==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-DEC-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 17-SEP-10 3OWC . COMPND 2 MOLECULE: PROBABLE ACETYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR K.A.MAJOREK,M.CHRUSZCZ,A.JOACHIMIAK,W.MINOR,MIDWEST CENTER F . 342 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16795.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 241 70.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 89 26.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.2 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 . 18 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 76 22.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.2 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 0 3 1 1 3 2 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 1 0 0 1 1 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 0 0 0 0 0 1 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 11 A E 0 0 144 0, 0.0 63,-0.5 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 -97.0 35.1 14.0 46.8 2 12 A L E -A 63 0A 21 61,-0.1 2,-0.4 59,-0.0 61,-0.2 -0.655 360.0-165.0 -86.6 137.7 34.0 12.4 43.4 3 13 A Q E -A 62 0A 73 59,-3.4 59,-3.4 -2,-0.3 2,-0.5 -0.980 15.0-142.1-122.1 144.4 36.2 13.1 40.3 4 14 A L E +A 61 0A 23 -2,-0.4 57,-0.2 57,-0.2 66,-0.0 -0.919 28.9 170.1-104.0 126.5 35.5 12.7 36.6 5 15 A V E -A 60 0A 41 55,-2.5 55,-2.4 -2,-0.5 3,-0.1 -0.816 45.5 -76.4-128.5 161.8 38.6 11.4 34.6 6 16 A P E -A 59 0A 94 0, 0.0 53,-0.3 0, 0.0 2,-0.1 -0.386 52.3-114.1 -63.4 137.8 38.9 10.2 31.0 7 17 A F + 0 0 24 51,-2.5 2,-0.3 64,-0.1 51,-0.2 -0.442 41.1 179.9 -62.0 146.4 37.6 6.6 30.6 8 18 A Q > - 0 0 110 -2,-0.1 3,-2.5 -3,-0.1 4,-0.3 -0.969 43.9-109.6-148.3 157.8 40.3 4.2 29.7 9 19 A L G > S+ 0 0 95 -2,-0.3 3,-1.5 1,-0.3 -1,-0.0 0.770 114.1 73.2 -62.3 -27.0 40.5 0.4 29.0 10 20 A G G 3 S+ 0 0 51 1,-0.3 -1,-0.3 2,-0.1 4,-0.1 0.686 99.1 46.6 -56.0 -22.0 42.3 0.1 32.2 11 21 A H G X> S+ 0 0 28 -3,-2.5 4,-2.2 1,-0.1 3,-0.7 0.421 86.5 93.6 -95.4 -7.3 38.9 0.8 33.9 12 22 A F H <> S+ 0 0 21 -3,-1.5 4,-2.8 -4,-0.3 5,-0.2 0.896 78.5 56.0 -60.9 -39.9 37.0 -1.7 31.7 13 23 A P H 3> S+ 0 0 57 0, 0.0 4,-0.8 0, 0.0 -1,-0.2 