==== Secondary Structure Definition by the program DSSP, CMBI version 3.0 ==== DATE=2017-09-12 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION REGULATION 08-FEB-98 1A4X . COMPND MOL_ID: 1; MOLECULE: PYRIMIDINE OPERON REGULATORY PROTEIN PYRR; CHAIN: . SOURCE MOL_ID: 1; ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; ORGANISM_TAXID: 142 . AUTHOR D.R.TOMCHICK,R.J.TURNER,R.W.SWITZER,J.L.SMITH . 334 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15505.8 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 219 65.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 54 16.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 34 10.2 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 . 14 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 25.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 0 0 0 0 0 0 0 0 2 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 4 2 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 PARALLEL BRIDGES PER LADDER . 1 0 3 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 2 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 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 CHAIN AUTHCHAIN 1 4 A K 0 0 157 0, 0.0 2,-0.3 0, 0.0 165,-0.2 0.000 360.0 360.0 360.0 148.5 27.2 1.7 50.2 A A 2 5 A A E -A 165 0A 49 163,-1.0 163,-2.6 0, 0.0 2,-0.4 -0.954 360.0-125.3-155.0 137.2 23.8 0.1 49.8 A A 3 6 A V E +A 164 0A 81 -2,-0.3 161,-0.3 161,-0.2 3,-0.1 -0.729 27.0 172.4 -85.6 126.7 20.6 1.3 48.2 A A 4 7 A I E S+ 0 0A 64 159,-2.7 2,-0.3 -2,-0.4 160,-0.2 0.683 71.4 25.8-106.4 -24.9 17.6 1.1 50.6 A A 5 8 A L E S-A 163 0A 6 158,-1.4 158,-2.3 4,-0.0 -1,-0.4 -0.999 70.1-161.0-138.7 136.3 15.0 2.9 48.5 A A 6 9 A D > - 0 0 82 -2,-0.3 4,-2.8 156,-0.2 5,-0.2 -0.468 45.2 -81.5-106.6-177.2 15.0 3.3 44.7 A A 7 10 A E H > S+ 0 0 102 154,-0.4 4,-2.5 1,-0.2 5,-0.2 0.882 131.1 48.3 -51.7 -43.2 13.1 5.7 42.4 A A 8 11 A Q H > S+ 0 0 97 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.920 111.1 49.5 -64.9 -47.2 9.9 3.7 42.7 A A 9 12 A A H > S+ 0 0 16 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.916 113.0 48.2 -57.7 -43.2 10.1 3.4 46.5 A A 10 13 A I H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.921 111.6 49.5 -63.9 -45.6 10.7 7.2 46.7 A A 11 14 A R H X S+ 0 0 102 -4,-2.5 