -2,-0.3 -29,-0.2 -31,-0.2 -22,-0.1 -0.990 16.1-137.4-136.7 125.9 12.2 -17.5 22.7 37 39 A V - 0 0 1 -31,-1.9 2,-0.5 -2,-0.4 -29,-0.4 -0.425 9.6-144.4 -79.4 153.7 8.7 -17.4 21.0 38 40 A D - 0 0 79 -2,-0.1 2,-0.3 -25,-0.1 -25,-0.1 -0.975 12.4-154.7-122.7 116.8 8.2 -18.0 17.3 39 41 A F - 0 0 14 -2,-0.5 10,-0.1 1,-0.1 -25,-0.1 -0.718 12.2-157.1 -92.0 141.1 5.4 -15.9 15.7 40 42 A W S S+ 0 0 160 -2,-0.3 2,-1.2 8,-0.1 -1,-0.1 0.764 75.7 89.3 -83.9 -26.9 3.7 -17.2 12.5 41 43 A D > - 0 0 14 1,-0.2 3,-2.1 4,-0.1 -30,-0.2 -0.594 58.8-169.7 -77.0 97.3 2.7 -13.6 11.6 42 44 A K T 3 S+ 0 0 113 -2,-1.2 -31,-1.4 1,-0.3 -1,-0.2 0.761 87.0 57.5 -56.0 -26.9 5.6 -12.4 9.5 43 45 A T T 3 S- 0 0 82 -33,-0.2 -1,-0.3 -32,-0.1 -33,-0.1 0.534 99.7-139.9 -84.1 -9.1 4.1 -8.9 9.7 44 46 A G < + 0 0 1 -3,-2.1 -2,-0.1 1,-0.1 36,-0.1 0.732 31.1 174.6 57.6 33.6 4.1 -8.9 13.5 45 47 A T > - 0 0 55 1,-0.1 4,-2.6 4,-0.0 5,-0.3 -0.348 37.2-129.5 -68.3 151.0 0.8 -7.2 14.2 46 48 A N H > S+ 0 0 29 1,-0.2 4,-2.7 2,-0.2 -1,-0.1 0.887 107.0 62.8 -65.5 -39.3 -0.2 -7.0 17.9 47 49 A Y H 4 S+ 0 0 189 1,-0.2 -1,-0.2 2,-0.2 -3,-0.0 0.875 115.4 29.6 -54.3 -41.7 -3.6 -8.5 17.0 48 50 A N H > S+ 0 0 54 -3,-0.2 4,-0.8 2,-0.1 -2,-0.2 0.896 125.4 42.9 -87.1 -43.6 -2.0 -11.7 15.9 49 51 A N H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.804 98.5 70.4 -75.4 -31.2 1.2 -11.9 18.0 50 52 A G H X S+ 0 0 0 -4,-2.7 4,-2.3 -5,-0.3 -1,-0.2 0.936 102.9 42.6 -52.1 -55.2 -0.3 -10.8 21.4 51 53 A P H > S+ 0 0 54 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.830 112.8 53.9 -61.9 -34.3 -2.3 -14.1 21.9 52 54 A V H X S+ 0 0 38 -4,-0.8 4,-2.3 2,-0.2 -2,-0.2 0.945 110.6 46.4 -66.1 -45.9 0.6 -16.2 20.7 53 55 A L H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 5,-0.2 0.888 109.6 55.3 -62.4 -39.8 2.9 -14.6 23.2 54 56 A S H X S+ 0 0 1 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.928 110.4 44.4 -59.5 -46.0 0.3 -15.0 26.0 55 57 A R H X S+ 0 0 148 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.894 112.3 52.9 -67.5 -37.7 0.1 -18.8 25.3 56 58 A F H X S+ 0 0 45 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.927 109.5 48.4 -63.5 -44.0 3.9 -19.0 25.1 57 59 A V H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 -1,-0.2 0.921 110.7 50.9 -62.7 -43.0 4.3 -17.3 28.5 58 60 A Q H X S+ 0 0 63 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.921 108.9 51.6 -60.7 -42.8 1.7 -19.5 30.1 59 61 A K H X S+ 0 0 116 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.911 110.9 48.1 -59.5 -43.7 3.6 -22.6 28.7 60 62 A V H X S+ 0 0 2 -4,-2.2 4,-2.3 1,-0.2 6,-0.3 0.919 110.1 51.7 -63.7 -43.7 6.8 -21.3 30.2 61 63 A L H X S+ 0 0 14 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.845 111.5 48.2 -62.5 -33.1 5.2 -20.6 33.6 62 64 A D H < S+ 0 0 112 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.897 112.9 45.9 -75.0 -40.4 3.8 -24.2 33.6 63 65 A E H < S+ 0 0 120 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.858 123.5 34.2 -70.0 -35.8 7.0 -25.9 32.7 64 66 A T H < S- 0 0 44 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.715 94.0-133.6 -93.1 -24.5 9.1 -23.9 35.2 65 67 A G < + 0 0 64 -4,-1.7 -3,-0.1 -5,-0.3 -4,-0.1 0.534 56.1 146.5 80.7 5.3 6.6 -23.4 38.0 66 68 A A - 0 0 27 -6,-0.3 -1,-0.3 -5,-0.2 -2,-0.1 -0.351 51.1-142.7 -73.9 155.5 7.6 -19.8 38.1 67 69 A K S S+ 0 0 187 1,-0.2 2,-0.3 -3,-0.1 -1,-0.1 0.734 82.4 16.0 -88.5 -25.1 5.0 -17.1 39.0 68 70 A K - 0 0 33 -7,-0.1 2,-0.3 26,-0.0 26,-0.2 -0.988 62.0-148.9-147.7 156.3 6.5 -14.6 36.5 69 71 A V E - c 0 94A 0 24,-2.7 26,-2.0 -2,-0.3 2,-0.3 -0.768 17.1-132.7-117.1 163.7 8.8 -14.3 33.5 70 72 A D E -b 4 0A 2 -67,-2.5 -65,-3.1 -2,-0.3 2,-0.4 -0.828 24.1-143.2-110.1 156.2 11.0 -11.5 32.4 71 73 A I E -bc 5 97A 0 25,-2.8 27,-2.5 -2,-0.3 2,-0.5 -0.976 17.9-169.9-129.7 137.7 10.9 -10.4 28.7 72 74 A V E -bc 6 98A 0 -67,-1.8 -65,-2.7 -2,-0.4 2,-0.4 -0.989 23.8-174.7-119.6 115.5 13.5 -9.1 26.3 73 75 A A E -bc 7 99A 0 25,-2.6 27,-2.7 -2,-0.5 2,-0.4 -0.901 13.8-150.8-119.1 147.1 11.8 -7.8 23.1 74 76 A H E > - c 0 100A 4 -67,-2.8 3,-2.9 -2,-0.4 27,-0.2 -0.935 53.9 -48.6-119.0 135.5 13.2 -6.5 19.8 75 77 A S T >> S+ 0 0 12 25,-2.6 28,-1.9 -2,-0.4 3,-1.8 -0.159 133.1 8.4 47.9-119.0 11.7 -4.0 17.5 76 78 A M H 3> S+ 0 0 33 1,-0.3 4,-2.4 26,-0.2 -1,-0.3 0.753 121.7 73.4 -63.3 -21.3 8.0 -4.7 16.8 77 79 A G H <> S+ 0 0 0 -3,-2.9 4,-2.4 1,-0.2 -1,-0.3 0.801 90.2 58.5 -61.4 -27.7 8.3 -7.4 19.5 78 80 A G H <> S+ 0 0 0 -3,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.928 106.2 46.7 -66.6 -43.7 8.4 -4.5 22.0 79 81 A A H X S+ 0 0 0 -4,-0.8 4,-2.0 1,-0.2 -2,-0.2 0.918 112.7 50.4 -62.8 -43.8 5.0 -3.4 20.7 80 82 A N H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.897 110.5 49.7 -61.2 -41.8 3.7 -6.9 20.9 81 83 A T H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.914 110.9 47.9 -64.4 -44.8 5.0 -7.3 24.5 82 84 A L H X S+ 0 0 0 -4,-2.3 4,-3.0 2,-0.2 5,-0.3 0.860 111.9 51.6 -64.8 -35.1 3.4 -4.0 25.7 83 85 A Y H X>S+ 0 0 48 -4,-2.0 4,-2.7 2,-0.2 5,-1.2 0.943 109.0 49.6 -65.5 -49.1 0.1 -5.1 24.0 84 86 A Y H X5S+ 0 0 0 -4,-2.5 6,-2.2 3,-0.2 4,-0.5 0.894 117.4 41.7 -56.1 -42.2 0.2 -8.5 25.8 85 87 A I H <5S+ 0 0 7 -4,-2.2 6,-0.5 5,-0.2 -2,-0.2 0.915 123.1 35.0 -74.5 -45.3 0.8 -6.8 29.1 86 88 A K H <5S+ 0 0 94 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.905 133.5 20.9 -79.3 -42.8 -1.6 -3.8 28.8 87 89 A Y H <5S+ 0 0 136 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.1 0.675 123.5 41.6-103.3 -20.0 -4.5 -5.4 26.8 88 90 A L S < S+ 0 0 57 1,-0.2 3,-0.7 2,-0.1 -4,-0.2 0.227 96.7 100.7 -98.6 15.5 -3.3 -11.2 30.5 90 92 A G G >> + 0 0 0 -6,-2.2 3,-1.7 1,-0.2 4,-0.8 0.616 50.6 96.9 -76.5 -11.5 0.4 -10.2 31.0 91 93 A G G 34 S+ 0 0 4 -6,-0.5 24,-1.6 -3,-0.4 25,-0.7 0.724 97.3 25.8 -49.0 -31.3 -0.2 -7.7 33.8 92 94 A N G <4 S+ 0 0 75 -3,-0.7 -1,-0.3 23,-0.2 -2,-0.1 0.170 114.5 63.9-121.4 18.7 0.6 -10.1 36.6 93 95 A K T <4 S+ 0 0 36 -3,-1.7 -24,-2.7 -25,-0.1 2,-0.4 0.356 90.6 70.0-121.1 2.1 2.9 -12.6 34.8 94 96 A V E < +c 69 0A 0 -4,-0.8 -24,-0.2 -26,-0.2 3,-0.1 -0.970 42.7 170.8-127.1 139.1 5.8 -10.3 34.0 95 97 A A E + 0 0 19 -26,-2.0 27,-2.3 -2,-0.4 2,-0.4 0.817 69.9 22.9-106.4 -63.9 8.4 -8.7 36.3 96 98 A N E - d 0 122A 20 -27,-0.2 -25,-2.8 25,-0.2 2,-0.4 -0.912 61.7-171.0-114.6 135.9 11.1 -7.1 34.2 97 99 A V E -cd 71 123A 2 25,-2.5 27,-1.7 -2,-0.4 2,-0.4 -0.988 3.8-177.5-127.1 132.3 10.8 -6.0 30.6 98 100 A V E -cd 72 124A 0 -27,-2.5 -25,-2.6 -2,-0.4 2,-0.4 -0.993 9.3-163.6-128.9 121.7 13.7 -4.8 28.4 99 101 A T E -cd 73 125A 1 25,-2.5 27,-3.0 -2,-0.4 2,-0.6 -0.852 6.9-152.9-108.3 146.4 13.0 -3.6 24.8 100 102 A L E S-cd 74 126A 0 -27,-2.7 -25,-2.6 -2,-0.4 27,-0.2 -0.946 80.0 -27.3-119.4 108.3 15.7 -3.2 22.1 101 103 A G S S- 0 0 0 25,-3.3 -1,-0.2 -2,-0.6 26,-0.2 0.905 93.7-172.9 53.6 41.6 14.9 -0.6 19.5 102 104 A G - 0 0 0 24,-0.5 2,-1.3 -29,-0.1 3,-0.3 -0.414 36.9-139.1 -73.7 141.0 11.2 -1.3 20.3 103 105 A A > + 0 0 4 -28,-1.9 3,-1.4 1,-0.2 36,-0.2 -0.400 51.1 153.3 -89.2 54.5 8.4 0.2 18.2 104 106 A N G >> + 0 0 0 -2,-1.3 3,-2.0 1,-0.3 4,-1.7 0.837 54.5 60.8 -56.6 -44.6 6.8 0.7 21.7 105 107 A R G 34 S+ 0 0 66 33,-2.3 -1,-0.3 -3,-0.3 4,-0.1 0.546 84.0 79.4 -67.6 -4.4 4.6 3.7 21.0 106 108 A L G <4 S+ 0 0 97 -3,-1.4 -1,-0.3 32,-0.2 -2,-0.2 0.574 110.7 27.2 -76.3 -5.8 2.7 1.7 18.4 107 109 A T T <4 S- 0 0 22 -3,-2.0 2,-0.3 1,-0.4 -2,-0.2 0.711 135.3 -20.0-115.9 -54.4 1.0 0.2 21.4 108 110 A T < - 0 0 11 -4,-1.7 -1,-0.4 1,-0.1 -2,-0.1 -0.992 39.5-137.3-157.8 155.7 1.1 2.8 24.2 109 111 A D S S+ 0 0 69 -2,-0.3 33,-2.8 32,-0.1 2,-0.4 0.727 89.1 59.3 -87.0 -23.5 3.0 5.9 25.2 110 112 A K B S-g 142 0B 105 31,-0.2 33,-0.2 33,-0.1 -1,-0.1 -0.883 90.6-107.6-115.0 141.1 3.3 4.9 28.9 111 113 A A - 0 0 0 31,-2.6 68,-0.2 -2,-0.4 12,-0.1 -0.438 39.4-125.7 -63.1 112.3 4.9 1.9 30.5 112 114 A P - 0 0 11 0, 0.0 9,-0.2 0, 0.0 -1,-0.1 -0.461 12.8-152.9 -65.7 117.4 2.0 -0.3 31.8 113 115 A P - 0 0 45 0, 0.0 8,-2.1 0, 0.0 3,-0.3 0.671 33.3-141.3 -64.4 -18.2 2.4 -1.0 35.5 114 116 A G - 0 0 29 6,-0.2 -22,-0.2 1,-0.2 -23,-0.1 -0.335 23.4 -75.4 87.3-171.2 0.6 -4.3 35.3 115 117 A T S S+ 0 0 89 -24,-1.6 -23,-0.2 -2,-0.1 -1,-0.2 0.207 86.4 111.0-117.3 13.6 -1.9 -5.9 37.8 116 118 A D > - 0 0 37 -25,-0.7 3,-1.6 3,-0.3 -24,-0.0 -0.793 53.0-157.7 -91.5 103.9 0.3 -7.2 40.6 117 119 A P T 3 S+ 0 0 123 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.729 88.3 60.0 -51.9 -23.4 -0.6 -4.9 43.6 118 120 A N T 3 S+ 0 0 142 1,-0.2 2,-0.3 -3,-0.1 -2,-0.0 0.770 118.0 7.5 -79.6 -26.0 2.8 -5.8 45.1 119 121 A Q < - 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