0.819 109.7 47.4 -65.0 -25.6 37.2 -4.7 34.1 14 24 A I H X4 S+ 0 0 51 -3,-0.7 3,-0.7 2,-0.2 4,-0.4 0.953 113.8 46.7 -74.6 -53.6 35.6 -2.6 36.9 15 25 A L H >< S+ 0 0 2 -4,-2.2 3,-1.9 1,-0.2 4,-0.2 0.901 107.2 57.1 -52.6 -47.6 32.8 -1.4 34.6 16 26 A Q H >< S+ 0 0 71 -4,-2.8 3,-1.1 1,-0.3 21,-0.3 0.820 100.0 60.8 -56.2 -34.2 32.1 -4.9 33.2 17 27 A R T << S+ 0 0 176 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.599 87.3 73.2 -72.0 -13.4 31.5 -6.2 36.7 18 28 A W T < S+ 0 0 17 -3,-1.9 2,-0.5 -4,-0.4 -1,-0.2 0.529 88.8 66.6 -80.7 -6.3 28.6 -3.8 37.4 19 29 A F < + 0 0 9 -3,-1.1 18,-0.3 -4,-0.2 -1,-0.1 -0.960 50.4 172.8-124.3 113.2 26.2 -5.7 35.1 20 30 A A + 0 0 69 -2,-0.5 2,-0.3 16,-0.1 -1,-0.1 0.741 67.0 27.3 -88.7 -28.4 25.1 -9.2 36.1 21 31 A T S > S- 0 0 65 1,-0.1 4,-1.6 13,-0.0 5,-0.1 -0.846 79.9-107.7-133.8 166.7 22.5 -9.8 33.4 22 32 A E H > S+ 0 0 94 -2,-0.3 4,-2.0 1,-0.2 5,-0.2 0.879 117.5 57.0 -58.9 -42.8 21.5 -8.8 29.9 23 33 A K H > S+ 0 0 108 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.889 104.1 51.2 -61.1 -38.3 18.6 -6.8 31.2 24 34 A E H > S+ 0 0 82 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.882 110.7 49.0 -67.0 -38.6 20.9 -4.7 33.4 25 35 A L H X S+ 0 0 0 -4,-1.6 4,-3.0 2,-0.2 5,-0.3 0.883 111.5 50.4 -61.9 -37.5 23.1 -3.9 30.4 26 36 A V H X S+ 0 0 2 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.900 107.2 52.4 -72.7 -45.0 20.0 -3.0 28.3 27 37 A Q H < S+ 0 0 77 -4,-2.6 -1,-0.2 1,-0.2 97,-0.2 0.910 118.7 38.2 -50.9 -44.3 18.7 -0.6 31.0 28 38 A W H < S+ 0 0 27 -4,-1.6 58,-0.4 -5,-0.2 -2,-0.2 0.909 137.3 10.4 -75.2 -45.4 22.1 1.1 31.0 29 39 A A H < S- 0 0 12 -4,-3.0 3,-0.2 1,-0.3 -3,-0.2 0.416 105.9-100.3-129.9 2.2 23.1 1.0 27.3 30 40 A G >< - 0 0 9 -4,-2.5 3,-1.5 -5,-0.3 -1,-0.3 -0.245 49.9 -53.8 95.8 174.1 20.1 -0.1 25.2 31 41 A P T 3 S+ 0 0 21 0, 0.0 -1,-0.1 0, 0.0 121,-0.1 0.502 117.7 70.7 -71.8 -8.2 18.7 -3.2 23.4 32 42 A A T 3 S+ 0 0 49 -3,-0.2 -2,-0.1 -6,-0.1 -6,-0.1 0.741 78.9 103.3 -74.0 -26.8 21.9 -3.9 21.3 33 43 A L < - 0 0 17 -3,-1.5 2,-0.3 -8,-0.1 -7,-0.1 -0.248 49.8-171.1 -69.5 147.6 23.8 -5.0 24.4 34 44 A R - 0 0 114 2,-0.1 4,-0.1 -9,-0.1 7,-0.1 -0.978 32.3 -78.2-134.1 144.2 24.4 -8.6 