4,-2.3 -5,-0.2 -1,-0.2 0.873 111.6 48.6 -60.1 -43.5 7.8 7.9 44.4 A A 12 15 A R H X S+ 0 0 140 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.936 111.1 49.9 -65.4 -44.7 5.4 5.7 46.4 A A 13 16 A A H X S+ 0 0 4 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.902 112.7 47.9 -59.7 -43.4 6.5 7.3 49.7 A A 14 17 A L H X S+ 0 0 2 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.899 110.2 50.1 -66.9 -40.3 5.9 10.8 48.2 A A 15 18 A T H X S+ 0 0 54 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.941 111.6 50.5 -63.4 -38.7 2.5 9.9 46.8 A A 16 19 A R H X S+ 0 0 95 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.914 111.9 47.2 -65.3 -42.0 1.6 8.5 50.3 A A 17 20 A I H X S+ 0 0 2 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.919 109.6 52.5 -66.1 -45.3 2.8 11.7 52.0 A A 18 21 A A H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.932 111.8 46.7 -55.9 -50.2 0.8 14.0 49.5 A A 19 22 A H H X S+ 0 0 73 -4,-2.3 4,-3.1 1,-0.2 5,-0.2 0.941 112.0 49.6 -58.7 -49.7 -2.4 12.0 50.2 A A 20 23 A E H X S+ 0 0 36 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.847 110.4 51.7 -59.4 -35.3 -1.9 12.1 54.0 A A 21 24 A M H X S+ 0 0 0 -4,-2.4 4,-1.3 2,-0.2 7,-0.4 0.928 113.0 44.6 -66.6 -42.1 -1.3 15.9 53.7 A A 22 25 A I H <>S+ 0 0 22 -4,-2.2 5,-2.8 1,-0.2 6,-0.3 0.910 115.4 47.7 -66.4 -42.2 -4.5 16.3 51.8 A A 23 26 A E H <5S+ 0 0 138 -4,-3.1 3,-0.3 1,-0.2 -1,-0.2 0.825 119.0 37.9 -69.9 -36.8 -6.5 14.0 54.2 A A 24 27 A R H <5S+ 0 0 129 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.558 118.3 46.6 -93.7 -11.9 -5.3 15.6 57.4 A A 25 28 A N T ><5S- 0 0 4 -4,-1.3 3,-2.2 -5,-0.2 4,-0.5 -0.214 113.2 -99.0-125.3 42.0 -5.2 19.3 56.3 A A 26 29 A K G > 5S- 0 0 182 -3,-0.3 3,-1.1 1,-0.3 -3,-0.2 0.866 89.6 -42.8 45.4 51.8 -8.6 19.8 54.5 A A 27 30 A G G 3 S- 0 0 17 27,-1.2 4,-1.8 -2,-0.4 5,-0.2 0.140 101.5 -75.4 76.3 157.4 18.1 21.5 53.2 A A 38 41 A T H > S+ 0 0 60 28,-0.2 4,-1.4 1,-0.2 3,-0.3 0.941 133.4 37.9 -50.6 -57.2 18.7 21.3 49.5 A A 39 42 A R H > S+ 0 0 66 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.772 109.6 62.1 -74.0 -18.8 16.8 18.1 48.9 A A 40 43 A G H > S+ 0 0 0 -4,-0.4 4,-2.4 2,-0.2 -1,-0.2 0.888 103.4 51.3 -69.7 -37.1 14.1 19.0 51.4 A A 41 44 A I H X S+ 0 0 10 -4,-1.8 4,-1.7 -3,-0.3 -2,-0.2 0.917 