==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 11-FEB-11 3QP9 . COMPND 2 MOLECULE: TYPE I POLYKETIDE SYNTHASE PIKAII; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES VENEZUELAE; . AUTHOR J.ZHENG,A.T.KEATINGE-CLAY . 1852 19 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 71032.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1348 72.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 272 14.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 82 4.4 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 . 7 0.4 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 . 2 0.1 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 . 168 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 200 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 547 29.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 40 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 6 8 5 2 3 10 7 3 3 0 0 0 0 0 2 0 1 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 0 8 20 0 8 8 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 . 9 4 0 4 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 4 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 V 0 0 139 0, 0.0 422,-0.0 0, 0.0 442,-0.0 0.000 360.0 360.0 360.0 -88.1 33.0 -10.4 21.4 2 4 A Q > + 0 0 54 424,-0.0 3,-1.1 425,-0.0 4,-0.1 0.028 360.0 76.2 178.6 -18.7 29.6 -10.2 23.1 3 5 A D G > S+ 0 0 60 1,-0.2 3,-0.7 2,-0.2 205,-0.1 0.716 96.1 57.2 -71.4 -14.6 28.0 -7.3 21.2 4 6 A S G 3 S+ 0 0 55 1,-0.2 -1,-0.2 205,-0.1 205,-0.1 0.410 93.5 69.4 -92.3 7.7 27.6 -10.0 18.6 5 7 A W G < S+ 0 0 15 -3,-1.1 437,-2.1 438,-0.1 2,-0.5 0.450 75.0 105.2 -94.6 -4.5 25.7 -12.1 21.2 6 8 A R E < +A 441 0A 11 -3,-0.7 202,-2.1 435,-0.2 2,-0.3 -0.716 40.0 156.3 -87.0 123.5 22.6 -9.8 21.3 7 9 A Y E -AB 440 207A 2 433,-2.4 433,-3.1 -2,-0.5 2,-0.3 -0.889 13.9-174.4-130.1 163.5 19.4 -11.1 19.5 8 10 A R E - B 0 206A 102 198,-2.5 198,-2.7 -2,-0.3 2,-0.5 -0.988 30.6 -99.7-152.2 171.1 15.8 -10.2 19.8 9 11 A I E - B 0 205A 46 -2,-0.3 2,-0.3 196,-0.2 196,-0.2 -0.700 38.1-178.2 -93.3 125.0 12.4 -11.3 18.5 10 12 A D E - B 0 204A 66 194,-3.3 194,-2.5 -2,-0.5 2,-0.5 -0.858 22.0-136.2-119.3 159.6 10.9 -9.2 15.8 11 13 A W E - B 0 203A 21 122,-0.4 2,-0.6 -2,-0.3 192,-0.2 -0.975 19.0-149.1-118.6 110.8 7.4 -9.6 14.1 12 14 A K E - B 0 202A 91 190,-3.4 190,-2.0 -2,-0.5 2,-0.2 -0.744 15.8-125.1 -88.7 121.6 7.6 -9.2 10.3 13 15 A R E - B 0 201A 126 -2,-0.6 2,-0.4 188,-0.2 188,-0.3 -0.428 28.6-137.3 -60.4 