25.3 35 45 A H S S+ 0 0 83 -2,-0.3 -13,-0.1 2,-0.1 2,-0.1 -0.742 106.0 43.6 -93.4 138.4 25.9 -10.2 28.6 36 46 A P S S- 0 0 77 0, 0.0 -2,-0.1 0, 0.0 -16,-0.1 0.512 92.1-124.1 -76.1 152.1 28.7 -10.2 29.5 37 47 A L - 0 0 2 -21,-0.3 2,-0.3 -18,-0.3 -2,-0.1 -0.349 37.3-171.1 -55.5 138.3 29.8 -6.7 28.5 38 48 A S >> - 0 0 39 -4,-0.1 3,-1.0 1,-0.1 4,-0.9 -0.979 36.7-119.0-138.1 152.7 32.8 -7.0 26.2 39 49 A L G >4 S+ 0 0 64 -2,-0.3 3,-0.9 1,-0.3 4,-0.5 0.864 113.9 63.4 -61.1 -36.3 35.2 -4.5 24.7 40 50 A E G >4 S+ 0 0 163 1,-0.3 3,-1.0 2,-0.2 4,-0.4 0.862 97.6 56.3 -53.5 -37.3 34.0 -5.5 21.3 41 51 A Q G <4 S+ 0 0 53 -3,-1.0 4,-0.3 1,-0.2 -1,-0.3 0.788 109.6 47.2 -69.2 -22.8 30.6 -4.1 22.2 42 52 A X G S+ 0 0 118 -3,-1.0 4,-2.7 -4,-0.5 5,-0.2 0.865 83.0 48.4 -60.6 -44.2 34.3 -0.4 19.9 44 54 A E H > S+ 0 0 142 -4,-0.4 4,-1.9 -3,-0.2 -1,-0.2 0.945 114.1 47.7 -65.7 -43.2 32.0 1.8 17.9 45 55 A D H > S+ 0 0 23 -4,-0.3 4,-1.1 2,-0.2 -2,-0.2 0.926 113.2 47.3 -60.5 -45.4 31.5 4.1 21.0 46 56 A L H >X S+ 0 0 25 -4,-2.4 4,-0.7 1,-0.2 3,-0.6 0.918 108.7 54.3 -66.2 -40.3 35.3 4.3 21.6 47 57 A A H >X S+ 0 0 29 -4,-2.7 3,-1.5 1,-0.3 4,-0.7 0.923 102.3 59.2 -60.3 -36.8 36.0 5.0 17.9 48 58 A E H >< S+ 0 0 49 -4,-1.9 7,-2.3 1,-0.3 3,-0.8 0.868 102.6 53.9 -59.0 -32.6 33.6 7.9 18.2 49 59 A S H << S+ 0 0 31 -4,-1.1 -1,-0.3 -3,-0.6 -2,-0.2 0.622 102.1 57.6 -76.3 -14.8 35.8 9.3 20.9 50 60 A R H << S+ 0 0 137 -3,-1.5 -1,-0.2 -4,-0.7 -2,-0.2 0.488 83.7 104.1 -94.2 -3.4 38.9 9.2 18.7 51 61 A R S << S- 0 0 147 -3,-0.8 5,-0.1 -4,-0.7 -3,-0.0 -0.340 81.3 -99.8 -70.7 158.5 37.3 11.4 16.0 52 62 A R S S+ 0 0 190 1,-0.3 -2,-0.1 2,-0.1 -3,-0.0 -0.948 119.6 23.9-130.5 113.9 38.5 15.1 15.8 53 63 A P S S- 0 0 79 0, 0.0 -1,-0.3 0, 0.0 2,-0.1 0.584 116.3-115.4 -70.6 160.6 36.6 16.7 17.1 54 64 A P - 0 0 25 0, 0.0 -5,-0.2 0, 0.0 3,-0.1 -0.375 19.3-161.1 -69.7 135.6 35.3 13.8 19.3 55 65 A L S S+ 0 0 65 -7,-2.3 20,-2.4 1,-0.2 2,-0.3 0.744 80.7 24.7 -82.0 -31.7 31.7 12.8 18.8 56 66 A R E - B 0 74A 19 -8,-0.7 2,-0.4 18,-0.2 -1,-0.2 -0.983 65.3-159.0-130.8 142.9 31.5 11.0 22.1 57 67 A L E - B 0 73A 51 16,-2.5 16,-2.2 -2,-0.3 2,-0.4 -0.990 11.4-156.0-117.5 134.5 33.4 11.5 25.4 58 68 A L E - B 0 