==== 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 TRANSFERASE 14-JAN-03 1NNR . COMPND 2 MOLECULE: PROBABLE FOSFOMYCIN RESISTANCE PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR C.L.RIFE,R.E.PHARRIS,M.E.NEWCOMER,R.N.ARMSTRONG . 268 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12389.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 186 69.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 8.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 65 24.3 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 . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.5 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 . 21 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 52 19.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.9 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 5 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 1 3 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 . 0 3 0 1 4 3 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 1 1 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 1 A M 0 0 77 0, 0.0 204,-0.5 0, 0.0 207,-0.1 0.000 360.0 360.0 360.0 -65.1 7.9 28.3 48.3 2 2 A L - 0 0 12 159,-0.3 202,-0.3 202,-0.1 176,-0.1 -0.260 360.0-165.4 -60.4 150.2 10.1 28.1 45.1 3 3 A T - 0 0 89 200,-1.8 176,-0.4 1,-0.4 2,-0.3 0.596 48.0 -65.7-116.5 -10.9 12.5 25.1 45.2 4 4 A G S S- 0 0 9 199,-0.4 199,-2.0 174,-0.2 2,-0.4 -0.963 79.6 -30.0 150.2-165.7 15.1 25.6 42.5 5 5 A L E -A 202 0A 44 -2,-0.3 197,-0.3 197,-0.3 3,-0.1 -0.755 44.6-177.0 -91.0 127.5 15.2 25.8 38.7 6 6 A N E - 0 0 21 195,-3.7 40,-0.4 -2,-0.4 2,-0.3 0.884 62.7 -24.9 -91.5 -45.5 12.6 23.7 37.0 7 7 A H E -A 201 0A 6 194,-1.4 194,-3.1 38,-0.1 -1,-0.4 -0.980 47.3-132.8-167.2 158.7 13.6 24.3 33.4 8 8 A L E -Ab 200 47A 7 38,-1.9 40,-3.4 -2,-0.3 2,-0.5 -0.978 19.6-161.0-116.5 131.9 15.3 26.6 30.9 9 9 A T E -Ab 199 48A 4 190,-2.8 190,-2.0 -2,-0.4 2,-0.5 -0.974 5.3-170.2-122.7 125.8 13.6 27.5 27.6 10 10 A L E - b 0 49A 0 38,-2.4 40,-2.2 -2,-0.5 2,-0.3 -0.969 20.1-134.1-117.9 123.9 15.6 28.9 24.7 11 11 A A E - b 0 50A 0 -2,-0.5 2,-0.3 38,-0.2 40,-0.2 -0.594 30.6-174.3 -69.4 137.8 14.0 30.3 21.5 12 12 A V E - b 0 51A 0 38,-2.1 40,-3.3 -2,-0.3 3,-0.2 -0.999 27.3-152.2-145.1 140.5 15.8 28.9 18.5 13 13 A A S S+ 0 0 37 -2,-0.3 2,-0.5 1,-0.3 -1,-0.1 0.830 92.6 37.2 -87.3 -27.4 15.4 29.8 14.8 14 14 A D > - 0 0 88 1,-0.2 4,-1.8 38,-0.1 -1,-0.3 -0.931 68.6-168.3-134.3 94.6 16.5 26.4 13.5 15 15 A L H > S+ 0 0 8 -2,-0.5 4,-2.3 -3,-0.2 5,-0.2 0.914 83.4 49.5 -60.7 -50.4 15.3 23.5 15.6 16 16 A P H > S+ 0 0 74 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.898 