127.8 4.5 -7.7 8.6 14 16 A L - 0 0 40 186,-3.4 186,-0.4 -2,-0.2 3,-0.1 -0.721 17.9-107.4 -94.4 140.8 3.4 -10.1 5.8 15 17 A A - 0 0 98 -2,-0.4 -1,-0.1 1,-0.1 2,-0.0 -0.232 41.7 -99.4 -56.0 139.5 2.2 -9.0 2.3 16 18 A V 0 0 89 1,-0.1 -1,-0.1 1643,-0.1 183,-0.0 -0.441 360.0 360.0 -58.0 138.6 -1.5 -9.3 1.6 17 19 A A 0 0 137 -3,-0.1 -1,-0.1 -2,-0.0 1643,-0.1 -0.036 360.0 360.0 -55.6 360.0 -2.1 -12.5 -0.4 18 ! 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 19 26 A G 0 0 107 0, 0.0 2,-0.3 0, 0.0 28,-0.1 0.000 360.0 360.0 360.0-179.7 -8.8 -21.3 0.8 20 27 A L + 0 0 14 26,-1.8 2,-0.3 23,-0.1 165,-0.1 -0.774 360.0 172.3-104.4 145.5 -9.7 -24.0 3.3 21 28 A S + 0 0 84 -2,-0.3 27,-0.2 2,-0.1 26,-0.0 -0.960 32.6 19.7-144.3 167.3 -11.3 -27.4 2.6 22 29 A G S S- 0 0 30 25,-0.3 27,-3.5 -2,-0.3 2,-0.5 -0.106 95.4 -20.6 76.8-167.0 -12.2 -30.7 4.2 23 30 A R E -c 49 0A 71 25,-0.2 57,-3.3 55,-0.1 58,-1.2 -0.660 54.5-172.9 -85.2 125.5 -12.8 -31.8 7.8 24 31 A W E -cd 50 81A 9 25,-1.6 27,-3.5 -2,-0.5 2,-0.5 -0.968 14.1-147.1-111.3 124.3 -11.3 -29.6 10.5 25 32 A L E -cd 51 82A 1 56,-2.3 58,-2.5 -2,-0.5 2,-0.7 -0.820 10.3-158.8 -88.8 131.1 -11.6 -30.8 14.1 26 33 A V E -cd 52 83A 0 25,-3.1 27,-3.0 -2,-0.5 2,-0.8 -0.949 3.6-154.9-111.2 110.3 -11.9 -27.9 16.6 27 34 A V E +cd 53 84A 1 56,-2.2 58,-3.1 -2,-0.7 59,-0.3 -0.833 19.4 176.7 -89.4 110.6 -10.9 -28.8 20.0 28 35 A V E -c 54 0A 2 25,-1.3 27,-2.7 -2,-0.8 2,-0.2 -0.808 36.6-108.2-113.6 139.1 -12.7 -26.6 22.6 29 36 A P E > -c 55 0A 1 0, 0.0 3,-1.8 0, 0.0 27,-0.2 -0.553 41.5-114.0 -67.8 138.5 -12.5 -26.8 26.4 30 37 A E G > S+ 0 0 103 25,-3.7 3,-0.8 1,-0.3 26,-0.1 0.804 109.2 42.4 -40.8 -61.3 -15.9 -28.2 27.6 31 38 A D G 3 S+ 0 0 66 1,-0.2 -1,-0.3 24,-0.2 3,-0.2 0.331 105.9 71.2 -78.7 13.4 -17.5 -25.3 29.6 32 39 A R G < + 0 0 51 -3,-1.8 -1,-0.2 1,-0.1 -2,-0.1 0.022 55.1 120.8-117.4 27.3 -16.3 -22.9 26.8 33 40 A S <> + 0 0 42 -3,-0.8 4,-0.6 1,-0.2 -1,-0.1 0.811 63.2 70.5 -63.9 -43.3 -18.7 -24.0 23.9 34 41 A A T >4 S+ 0 0 44 -3,-0.2 3,-1.8 2,-0.1 -1,-0.2 0.953 97.7 53.7 -26.8 -78.2 -20.2 -20.5 23.6 35 42 A E T 34 S+ 0 0 81 1,-0.2 -3,-0.0 2,-0.1 -7,-0.0 -0.443 95.3 56.1 -68.7 144.0 -16.9 -19.2 22.1 36 43 A A T 3> S+ 0 0 0 -2,-0.1 4,-3.3 -8,-0.0 5,-0.3 -0.278 81.2 96.1 113.4 -38.9 -15.9 -21.3 19.2 37 44 A A H S+ 0 0 33 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.825 111.7 62.0 -74.6 -27.4 -17.6 -17.7 15.7 39 46 A V H > S+ 0 0 2 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.971 