111.2 47.3 -64.1 -40.9 13.3 22.0 49.1 A A 42 45 A Y H X S+ 0 0 65 -4,-1.4 4,-2.4 2,-0.2 -2,-0.2 0.897 111.5 49.7 -67.3 -43.7 13.1 19.7 46.0 A A 43 46 A L H X S+ 0 0 1 -4,-2.4 4,-3.2 2,-0.2 5,-0.2 0.907 108.2 54.4 -62.2 -42.0 10.8 17.2 47.9 A A 44 47 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.903 109.6 47.9 -57.7 -42.0 8.6 20.1 49.0 A A 45 48 A K H X S+ 0 0 97 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.897 111.3 49.8 -66.7 -40.1 8.3 21.1 45.3 A A 46 49 A R H X S+ 0 0 25 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.943 113.0 46.7 -63.7 -44.2 7.5 17.5 44.3 A A 47 50 A L H X S+ 0 0 2 -4,-3.2 4,-2.8 2,-0.2 5,-0.2 0.880 110.5 52.2 -63.8 -43.0 4.8 17.3 47.0 A A 48 51 A A H X S+ 0 0 8 -4,-2.5 4,-2.1 -5,-0.2 -1,-0.2 0.920 111.4 48.4 -58.8 -39.7 3.3 20.6 46.0 A A 49 52 A E H X S+ 0 0 128 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.938 112.5 47.0 -66.4 -46.1 3.1 19.3 42.4 A A 50 53 A R H X S+ 0 0 39 -4,-2.6 4,-0.6 1,-0.2 -2,-0.2 0.908 113.0 48.9 -61.9 -44.2 1.5 16.1 43.5 A A 51 54 A I H X S+ 0 0 0 -4,-2.8 4,-3.3 1,-0.2 3,-0.4 0.864 112.5 48.8 -64.9 -37.1 -1.0 17.8 45.7 A A 52 55 A E H X S+ 0 0 85 -4,-2.1 4,-3.2 -5,-0.2 5,-0.3 0.941 107.6 53.1 -69.2 -45.4 -1.9 20.3 42.9 A A 53 56 A Q H < S+ 0 0 143 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.618 119.3 37.6 -66.7 -9.6 -2.3 17.5 40.3 A A 54 57 A I H < S+ 0 0 76 -4,-0.6 -2,-0.2 -3,-0.4 -1,-0.2 0.792 126.7 33.9-103.6 -44.8 -4.8 15.9 42.8 A A 55 58 A E H < S- 0 0 60 -4,-3.3 -3,-0.2 2,-0.2 -2,-0.2 0.582 91.5-134.6 -85.4 -20.6 -6.5 19.1 44.2 A A 56 59 A G S < S+ 0 0 64 -4,-3.2 -4,-0.1 -5,-0.2 -3,-0.1 0.716 76.5 103.6 69.5 17.0 -6.4 21.2 41.1 A A 57 60 A N S S- 0 0 86 -6,-0.3 -2,-0.2 -5,-0.3 -1,-0.2 -0.995 75.9-116.4-130.8 135.8 -5.2 24.0 43.4 A A 58 61 A P - 0 0 101 0, 0.0 2,-0.5 0, 0.0 -9,-0.1 -0.347 22.2-141.6 -71.6 154.9 -1.6 25.2 43.6 A A 59 62 A V - 0 0 19 -11,-0.1 2,-0.3 -14,-0.1 -27,-0.1 -0.974 17.9-121.6-119.0 129.4 0.4 24.8 46.9 A A 60 63 A T - 0 0 51 -2,-0.5 -27,-2.4 -29,-0.5 2,-0.4 -0.544 27.5-160.3 -71.6 134.1 2.7 27.5 48.0 A A 61 64 A V E +d 33 0B 31 -2,-0.3 2,-0.3 -29,-0.2 -27,-0.2 -0.937 12.8 174.1-118.9 136.0 6.3 26.4 48.5 A A 62 65 A G E -d 34 0B 0 -29,-2.5 -27,-2.4 -2,-0.4 2,-0.3 -0.775 12.5-147.5-129.4 178.9 9.0 28.2 50.6 