111.7 49.2 -60.5 -36.7 17.4 20.7 14.1 17 17 A A H > S+ 0 0 37 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.872 112.0 49.4 -67.3 -35.2 20.7 22.6 14.3 18 18 A S H X S+ 0 0 0 -4,-1.8 4,-3.3 2,-0.2 5,-0.3 0.918 112.0 47.0 -67.2 -46.3 20.0 23.5 17.9 19 19 A I H X S+ 0 0 2 -4,-2.3 4,-2.7 -5,-0.2 5,-0.5 0.911 111.2 52.9 -60.6 -44.1 19.2 19.9 18.8 20 20 A A H X S+ 0 0 35 -4,-2.2 4,-2.3 -5,-0.2 5,-0.5 0.919 113.4 43.8 -59.4 -40.3 22.4 18.9 17.0 21 21 A F H X>S+ 0 0 17 -4,-2.3 5,-1.9 3,-0.2 4,-1.6 0.962 118.0 42.1 -71.1 -54.4 24.5 21.4 19.0 22 22 A Y H <5S+ 0 0 0 -4,-3.3 6,-2.0 3,-0.2 4,-0.3 0.959 126.1 34.5 -63.3 -41.0 22.9 20.6 22.4 23 23 A R H X5S+ 0 0 97 -4,-2.7 4,-0.6 -5,-0.3 -2,-0.2 0.939 127.7 31.8 -78.1 -52.0 22.9 16.9 21.9 24 24 A D H <5S+ 0 0 98 -4,-2.3 -3,-0.2 -5,-0.5 -2,-0.1 0.709 132.4 26.4 -83.9 -28.2 26.0 16.2 19.8 25 25 A L T <5S+ 0 0 31 -4,-1.6 -3,-0.2 -5,-0.5 -2,-0.1 0.764 131.0 35.0-100.3 -41.1 28.4 18.9 21.1 26 26 A L T 4 -C 37 0A 36 3,-3.0 3,-1.1 -2,-0.3 231,-0.2 -0.852 55.1 -63.1-159.5-173.4 7.8 18.0 17.8 35 35 A D T 3 S+ 0 0 85 229,-2.0 230,-0.1 -2,-0.3 3,-0.0 0.825 129.5 28.0 -51.7 -43.1 6.7 20.7 15.3 36 36 A Q T 3 S- 0 0 104 228,-0.2 15,-2.7 1,-0.1 2,-0.3 0.169 126.1 -26.3-110.8 11.8 7.4 23.7 17.6 37 37 A G E < -CE 34 50A 0 -3,-1.1 -3,-3.0 13,-0.2 2,-0.3 -1.000 48.4-110.4 170.7-172.1 10.1 22.3 19.9 38 38 A A E -CE 33 49A 0 11,-1.9 11,-2.6 -2,-0.3 2,-0.4 -0.978 15.2-139.6-149.1 154.3 12.2 19.8 21.7 39 39 A Y E +CE 32 48A 7 -7,-2.9 -8,-2.2 -2,-0.3 -7,-1.7 -0.992 27.1 174.2-116.4 126.8 12.9 18.7 25.3 40 40 A L E -CE 30 47A 0 7,-3.5 7,-2.3 -2,-0.4 2,-0.4 -0.844 14.4-149.0-129.6 168.5 16.3 17.8 26.4 41 41 A E E -CE 29 46A 64 -12,-1.9 -12,-2.5 -2,-0.3 2,-0.4 -0.996 14.2-176.9-147.8 133.0 18.1 16.8 29.7 42 42 A L E > S- E 0 45A 7 3,-2.4 3,-2.2 -2,-0.4 2,-0.6 -0.880 73.9 -54.9-127.8 93.8 21.5 17.2 31.2 43 43 A G T 3 S- 0 0 53 -2,-0.4 96,-0.2 1,-0.3 95,-0.0 -0.622 125.6 -17.9 72.9-119.3 21.7 15.5 34.6 44 44 A S T 3 S+ 0 0 117 -2,-0.6 2,-0.4 94,-0.3 -1,-0.3 0.503 114.8 111.0 -97.9 -7.7 18.8 17.0 36.5 45 45 A L E < - E 0 42A 8 -3,-2.2 -3,-2.4 93,-0.1 2,-0.7 -0.598 53.1-157.1 -73.2 127.3 18.6 20.0 34.0 46 46 A W E - E 0 41A 4 -2,-0.4 -38,-1.9 -40,-0.4 2,-0.5 -0.909 11.3-170.8-109.7 104.7 15.5 20.2 31.8 47 47 A L E -bE 8 40A 1 -7,-2.3 -7,-3.5 -2,-0.7 2,-0.4 -0.883 3.1-165.5 -98.8 124.5 16.2 22.3 28.7 48 48 A C E -bE 9 39A 8 -40,-3.4 -38,-2.4 -2,-0.5 2,-0.5 -0.871 5.7-155.8-105.2 139.3 13.2 23.2 26.3 49 49 A L E -bE 10 38A 2 -11,-2.6 -11,-1.9 -2,-0.4 2,-0.6 -0.994 6.8-157.4-114.6 127.7 13.9 24.6 22.8 50 50 A S E -bE 11 37A 21 -40,-2.2 -38,-2.1 -2,-0.5 2,-0.4 -0.940 19.6-127.2-112.3 114.1 11.0 26.7 21.5 51 51 A R E +b 12 0A 82 -15,-2.7 -38,-0.2 -2,-0.6 -40,-0.1 -0.516 41.3 160.7 -70.2 116.9 11.0 26.8 17.7 52 52 A E > - 0 0 44 -40,-3.3 3,-0.8 -2,-0.4 -38,-0.1 -0.822 16.5-179.3-146.0 97.4 10.9 30.5 16.7 53 53 A P T 3 S+ 0 0 60 0, 0.0 -1,-0.1 0, 0.0 -40,-0.1 0.820 80.5 58.9 -77.0 -32.7 12.0 31.3 13.2 54 54 A Q T 3 S+ 0 0 180 2,-0.0 2,-0.4 -41,-0.0 -41,-0.1 0.126 80.8 127.9 -80.2 25.5 11.6 35.2 13.3 55 55 A Y < - 0 0 26 -3,-0.8 -42,-0.1 1,-0.1 -3,-0.1 -0.744 39.2-176.7 -87.5 128.3 14.1 35.0 16.1 56 56 A G - 0 0 86 -2,-0.4 -1,-0.1 1,-0.4 -2,-0.0 0.123 51.2 -92.9-107.4 14.6 17.1 37.4 15.7 57 57 A G - 0 0 14 2,-0.0 -1,-0.4 3,-0.0 49,-0.2 -0.191 52.2 -56.8 99.3 166.8 19.0 36.4 18.8 58 58 A P - 0 0 44 0, 0.0 -3,-0.0 0, 0.0 0, 0.0 -0.514 66.4 -99.8 -70.4 154.6 19.2 37.7 22.4 59 59 A A - 0 0 48 -2,-0.1 2,-1.6 1,-0.1 4,-0.1 -0.121 48.5 -81.3 -71.6 175.6 20.1 41.4 22.7 60 60 A A S S+ 0 0 99 -3,-0.1 2,-0.2 2,-0.1 -1,-0.1 -0.608 85.7 112.8 -92.7 83.1 23.7 42.4 23.6 61 61 A D S S- 0 0 16 -2,-1.6 126,-0.0 2,-0.2 84,-0.0 -0.783 79.7 -95.0-137.2 178.1 23.8 42.0 27.4 62 62 A Y S S+ 0 0 62 -2,-0.2 2,-0.3 123,-0.2 82,-0.1 0.272 71.1 135.4 -86.6 12.4 25.6 39.7 30.0 63 63 A T + 0 0 12 -4,-0.1 45,-0.5 82,-0.1 2,-0.3 -0.463 32.1 152.1 -67.8 120.6 22.6 37.3 30.3 64 64 A H E -iJ 108 144B 2 80,-1.8 80,-2.5 -2,-0.3 2,-0.5 -0.990 44.0-129.0-154.9 165.1 24.1 33.8 30.2 65 65 A Y E -iJ 109 143B 8 43,-1.9 45,-1.8 -2,-0.3 2,-0.5 -0.960 20.6-159.1-126.2 107.3 23.9 30.1 31.2 66 66 A A E -iJ 110 142B 0 76,-2.1 75,-1.8 -2,-0.5 76,-1.5 -0.797 5.2-160.5 -92.7 132.2 26.8 28.3 32.9 67 67 A F E -iJ 111 140B 1 43,-4.0 45,-2.7 -2,-0.5 73,-0.2 -0.846 20.2-115.1-110.4 146.6 27.0 24.5 32.9 68 68 A G E +iJ 112 139B 6 71,-1.6 70,-2.1 -2,-0.4 71,-0.6 -0.467 36.2 164.8 -80.6 148.0 29.1 22.4 35.3 69 69 A I E - J 0 137B 12 43,-1.1 45,-0.3 68,-0.2 2,-0.2 -0.965 38.7-100.4-156.9 149.5 32.1 20.3 34.3 70 70 A A >> - 0 0 45 66,-0.5 3,-2.3 -2,-0.3 4,-1.2 -0.560 30.2-119.2 -74.4 143.3 34.9 18.6 36.3 71 71 A A H >> S+ 0 0 75 1,-0.3 3,-0.6 2,-0.2 4,-0.5 0.847 115.8 56.3 -36.0 -47.5 38.4 20.2 36.3 72 72 A A H 34 S+ 0 0 97 1,-0.2 -1,-0.3 2,-0.1 4,-0.3 0.661 110.7 41.8 -73.7 -15.8 39.8 17.2 34.7 73 73 A D H <> S+ 0 0 64 -3,-2.3 4,-1.8 2,-0.1 -1,-0.2 0.616 89.5 89.7-101.1 -12.8 37.4 17.4 31.7 74 74 A F H S+ 0 0 193 -4,-0.3 4,-1.4 1,-0.2 -1,-0.2 0.807 112.9 53.4 -57.3 -36.0 39.1 18.3 26.3 77 77 A F H X S+ 0 0 5 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.932 111.5 41.6 -67.9 -56.3 35.7 20.2 26.3 78 78 A A H X S+ 