108.5 42.4 -49.8 -55.4 -14.4 -19.9 15.2 40 47 A L H X S+ 0 0 36 -4,-3.3 4,-3.3 1,-0.2 5,-0.3 0.914 110.7 56.1 -65.0 -34.5 -16.5 -22.5 13.3 41 48 A A H X S+ 0 0 47 -4,-2.1 4,-3.8 -5,-0.3 5,-0.3 0.962 109.2 46.7 -60.2 -45.4 -18.4 -19.9 11.4 42 49 A A H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.912 114.3 46.3 -61.2 -42.3 -15.1 -18.5 10.1 43 50 A L H <>S+ 0 0 0 -4,-2.3 5,-2.8 2,-0.2 4,-0.5 0.932 116.1 45.7 -64.1 -46.7 -13.8 -21.9 9.2 44 51 A S H ><5S+ 0 0 59 -4,-3.3 3,-2.6 3,-0.2 -2,-0.2 0.975 114.1 48.2 -56.2 -55.3 -17.1 -22.7 7.5 45 52 A G H 3<5S+ 0 0 62 -4,-3.8 -2,-0.2 1,-0.3 -1,-0.2 0.823 107.8 56.8 -58.3 -33.0 -17.1 -19.3 5.8 46 53 A A T 3<5S- 0 0 27 -4,-2.4 -26,-1.8 -5,-0.3 -1,-0.3 0.574 127.8-102.6 -71.6 -10.8 -13.5 -20.1 4.8 47 54 A G T < 5S+ 0 0 44 -3,-2.6 -25,-0.3 -4,-0.5 -3,-0.2 0.635 80.1 125.8 98.3 17.4 -14.8 -23.3 3.1 48 55 A A < - 0 0 13 -5,-2.8 -1,-0.3 -27,-0.2 -25,-0.2 -0.507 63.0-125.3 -87.1 168.1 -13.8 -25.9 5.7 49 56 A D E -c 23 0A 87 -27,-3.5 -25,-1.6 -2,-0.2 2,-0.3 -0.881 37.6-157.2-108.3 92.0 -16.3 -28.5 7.2 50 57 A P E -c 24 0A 17 0, 0.0 2,-0.5 0, 0.0 -25,-0.2 -0.549 13.5-168.2 -80.2 132.9 -15.7 -27.8 10.9 51 58 A V E -c 25 0A 44 -27,-3.5 -25,-3.1 -2,-0.3 2,-0.3 -0.948 14.8-141.6-115.3 117.4 -16.4 -30.3 13.6 52 59 A Q E -c 26 0A 46 -2,-0.5 2,-0.5 -27,-0.2 -25,-0.2 -0.559 12.9-169.4 -75.1 136.7 -16.4 -29.2 17.3 53 60 A L E -c 27 0A 23 -27,-3.0 -25,-1.3 -2,-0.3 2,-0.5 -0.898 8.7-157.9-129.3 95.3 -15.0 -31.6 19.8 54 61 A D E -c 28 0A 76 -2,-0.5 2,-0.3 -27,-0.2 -27,-0.1 -0.664 17.9-176.2 -75.7 123.8 -15.7 -30.4 23.3 55 62 A V E -c 29 0A 19 -27,-2.7 -25,-3.7 -2,-0.5 -24,-0.2 -0.865 32.7-115.4-119.6 156.9 -13.2 -31.9 25.8 56 63 A S > - 0 0 53 -2,-0.3 3,-1.6 -27,-0.2 8,-0.1 -0.800 23.6-148.8 -80.0 113.3 -12.8 -31.9 29.7 57 64 A P T 3 S+ 0 0 16 0, 0.0 -1,-0.2 0, 0.0 52,-0.1 0.814 98.7 54.0 -57.6 -23.5 -9.4 -30.1 30.1 58 65 A L T 3 S+ 0 0 84 -3,-0.1 -2,-0.0 47,-0.0 35,-0.0 0.687 90.1 119.0 -78.3 -17.8 -8.9 -32.3 33.3 59 66 A G < - 0 0 23 -3,-1.6 50,-0.1 1,-0.1 -4,-0.0 0.086 69.2 -97.8 -54.9 155.9 -9.5 -35.5 31.2 60 67 A D > - 0 0 93 1,-0.1 4,-1.8 4,-0.0 5,-0.1 -0.257 25.0-120.2 -66.7 154.7 -7.1 -38.4 30.7 61 68 A R H > S+ 0 0 66 2,-0.2 4,-2.8 1,-0.2 3,-0.4 0.977 114.9 54.6 -60.1 -51.3 -5.0 -38.7 27.5 62 69 A Q H > S+ 0 0 106 1,-0.3 4,-2.0 2,-0.2 5,-0.2 0.873 106.4 51.4 -53.3 -41.0 -6.7 -42.1 26.8 63 70 A R H > S+ 0 0 180 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.907 112.0 46.7 -60.0 -42.9 -10.2 -40.4 26.9 64 71 A L H X S+ 0 0 9 -4,-1.8 4,-2.7 -3,-0.4 -2,-0.2 0.888 110.2 52.2 -68.2 -41.9 -9.1 -37.7 24.5 65 72 A A H X S+ 0 0 11 -4,-2.8 4,-3.2 2,-0.2 5,-0.2 0.873 110.0 49.6 -60.6 -37.5 -7.5 -40.3 22.1 66 73 A A H X S+ 0 0 63 -4,-2.0 4,-2.8 -5,-0.3 5,-0.2 0.932 111.3 50.1 -65.1 -42.4 -10.8 -42.3 22.1 67 74 A T H X S+ 0 0 53 -4,-2.0 4,-1.6 1,-0.2 -2,-0.2 0.916 114.6 43.0 -64.7 -45.7 -12.6 -39.1 21.4 68 75 A L H X S+ 0 0 1 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.916 112.8 51.1 -63.3 -51.5 -10.2 -38.2 18.5 69 76 A G H X S+ 0 0 26 -4,-3.2 4,-3.3 1,-0.2 5,-0.2 0.910 111.1 50.7 -52.7 -45.5 -10.2 -41.9 17.1 70 77 A E H X S+ 0 0 152 -4,-2.8 4,-2.1 -5,-0.2 -1,-0.2 0.921 112.4 45.7 -57.3 -42.0 -14.0 -41.7 17.1 71 78 A A H X S+ 0 0 11 -4,-1.6 4,-1.0 -5,-0.2 -2,-0.2 0.853 113.9 48.7 -71.5 -33.2 -14.0 -38.4 15.3 72 79 A L H <>S+ 0 0 19 -4,-2.6 5,-2.8 2,-0.2 4,-0.5 0.893 108.9 52.5 -76.0 -41.5 -11.4 -39.7 12.8 73 80 A A H ><5S+ 0 0 75 -4,-3.3 3,-1.6 1,-0.2 -2,-0.2 0.930 107.3 54.9 -52.8 -44.0 -13.4 -42.9 12.2 74 81 A A H 3<5S+ 0 0 77 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.789 105.0 51.6 -64.9 -28.6 -16.4 -40.6 11.5 75 82 A A T 3<5S- 0 0 30 -4,-1.0 -1,-0.3 -3,-0.4 -2,-0.2 0.479 125.7 -99.0 -83.8 -4.2 -14.5 -38.6 8.8 76 83 A G T < 5S- 0 0 73 -3,-1.6 -3,-0.2 -4,-0.5 -2,-0.1 0.617 76.0 -55.6 94.3 18.1 -13.5 -41.9 7.0 77 84 A G S + 0 0 0 -58,-3.1 3,-1.6 -2,-0.6 4,-0.2 0.156 51.9 112.1 -95.9 16.4 -8.7 -23.7 21.3 86 93 A L G > + 0 0 0 -59,-0.3 3,-1.7 1,-0.3 20,-0.1 0.788 61.7 67.7 -64.2 -27.5 -7.5 -25.4 24.6 87 94 A A G 3 S+ 0 0 2 39,-0.4 -1,-0.3 1,-0.3 16,-0.2 0.750 84.1 74.8 -63.8 -20.3 -5.1 -22.6 25.6 88 95 A W G < S+ 0 0 21 -3,-1.6 2,-1.5 38,-0.2 -1,-0.3 0.702 72.3 93.5 -68.8 -16.9 -8.2 -20.3 26.1 89 96 A D < + 0 0 5 -3,-1.7 14,-2.1 -4,-0.2 15,-0.3 -0.589 46.9 166.5 -77.9 96.4 -8.8 -22.3 29.3 90 97 A E + 0 0 67 -2,-1.5 -1,-0.2 12,-0.2 -2,-0.1 0.340 29.9 129.4 -90.5 7.9 -7.0 -20.1 31.8 91 98 A S - 0 0 39 1,-0.1 11,-2.3 10,-0.1 12,-0.3 -0.241 65.8 -96.6 -65.1 150.6 -8.6 -21.8 34.8 92 99 A A B -O 101 0B 41 9,-0.2 9,-0.2 10,-0.1 -1,-0.1 -0.352 31.3-129.7 -60.1 139.9 -6.6 -23.1 37.8 93 100 A H > - 0 0 32 7,-0.5 3,-2.1 3,-0.4 -1,-0.1 -0.854 15.2-130.3 -95.7 133.3 -5.6 -26.7 37.8 94 101 A P T 3 S+ 0 0 89 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.766 103.7 47.3 -52.9 -35.7 -6.4 -28.5 41.2 95 102 A G T 3 S+ 0 0 51 1,-0.0 -3,-0.0 2,-0.0 -2,-0.0 0.536 112.3 49.4 -84.6 -0.8 -3.0 -30.0 