A A 63 66 A E E -dE 35 79B 56 16,-1.4 16,-0.9 -29,-0.3 2,-0.4 -0.996 17.7-164.0-156.3 152.3 12.5 27.3 51.6 A A 64 67 A I E -dE 36 78B 1 -29,-2.1 -27,-1.2 -2,-0.3 2,-1.0 -0.982 19.1-153.0-132.1 115.5 15.1 27.7 54.3 A A 65 68 A D E + 0 0B 61 12,-1.6 11,-1.5 -2,-0.4 12,-0.5 -0.843 33.2 151.7 -99.7 103.2 18.6 26.9 53.1 A A 66 69 A I E - E 0 75B 2 -2,-1.0 2,-0.3 9,-0.2 -28,-0.2 -0.866 46.8-112.5-119.0 157.4 20.4 25.7 56.1 A A 67 70 A T - 0 0 83 7,-0.8 3,-0.1 -2,-0.3 -30,-0.0 -0.716 41.8 -96.5 -93.3 145.7 23.3 23.3 56.0 A A 68 71 A L - 0 0 91 -2,-0.3 6,-0.1 1,-0.1 -1,-0.1 -0.333 53.9 -84.3 -58.6 142.5 22.8 19.9 57.6 A A 69 72 A Y 0 0 37 1,-0.2 -1,-0.1 4,-0.1 29,-0.1 -0.300 360.0 360.0 -52.3 120.5 24.0 19.5 61.2 A A 70 73 A R 0 0 253 -3,-0.1 -1,-0.2 -2,-0.0 -2,-0.1 -0.151 360.0 360.0 58.3 360.0 27.7 18.7 61.1 A A 71 ! 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 72 84 A E 0 0 101 1,-0.1 2,-0.3 28,-0.1 29,-0.1 0.000 360.0 360.0 360.0 146.5 24.6 23.8 65.2 A A 73 85 A P - 0 0 10 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.431 360.0-143.8 -63.3 120.9 23.0 24.3 61.7 A A 74 86 A L - 0 0 66 -2,-0.3 -7,-0.8 -6,-0.1 2,-0.4 -0.754 8.1-131.8 -93.1 130.8 23.2 28.0 60.8 A A 75 87 A V E -E 66 0B 59 -2,-0.4 -9,-0.2 -9,-0.2 3,-0.1 -0.687 17.9-173.5 -81.3 128.5 20.4 29.5 58.8 A A 76 88 A K E - 0 0B 154 -11,-1.5 2,-0.3 1,-0.4 -1,-0.2 0.634 61.6 -72.0 -91.3 -23.6 21.6 31.6 55.8 A A 77 89 A G E - 0 0B 35 -12,-0.5 -12,-1.6 -3,-0.1 -1,-0.4 -0.878 42.4-107.5 153.2 176.9 18.1 32.8 55.2 A A 78 90 A A E -E 64 0B 44 -2,-0.3 -14,-0.2 -14,-0.2 2,-0.1 -0.457 8.2-158.2-120.1-165.4 14.6 31.9 53.9 A A 79 91 A D E +E 63 0B 94 -16,-0.9 -16,-1.4 -2,-0.2 -2,-0.0 -0.382 21.1 163.2 178.5 83.8 12.5 32.6 50.9 A A 80 92 A I - 0 0 24 -18,-0.3 -18,-0.2 2,-0.1 4,-0.1 -0.938 28.9-150.5-117.5 107.2 8.8 32.2 51.4 A A 81 93 A P S S+ 0 0 91 0, 0.0 2,-0.3 0, 0.0 -19,-0.1 0.450 77.1 48.3 -55.2 -5.2 6.7 34.0 48.6 A A 82 94 A V S S- 0 0 64 -21,-0.0 2,-0.6 -22,-0.0 -2,-0.1 -0.870 94.7 -96.9-133.7 166.3 3.8 34.6 51.0 A A 83 95 A D - 0 0 115 -2,-0.3 30,-0.1 1,-0.1 29,-0.0 -0.788 32.9-162.7 -81.9 119.9 3.2 36.1 54.4 A A 84 96 A I > + 0 0 2 -2,-0.6 3,-2.1 -4,-0.1 32,-0.3 0.369 41.7 132.9 -88.3 5.5 3.0 33.0 56.7 A A 85 97 A T T 3 S+ 0 0 36 1,-0.3 3,-0.1 30,-0.2 -2,-0.1 -0.379 83.3 0.5 -60.9 123.2 1.4 34.7 59.6 A A 86 98 A D T 3 S+ 0 0 116 28,-2.7 2,-0.3 1,-0.3 -1,-0.3 0.659 107.6 121.9 70.1 21.4 -1.6 32.7 60.8 A A 87 99 A Q < - 0 0 54 -3,-2.1 29,-1.1 27,-0.1 30,-1.0 -0.806 68.1-112.6-115.6 152.1 -1.0 30.0 58.3 A A 88 100 A K E -cf 31 117B 62 -58,-0.9 -56,-2.6 -2,-0.3 2,-0.4 -0.706 36.4-166.5 -81.8 130.6 -0.3 26.3 58.7 A A 89 101 A V E -cf 32 118B 0 28,-2.5 30,-1.9 -2,-0.4 2,-0.4 -0.909 11.7-162.7-119.9 143.2 3.2 25.4 57.7 A A 90 102 A I E -cf 33 119B 0 -58,-2.6 -56,-2.9 -2,-0.4 2,-0.3 -0.988 14.1-144.6-126.5 119.0 4.7 22.0 57.1 A A 91 103 A L E -cf 34 120B 0 28,-2.8 30,-2.9 -2,-0.4 2,-0.5 -0.670 12.0-150.8 -80.1 140.6 8.5 21.7 57.0 A A 92 104 A V E +cf 35 121B 3 -58,-2.3 -56,-2.2 -2,-0.3 2,-0.3 -0.968 17.6 178.2-119.0 122.4 9.8 19.1 54.5 A A 93 105 A D E - f 0 122B 2 28,-2.5 30,-1.6 -2,-0.5 3,-0.2 -0.867 27.1-144.9-121.1 151.8 13.1 17.3 55.3 A A 94 106 A D E S+ 0 0B 14 -58,-0.4 30,-2.0 -2,-0.3 2,-0.4 0.947 88.6 11.7 -82.9 -48.5 14.9 14.6 53.3 A A 95 107 A V E - f 0 124B 10 28,-0.2 2,-0.5 27,-0.1 -1,-0.3 -0.986 68.9-149.6-133.0 120.6 16.3 12.6 56.2 A A 96 108 A L E + f 0 125B 4 28,-3.3 30,-2.4 -2,-0.4 31,-0.4 -0.795 39.8 137.7 -90.2 124.9 15.3 13.1 59.8 A A 97 109 A Y S S- 0 0 73 -2,-0.5 -1,-0.1 28,-0.2 33,-0.1 0.225 73.6 -1.8-127.8-100.3 18.1 12.3 62.1 A A 98 110 A T S S- 0 0 6 31,-0.2 32,-2.9 32,-0.1 33,-0.7 0.761 81.6-131.0 -73.1 -25.9 19.1 14.4 65.2 A A 99 111 A G S > S+ 0 0 5 30,-0.2 4,-2.3 31,-0.1 5,-0.2 0.250 74.6 118.6 89.6 -7.8 16.3 16.9 64.6 A A 100 112 A R H > S+ 0 0 8 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.761 73.9 49.0 -64.7 -23.7 18.9 19.8 65.1 A A 101 113 A T H > S+ 0 0 5 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.879 110.4 51.1 -80.6 -40.3 18.4 21.2 61.5 A A 102 114 A V H > S+ 0 0 1 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.913 108.7 52.8 -60.5 -39.9 14.6 21.1 61.9 A A 103 115 A R H X S+ 0 0 15 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.949 110.6 46.1 -62.1 -48.0 15.1 23.0 65.2 A A 104 116 A A H X S+ 0 0 6 -4,-1.6 4,-1.9 1,-0.2 -2,-0.2 0.933 115.3 47.5 -61.5 -39.2 17.1 25.7 63.4 A A 105 117 A G H X S+ 0 0 0 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.873 111.1 50.6 -67.3 -38.2 14.5 25.8 60.6 A A 106 118 A M H X