0 0 3 -4,-2.1 4,-2.7 2,-0.2 5,-0.3 0.909 113.5 55.3 -54.7 -45.9 37.1 23.7 25.3 79 79 A A H X S+ 0 0 57 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.895 109.5 46.7 -54.0 -40.2 39.4 22.0 22.8 80 80 A Q H X S+ 0 0 67 -4,-1.4 4,-1.6 2,-0.2 -1,-0.2 0.861 111.2 48.1 -77.1 -41.8 36.5 20.3 21.1 81 81 A L H <>S+ 0 0 0 -4,-1.8 5,-2.6 2,-0.2 -1,-0.2 0.920 114.7 47.4 -64.7 -45.1 34.2 23.2 20.9 82 82 A R H ><5S+ 0 0 118 -4,-2.7 3,-1.5 3,-0.2 -2,-0.2 0.892 108.1 55.6 -58.8 -41.1 37.0 25.3 19.5 83 83 A A H 3<5S+ 0 0 88 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.837 108.1 49.9 -62.3 -33.0 37.8 22.5 17.0 84 84 A H T 3<5S- 0 0 126 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.433 120.9-112.8 -85.4 0.4 34.2 22.7 15.9 85 85 A G T < 5 + 0 0 56 -3,-1.5 -3,-0.2 -4,-0.2 -2,-0.1 0.799 51.9 171.0 80.0 29.0 34.5 26.5 15.4 86 86 A V < - 0 0 25 -5,-2.6 2,-0.5 -6,-0.1 -1,-0.2 -0.359 34.8-114.3 -69.0 154.8 32.2 27.5 18.2 87 87 A R - 0 0 160 15,-0.5 15,-2.2 16,-0.1 2,-0.3 -0.842 21.1-147.3 -94.7 130.4 32.3 31.3 18.9 88 88 A E - 0 0 79 -2,-0.5 13,-0.2 13,-0.2 3,-0.1 -0.692 12.7-174.8 -89.9 141.6 33.7 32.6 22.2 89 89 A W + 0 0 55 11,-0.4 2,-0.3 -2,-0.3 12,-0.1 0.531 64.7 27.7-110.0 -8.8 32.2 35.8 23.6 90 90 A K - 0 0 64 10,-0.4 10,-0.6 2,-0.0 2,-0.4 -0.997 64.9-125.6-157.5 142.6 34.4 36.4 26.6 91 91 A Q - 0 0 139 -2,-0.3 2,-0.5 8,-0.1 8,-0.1 -0.787 43.1-109.8 -88.9 135.2 37.9 35.9 28.1 92 92 A N + 0 0 44 -2,-0.4 4,-0.1 6,-0.3 -1,-0.0 -0.545 53.4 150.3 -68.0 115.8 37.8 34.2 31.5 93 93 A R + 0 0 206 -2,-0.5 -1,-0.2 2,-0.1 3,-0.1 0.680 47.0 76.9-118.0 -27.1 38.9 36.6 34.2 94 94 A S S S- 0 0 35 1,-0.2 4,-0.1 2,-0.0 2,-0.0 -0.115 95.2 -62.3 -74.3 176.3 37.0 35.4 37.4 95 95 A E S S+ 0 0 49 24,-0.1 -1,-0.2 2,-0.0 -2,-0.1 -0.320 100.8 26.7 -64.1 141.9 37.8 32.5 39.8 96 96 A G S S- 0 0 23 -3,-0.1 2,-0.2 16,-0.1 18,-0.1 0.167 100.3 -65.6 87.9 154.8 37.6 28.9 38.3 97 97 A D + 0 0 90 16,-0.2 16,-2.8 -4,-0.0 2,-0.3 -0.540 59.7 176.2 -75.2 137.2 38.2 27.8 34.7 98 98 A S E -K 112 0B 10 14,-0.2 2,-0.4 -2,-0.2 -6,-0.3 -0.991 22.5-164.5-142.3 148.6 35.5 29.1 32.4 99 99 A F E -K 111 0B 2 12,-1.7 12,-2.6 -2,-0.3 2,-0.5 -0.989 15.6-154.1-136.7 119.7 34.9 28.9 28.6 100 100 A Y E +K 110 0B 3 -10,-0.6 -11,-0.4 -2,-0.4 -10,-0.4 -0.819 25.2 159.4-104.0 124.1 32.4 31.3 27.2 101 101 A F E -K 109 0B 0 8,-2.3 8,-3.8 -2,-0.5 2,-0.3 -0.977 32.8-124.2-150.0 159.0 30.6 30.3 24.1 102 102 A L E -K 108 0B 26 -15,-2.2 -15,-0.5 -2,-0.3 6,-0.2 -0.809 17.3-137.9-106.9 146.3 27.6 30.9 21.9 103 103 A D > - 0 0 1 4,-1.9 3,-1.7 -2,-0.3 -16,-0.1 -0.280 49.2 -82.5 -89.1 174.2 25.0 28.5 20.7 104 