41.6 96 103 A H S < S- 0 0 34 -3,-2.1 -3,-0.4 4,-0.1 228,-0.0 -0.976 70.5-118.9-152.5 142.0 -0.9 -26.9 40.8 97 104 A P > - 0 0 62 0, 0.0 3,-0.6 0, 0.0 -4,-0.1 -0.260 55.9 -53.6 -74.4 167.8 -0.3 -23.2 41.6 98 105 A A T 3 S+ 0 0 56 1,-0.3 3,-0.1 233,-0.1 236,-0.1 -0.448 109.7 42.3 -64.2 151.6 -0.5 -20.4 39.0 99 106 A P T 3 S+ 0 0 7 0, 0.0 -1,-0.3 0, 0.0 228,-0.0 -0.991 95.2 86.6 -98.9 -4.5 0.6 -19.7 36.2 100 107 A F < - 0 0 3 -3,-0.6 -7,-0.5 223,-0.2 2,-0.2 -0.298 66.2-169.1 -48.6 129.4 0.2 -23.3 35.1 101 108 A T B > -O 92 0B 10 -9,-0.2 4,-1.5 42,-0.1 3,-0.4 -0.775 37.8-107.1-120.2 171.2 -3.5 -23.4 33.7 102 109 A R H > S+ 0 0 55 -11,-2.3 4,-3.2 -2,-0.2 5,-0.2 0.906 121.5 57.8 -66.0 -37.2 -5.8 -26.3 32.7 103 110 A G H > S+ 0 0 0 -14,-2.1 4,-1.9 -12,-0.3 -1,-0.2 0.804 101.4 55.3 -56.6 -36.3 -5.3 -25.1 29.1 104 111 A T H > S+ 0 0 2 -3,-0.4 4,-1.5 -15,-0.3 -1,-0.2 0.931 114.4 38.7 -59.9 -53.4 -1.5 -25.6 29.5 105 112 A G H X S+ 0 0 3 -4,-1.5 4,-2.5 2,-0.2 -2,-0.2 0.947 115.3 53.4 -60.6 -53.1 -2.0 -29.3 30.6 106 113 A A H X S+ 0 0 5 -4,-3.2 4,-2.2 1,-0.2 -2,-0.2 0.860 106.2 52.5 -54.3 -42.2 -4.8 -30.0 28.1 107 114 A T H X S+ 0 0 1 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.919 110.3 48.0 -62.8 -43.4 -2.7 -28.7 25.1 108 115 A L H X S+ 0 0 0 -4,-1.5 4,-1.6 1,-0.2 -2,-0.2 0.943 110.9 52.1 -59.5 -42.2 0.1 -31.1 26.1 109 116 A T H X S+ 0 0 14 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.883 107.2 52.5 -63.5 -35.9 -2.4 -33.9 26.4 110 117 A L H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.887 104.6 54.2 -68.1 -37.7 -3.8 -33.1 23.0 111 118 A V H X S+ 0 0 3 -4,-1.9 4,-0.7 1,-0.2 -1,-0.2 0.819 115.6 41.5 -64.0 -35.3 -0.3 -33.3 21.3 112 119 A Q H X S+ 0 0 8 -4,-1.6 4,-1.6 -5,-0.2 3,-0.4 0.926 114.1 49.8 -77.9 -46.5 0.1 -36.8 22.8 113 120 A A H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.789 101.1 63.0 -69.3 -36.4 -3.4 -38.0 22.2 114 121 A L H <>S+ 0 0 4 -4,-2.4 5,-2.2 2,-0.2 4,-0.3 0.913 107.5 44.7 -49.4 -46.3 -3.4 -37.0 18.5 115 122 A E H ><5S+ 0 0 96 -4,-0.7 3,-1.1 -3,-0.4 -2,-0.2 0.907 110.8 54.1 -69.4 -37.5 -0.5 -39.5 18.0 116 123 A D H 3<5S+ 0 0 69 -4,-1.6 -2,-0.2 1,-0.3 -1,-0.2 0.844 112.5 44.3 -64.1 -37.7 -2.4 -42.2 20.1 117 124 A A T 3<5S- 0 0 21 -4,-2.5 -1,-0.3 -5,-0.1 -2,-0.2 0.428 113.3-121.1 -80.9 -3.7 -5.4 -41.8 17.8 118 125 A G T < 5 + 0 0 51 -3,-1.1 2,-0.6 -4,-0.3 -3,-0.2 0.761 50.9 162.6 65.9 29.7 -3.3 -41.8 14.6 119 126 A V < - 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