72A 15 -2,-0.4 -51,-2.5 14,-0.2 2,-0.3 -0.928 12.6-170.7-113.9 140.4 33.6 8.6 27.9 59 69 A W E -AB 6 71A 32 12,-3.1 12,-2.1 -2,-0.4 2,-0.4 -0.936 18.7-150.8-134.2 148.1 34.3 9.3 31.6 60 70 A S E -AB 5 70A 2 -55,-2.4 -55,-2.5 -2,-0.3 2,-0.5 -0.943 18.7-142.2-113.2 133.7 35.0 7.2 34.7 61 71 A A E -AB 4 69A 0 8,-2.0 7,-2.4 -2,-0.4 8,-1.6 -0.895 30.4-177.2 -95.9 131.6 33.8 8.8 38.1 62 72 A C E -AB 3 67A 7 -59,-3.4 -59,-3.4 -2,-0.5 2,-0.5 -0.912 33.2-150.7-127.6 154.5 36.4 8.0 40.7 63 73 A R E > S-AB 2 66A 101 3,-2.5 3,-2.2 -2,-0.3 2,-0.2 -0.981 83.0 -47.9-118.1 114.6 36.9 8.6 44.3 64 74 A D T 3 S- 0 0 132 -63,-0.5 -61,-0.1 -2,-0.5 -2,-0.0 -0.452 127.1 -20.7 50.1-122.8 40.7 8.8 44.6 65 75 A D T 3 S+ 0 0 129 -2,-0.2 2,-0.5 -3,-0.1 -1,-0.3 0.499 116.0 104.9 -86.5 -6.6 41.9 5.7 42.6 66 76 A Q E < -B 63 0A 111 -3,-2.2 -3,-2.5 1,-0.0 2,-0.7 -0.700 64.9-141.7 -89.5 124.1 38.6 3.9 42.8 67 77 A V E +B 62 0A 14 -2,-0.5 -5,-0.2 -5,-0.2 3,-0.1 -0.693 32.5 159.8 -81.6 114.6 36.4 3.7 39.9 68 78 A I E + 0 0 16 -7,-2.4 22,-2.7 -2,-0.7 2,-0.3 0.408 57.6 11.4-118.3 -1.5 32.8 4.0 41.1 69 79 A G E -BC 61 89A 0 -8,-1.6 -8,-2.0 20,-0.3 2,-0.3 -0.986 53.2-142.5-165.0 174.6 30.9 5.1 38.0 70 80 A H E +BC 60 88A 1 18,-2.4 18,-2.1 -2,-0.3 2,-0.3 -0.978 19.5 168.6-141.0 148.5 30.7 5.7 34.3 71 81 A C E -B 59 0A 0 -12,-2.1 -12,-3.1 -2,-0.3 2,-0.3 -0.976 14.0-150.9-157.1 159.5 29.2 8.3 32.1 72 82 A Q E -BC 58 85A 1 13,-2.6 13,-2.3 -2,-0.3 2,-0.4 -0.936 3.6-155.3-129.9 156.9 29.1 9.5 28.5 73 83 A L E -BC 57 84A 0 -16,-2.2 -16,-2.5 -2,-0.3 2,-0.5 -0.998 7.4-160.2-126.4 135.2 28.6 12.7 26.5 74 84 A L E -BC 56 83A 31 9,-2.4 9,-3.0 -2,-0.4 2,-0.4 -0.969 18.2-142.5-116.0 130.5 27.5 12.8 22.9 75 85 A F E - C 0 82A 30 -20,-2.4 2,-0.5 -2,-0.5 7,-0.2 -0.795 25.6-178.9-103.5 132.5 28.2 16.0 21.0 76 86 A D E >> + C 0 81A 63 5,-3.2 5,-2.0 -2,-0.4 4,-1.3 -0.843 16.8 171.9-117.3 85.3 26.1 17.8 18.5 77 87 A R T 45S+ 0 0 72 -2,-0.5 3,-0.2 1,-0.2 -1,-0.1 0.875 70.9 63.4 -71.6 -35.6 28.6 20.7 17.8 78 88 A R T 45S+ 0 0 125 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.926 118.2 28.8 -49.4 -44.0 26.6 22.1 14.9 79 89 A N T 45S- 0 0 16 -3,-0.3 -1,-0.2 2,-0.2 -2,-0.2 0.583 107.4-118.9 -97.3 -6.8 23.7 22.8 17.3 80 90 A G T <5 + 0 0 0 -4,-1.3 37,-2.6 1,-0.3 38,-1.5 0.918 68.2 133.6 66.8 48.5 25.6 23.3 20.5 81 91 A V E < -Cd 76 118A 7 -5,-2.0 -5,-3.2 35,-0.2 2,-0.4 -0.982 36.8-167.2-133.3 135.1 23.9 20.4 22.3 82 92 A V E -Cd 75 119A 0 36,-1.9 38,-2.0 -2,-0.4 2,-0.5 -0.984 11.0-147.7-119.8 139.9 25.4 17.6 24.3 83 93 A R E -Cd 74 120A 85 -9,-3.0 -9,-2.4 -2,-0.4 2,-0.3 -0.900 9.8-141.1-107.9 127.2 23.5 14.5 25.4 84 94 A L E +C 73 0A 3 36,-3.0 38,-0.5 -2,-0.5 2,-0.3 -0.700 35.2 162.4 -77.2 140.3 24.2 12.8 28.6 85 95 A A E +C 72 0A 7 -13,-2.3 -13,-2.6 -2,-0.3 -56,-0.1 -0.995 40.3 25.6-155.5 161.5 24.2 9.0 28.4 86 96 A R E + 0 0 51 -58,-0.4 2,-0.3 -2,-0.3 -16,-0.1 0.824 66.7 173.9 56.4 40.0 25.1 5.7 30.0 87 97 A I E + 0 0 26 -16,-0.1 2,-0.3 -59,-0.1 -16,-0.2 -0.610 8.2 153.9 -80.6 128.8 25.3 7.1 33.5 88 98 A V E -C 70 0A 14 -18,-2.1 -18,-2.4 -2,-0.3 2,-0.4 -0.970 32.3-151.0-154.4 147.7 25.8 4.4 36.1 89 99 A L E -C 69 0A 17 -2,-0.3 -20,-0.3 -20,-0.2 5,-0.1 -0.923 41.3 -96.2-112.8 142.4 27.3 4.0 39.6 90 100 A A > - 0 0 4 -22,-2.7 3,-2.7 -2,-0.4 4,-0.5 -0.292 39.8-114.7 -43.4 140.7 28.8 0.8 40.8 91 101 A P G > S+ 0 0 68 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.888 117.4 56.2 -54.2 -36.3 26.2 -1.2 42.7 92 102 A S G 3 S+ 0 0 102 1,-0.3 -2,-0.1 3,-0.0 -24,-0.0 0.509 105.3 52.8 -71.6 -4.7 28.2 -0.8 45.9 93 103 A A G X S+ 0 0 4 -3,-2.7 3,-0.5 -25,-0.1 5,-0.3 0.416 86.0 107.9-108.2 -1.5 28.2 3.0 45.4 94 104 A R T < S+ 0 0 121 -3,-1.5 -4,-0.0 -4,-0.5 0, 0.0 -0.362 72.0 28.5 -77.2 156.0 24.4 3.4 45.1 95 105 A G T 3 S+ 0 0 89 1,-0.1 -1,-0.2 -2,-0.1 -3,-0.0 0.763 91.9 101.1 71.9 26.5 22.2 5.0 47.8 96 106 A Q S < S- 0 0 115 -3,-0.5 -2,-0.1 0, 0.0 -1,-0.1 0.039 100.2-101.9-129.3 23.4 25.1 7.2 49.2 97 107 A G S S+ 0 0 60 1,-0.1 -3,-0.1 3,-0.0 -4,-0.0 0.845 89.2 122.0 47.6 39.9 24.2 10.5 47.6 98 108 A L > + 0 0 3 -5,-0.3 4,-2.2 2,-0.1 5,-0.2 0.604 55.0 77.2 -95.3 -14.2 26.9 10.0 44.9 99 109 A G H > S+ 0 0 14 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.952 97.0 42.7 -56.9 -55.4 24.3 10.4 42.0 100 110 A L H > S+ 0 0 30 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.909 111.9 51.7 -65.1 -46.8 24.0 14.1 42.3 101 111 