S+ 0 0 0 -4,-2.9 4,-1.9 2,-0.2 -2,-0.2 0.958 107.5 53.7 -64.3 -45.9 11.6 26.0 63.1 A A 107 119 A D H < S+ 0 0 29 -4,-2.9 3,-0.2 1,-0.2 -2,-0.2 0.910 108.1 50.5 -56.3 -46.2 13.3 28.9 65.0 A A 108 120 A A H >X S+ 0 0 19 -4,-1.9 3,-2.2 1,-0.2 4,-1.6 0.959 106.1 54.3 -56.3 -54.3 13.6 30.9 61.7 A A 109 121 A L H 3X S+ 0 0 1 -4,-2.1 4,-1.6 1,-0.3 -1,-0.2 0.843 101.1 59.9 -50.3 -35.9 9.9 30.3 60.8 A A 110 122 A V H 3< S+ 0 0 14 -4,-1.9 -1,-0.3 -3,-0.2 -2,-0.2 0.171 114.7 37.9 -80.1 22.0 9.0 31.8 64.2 A A 111 123 A D H <4 S+ 0 0 135 -3,-2.2 -2,-0.2 0, 0.0 -1,-0.2 0.449 111.2 51.5-141.0 -27.5 10.8 35.0 63.1 A A 112 124 A V H < S- 0 0 85 -4,-1.6 2,-0.3 1,-0.3 -3,-0.2 0.835 133.6 -21.3 -80.6 -38.7 10.1 35.4 59.3 A A 113 125 A G < - 0 0 5 -4,-1.6 -1,-0.3 -5,-0.3 -28,-0.1 -0.830 65.5-110.6-151.9-173.5 6.4 35.1 60.2 A A 114 126 A R - 0 0 158 -2,-0.3 -28,-2.7 -3,-0.1 -4,-0.1 -0.739 36.4-166.0-132.9 81.1 4.2 33.7 62.9 A A 115 127 A P - 0 0 4 0, 0.0 -27,-0.2 0, 0.0 -30,-0.2 -0.347 28.2-124.9 -66.4 152.9 2.5 30.6 61.5 A A 116 128 A S S S- 0 0 45 -29,-1.1 2,-0.3 -32,-0.3 -28,-0.2 0.812 89.3 -8.5 -66.1 -34.4 -0.5 29.2 63.4 A A 117 129 A S E -f 88 0B 19 -30,-1.0 -28,-2.5 2,-0.0 2,-0.4 -0.987 57.1-145.3-160.0 161.6 1.3 25.9 63.4 A A 118 130 A I E -f 89 0B 3 181,-2.1 2,-0.2 -2,-0.3 -28,-0.2 -1.000 17.5-177.7-133.4 129.1 4.3 24.0 62.0 A A 119 131 A Q E -f 90 0B 31 -30,-1.9 -28,-2.8 -2,-0.4 2,-0.4 -0.689 20.1-127.9-115.7 174.5 4.3 20.2 61.2 A A 120 132 A L E -f 91 0B 0 -2,-0.2 16,-2.6 -30,-0.2 17,-1.4 -0.991 19.4-178.4-133.9 125.6 7.1 18.0 59.9 A A 121 133 A A E +fg 92 137B 1 -30,-2.9 -28,-2.5 -2,-0.4 2,-0.4 -0.982 10.7 179.9-118.9 133.0 7.2 15.7 56.8 A A 122 134 A V E -fg 93 138B 1 15,-2.8 17,-1.5 -2,-0.4 -28,-0.2 -0.990 30.1-145.0-135.0 143.2 10.3 13.7 56.1 A A 123 135 A L E S+ 0 0B 2 -30,-1.6 17,-2.1 -2,-0.4 2,-0.4 0.938 92.4 16.2 -68.0 -50.2 11.0 11.2 53.3 A A 124 136 A V E -fg 95 140B 0 -30,-2.0 -28,-3.3 15,-0.2 2,-0.5 -0.983 61.0-164.0-128.4 140.4 13.1 9.1 55.6 A A 125 137 A D E +fg 96 141B 14 15,-2.2 17,-2.9 -2,-0.4 -28,-0.2 -0.997 9.0 177.4-121.6 117.8 13.4 8.9 59.4 A A 126 138 A R - 0 0 8 -30,-2.4 18,-0.5 -2,-0.5 -29,-0.1 0.241 36.9-132.4-103.4 3.0 16.5 7.0 60.5 A A 127 139 A G + 0 0 28 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