104 A P T 3 S+ 0 0 73 0, 0.0 -86,-0.0 0, 0.0 -92,-0.0 0.756 132.1 46.9 -56.9 -26.8 23.8 28.7 17.1 105 105 A D T 3 S- 0 0 24 -94,-0.1 -94,-0.0 2,-0.1 -87,-0.0 0.426 122.8-102.3 -95.0 -4.0 21.2 31.5 17.9 106 106 A G < + 0 0 20 -3,-1.7 2,-0.2 1,-0.3 -50,-0.0 0.559 64.3 156.6 93.7 11.2 23.7 33.4 20.0 107 107 A H - 0 0 1 1,-0.1 -4,-1.9 -50,-0.0 2,-0.5 -0.489 47.5-119.3 -57.4 125.4 22.6 32.5 23.4 108 108 A R E +iK 64 102B 54 -45,-0.5 -43,-1.9 -2,-0.2 2,-0.2 -0.692 40.5 178.8 -73.5 121.2 25.7 33.0 25.7 109 109 A L E -iK 65 101B 0 -8,-3.8 -8,-2.3 -2,-0.5 2,-0.3 -0.704 10.3-161.4-122.0 166.3 26.7 29.8 27.4 110 110 A E E -iK 66 100B 2 -45,-1.8 -43,-4.0 -2,-0.2 2,-0.5 -0.960 17.7-151.0-156.1 138.8 29.5 28.8 29.7 111 111 A A E -iK 67 99B 0 -12,-2.6 -12,-1.7 -2,-0.3 2,-0.4 -0.962 33.6-174.9-106.6 121.7 31.3 25.8 30.9 112 112 A H E -iK 68 98B 1 -45,-2.7 -43,-1.1 -2,-0.5 2,-0.7 -0.962 26.8-150.4-131.5 135.5 32.6 26.4 34.4 113 113 A V S S+ 0 0 32 -16,-2.8 2,-0.3 -2,-0.4 -16,-0.2 -0.932 71.1 29.1-101.7 111.8 34.7 24.7 37.0 114 114 A G - 0 0 26 -2,-0.7 2,-0.2 -45,-0.3 -45,-0.1 -0.788 68.8-123.4 138.4-162.3 33.6 25.6 40.5 115 115 A D > - 0 0 39 -2,-0.3 4,-1.7 1,-0.1 5,-0.2 -0.839 43.1 -72.0-159.2-173.3 30.5 26.6 42.3 116 116 A L H > S+ 0 0 11 -2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.943 127.3 50.6 -64.6 -42.3 29.0 29.4 44.5 117 117 A R H > S+ 0 0 193 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.847 107.3 51.7 -58.0 -41.2 31.1 28.4 47.6 118 118 A S H > S+ 0 0 39 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.929 114.0 47.6 -65.0 -36.9 34.4 28.3 45.7 119 119 A R H X S+ 0 0 13 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.808 108.9 49.1 -70.7 -43.3 33.5 31.9 44.5 120 120 A L H X S+ 0 0 17 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.935 110.4 54.8 -60.6 -43.8 32.5 33.4 47.8 121 121 A A H X S+ 0 0 33 -4,-2.0 4,-1.2 1,-0.2 -2,-0.2 0.916 111.0 43.1 -56.7 -49.9 35.8 31.9 49.2 122 122 A A H X S+ 0 0 26 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.848 111.9 56.0 -57.8 -40.4 37.8 33.7 46.5 123 123 A C H < S+ 0 0 1 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.887 100.9 56.0 -67.0 -36.1 35.7 36.8 47.0 124 124 A R H < S+ 0 0 152 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.921 115.8 38.8 -61.3 -38.1 36.5 37.0 50.8 125 125 A Q H < S+ 0 0 173 -4,-1.2 -2,-0.2 1,-0.3 -1,-0.2 0.730 134.5 23.0 -85.8 -27.8 40.2 37.0 49.9 126 126 A A S < S- 0 0 69 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 -0.569 86.5-165.8-137.7 74.4 39.8 39.3 46.8 127 127 A P - 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