A P H > S+ 0 0 27 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.918 110.9 50.5 -54.9 -39.5 27.7 14.8 42.6 102 112 A X H X S+ 0 0 3 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.965 112.0 46.8 -64.0 -44.9 28.3 12.7 39.5 103 113 A L H X S+ 0 0 0 -4,-2.4 4,-3.1 1,-0.2 5,-0.2 0.911 110.5 52.4 -61.0 -39.6 25.7 14.6 37.5 104 114 A E H X S+ 0 0 109 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.924 112.0 45.7 -66.8 -41.3 27.0 18.0 38.7 105 115 A A H X S+ 0 0 26 -4,-2.2 4,-1.9 -5,-0.2 -1,-0.2 0.892 113.6 49.4 -63.8 -40.4 30.5 17.0 37.5 106 116 A L H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.930 110.0 50.5 -70.8 -43.4 29.2 15.7 34.2 107 117 A L H X S+ 0 0 4 -4,-3.1 4,-2.7 2,-0.2 -1,-0.2 0.902 106.1 56.2 -56.4 -45.5 27.2 18.8 33.6 108 118 A A H X S+ 0 0 46 -4,-2.1 4,-0.6 -5,-0.2 -2,-0.2 0.920 110.9 44.8 -52.5 -44.8 30.3 20.9 34.3 109 119 A E H >X S+ 0 0 74 -4,-1.9 3,-0.5 1,-0.2 4,-0.5 0.880 111.2 52.7 -67.7 -39.9 32.1 19.0 31.5 110 120 A A H 3< S+ 0 0 0 -4,-2.5 3,-0.3 1,-0.2 -2,-0.2 0.884 116.5 38.4 -63.1 -42.8 29.2 19.2 29.1 111 121 A F H 3< S+ 0 0 4 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.412 87.3 98.2 -87.1 -1.7 29.0 23.0 29.5 112 122 A A H << S+ 0 0 73 -4,-0.6 2,-0.7 -3,-0.5 -1,-0.2 0.908 72.4 71.1 -51.8 -48.7 32.9 23.6 29.7 113 123 A D S >< S- 0 0 66 -4,-0.5 3,-2.3 -3,-0.3 -1,-0.1 -0.622 83.0-145.8 -72.8 115.8 32.8 24.5 26.0 114 124 A A T 3 S+ 0 0 71 -2,-0.7 -1,-0.2 1,-0.3 -2,-0.1 0.703 93.2 69.2 -57.4 -19.3 31.1 27.9 25.9 115 125 A D T 3 S+ 0 0 104 2,-0.0 2,-0.5 -34,-0.0 -1,-0.3 0.626 78.1 94.1 -75.9 -13.8 29.4 27.0 22.5 116 126 A I < + 0 0 2 -3,-2.3 -35,-0.2 1,-0.1 -36,-0.1 -0.727 43.1 165.5 -80.5 122.8 27.2 24.4 24.2 117 127 A E + 0 0 71 -37,-2.6 48,-2.5 -2,-0.5 2,-0.3 0.511 59.9 38.6-111.9 -12.1 23.9 26.0 25.1 118 128 A R E -dE 81 164A 0 -38,-1.5 -36,-1.9 46,-0.2 2,-0.3 -1.000 54.6-166.1-148.0 140.1 21.8 22.9 25.8 119 129 A V E +dE 82 163A 0 44,-2.8 44,-2.6 -2,-0.3 2,-0.3 -0.943 19.7 175.1-122.6 146.4 22.2 19.6 27.5 120 130 A E E -dE 83 162A 40 -38,-2.0 -36,-3.0 -2,-0.3 2,-0.3 -0.906 10.6-172.0-149.0 166.5 19.7 16.7 27.2 121 131 A L E - 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