==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 04-OCT-00 1FZT . COMPND 2 MOLECULE: PHOSPHOGLYCERATE MUTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SCHIZOSACCHAROMYCES POMBE; . AUTHOR S.UHRINOVA,D.UHRIN,J.NAIRN,N.C.PRICE,L.A.FOTHERGILL-GILMORE . 211 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9937.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 140 66.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 8.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 13 6.2 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 . 1 0.5 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 . 13 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 69 32.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 3.3 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 1 1 0 0 0 0 0 0 1 0 1 0 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 1 1 1 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 . 4 0 0 1 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 1 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 1 1 A M 0 0 101 0, 0.0 155,-0.1 0, 0.0 55,-0.1 0.000 360.0 360.0 360.0 -61.7 0.2 -19.8 -6.5 2 2 A T - 0 0 19 7,-0.2 155,-0.2 1,-0.1 2,-0.2 -0.109 360.0-107.8 -62.0 164.6 0.2 -19.3 -2.7 3 3 A T > - 0 0 101 4,-0.3 3,-1.5 1,-0.1 2,-0.2 -0.504 42.1 -79.7 -93.6 164.5 -0.9 -22.2 -0.4 4 4 A E T 3 S- 0 0 141 1,-0.3 151,-0.3 -2,-0.2 150,-0.1 -0.429 114.9 -1.9 -65.4 129.7 -4.1 -22.4 1.6 5 5 A A T 3 S+ 0 0 80 148,-0.5 -1,-0.3 149,-0.3 194,-0.2 0.866 118.5 104.9 56.5 38.1 -3.9 -20.4 4.8 6 6 A A S < S- 0 0 21 -3,-1.5 2,-0.4 192,-0.1 -1,-0.2 -0.791 85.5 -42.4-136.7 179.2 -0.3 -19.5 3.9 7 7 A P - 0 0 63 0, 0.0 191,-0.3 0, 0.0 -4,-0.3 -0.238 65.4-139.7 -49.0 100.5 1.7 -16.5 2.6 8 8 A N - 0 0 2 -2,-0.4 189,-1.2 144,-0.2 2,-0.5 -0.362 9.6-137.7 -66.7 143.2 -0.5 -15.2 -0.1 9 9 A L E -A 196 0A 20 147,-0.4 149,-2.4 187,-0.2 2,-0.5 -0.912 19.0-175.2-110.5 125.3 1.2 -14.1 -3.3 10 10 A L E -Ab 195 158A 1 185,-2.1 185,-3.8 -2,-0.5 2,-0.5 -0.952 9.9-155.9-122.1 114.0 0.1 -10.9 -5.1 11 11 A V E -Ab 194 159A 0 147,-3.3 149,-1.7 -2,-0.5 2,-0.5 -0.753 7.4-162.6 -92.1 131.1 1.6 -9.9 -8.4 12 12 A L E -Ab 193 160A 3 181,-3.4 181,-1.6 -2,-0.5 2,-0.6 -0.950 5.0-171.3-116.0 123.0 1.6 -6.3 -9.4 13 13 A T - 0 0 2 147,-3.4 2,-0.6 -2,-0.5 149,-0.2 -0.928 5.7-162.3-118.0 111.0 2.2 -5.1 -13.0 14 14 A R B -f 189 0B 43 -2,-0.6 176,-2.3 174,-0.5 149,-0.1 -0.802 30.7-108.6 -94.2 123.2 2.6 -1.4 -13.6 15 15 A H - 0 0 4 -2,-0.6 3,-0.1 147,-0.4 176,-0.1 -0.113 33.9-126.3 -46.8 139.8 2.1 -0.3 -17.2 16 16 A G - 0 0 2 22,-0.3 2,-0.5 173,-0.2 174,-0.1 0.758 60.4 -32.9 -59.5-122.3 5.3 0.7 -18.8 17 17 A E - 0 0 50 18,-0.1 18,-1.4 172,-0.1 21,-0.7 -0.916 58.6-149.0-111.2 130.4 5.6 4.1 -20.5 18 18 A S B >> -G 34 0C 0 -2,-0.5 4,-1.6 16,-0.2 3,-0.6 -0.447 32.0-101.8 -90.5 166.1 2.7 5.8 -22.1 19 19 A E H >> S+ 0 0 114 14,-1.9 4,-1.4 1,-0.3 3,-0.6 0.939 126.2 48.0 -50.7 -53.6 2.8 8.3 -25.1 20 20 A W H 3>>S+ 0 0 85 1,-0.2 5,-1.6 2,-0.2 4,-1.0 0.782 104.2 64.8 -59.3 -26.1 2.3 11.3 -22.8 21 21 A N H X45S+ 0 0 55 -3,-0.6 3,-0.7 1,-0.2 -1,-0.2 0.925 99.0 50.4 -63.0 -45.4 5.1 9.7 -20.6 22 22 A K H <<5S+ 0 0 117 -4,-1.6 -1,-0.2 -3,-0.6 -2,-0.2 0.902 107.0 54.4 -59.4 -41.9 7.6 10.2 -23.4 23 23 A L H 3<5S- 0 0 101 -4,-1.4 -1,-0.3 2,-0.1 -2,-0.2 0.757 111.1-128.3 -63.7 -23.9 6.6 13.8 -23.8 24 24 A N T <<5 + 0 0 68 -4,-1.0 80,-2.3 -3,-0.7 81,-0.4 0.928 59.1 136.4 75.1 48.7 7.3 14.1 -20.0 25 25 A L B < -H 103 0D 29 -5,-1.6 -1,-0.3 78,-0.3 78,-0.2 -0.925 61.8 -87.8-127.8 152.5 4.0 15.7 -19.1 26 26 A F - 0 0 6 76,-2.0 75,-0.8 73,-0.3 77,-0.0 -0.246 37.6-170.4 -56.8 140.1 1.5 15.1 -16.2 27 27 A T + 0 0 23 73,-0.2 2,-0.5 1,-0.1 3,-0.5 0.838 14.3 163.1 -96.2 -84.3 -1.0 12.4 -16.9 28 28 A G S S- 0 0 0 1,-0.2 65,-0.2 67,-0.1 -1,-0.1 -0.869 70.3 -24.1 104.2-127.2 -3.8 12.2 -14.3 29 29 A W S S+ 0 0 94 -2,-0.5 -1,-0.2 68,-0.1 64,-0.1 0.680 101.6 113.2 -97.6 -24.0 -7.0 10.4 -15.0 30 30 A K S S- 0 0 46 -3,-0.5 -2,-0.1 1,-0.1 34,-0.0 -0.052 70.7-123.4 -47.9 150.5 -6.9 10.6 -18.8 31 31 A D - 0 0 80 34,-0.1 -1,-0.1 -4,-0.1 -2,-0.1 -0.797 34.3-172.5-104.9 92.2 -6.4 7.4 -20.7 32 32 A P - 0 0 10 0, 0.0 2,-0.6 0, 0.0 34,-0.2 -0.120 29.6 -98.1 -74.6 176.0 -3.2 7.7 -22.8 33 33 A A - 0 0 41 32,-0.1 -14,-1.9 1,-0.0 -13,-0.1 -0.880 36.6-123.2-103.9 117.6 -2.0 5.2 -25.4 34 34 A L B -G 18 0C 13 -2,-0.6 -16,-0.2 -16,-0.2 2,-0.2 -0.012 28.9-134.9 -50.1 159.2 0.7 2.8 -24.3 35 35 A S > - 0 0 15 -18,-1.4 4,-3.8 1,-0.0 5,-0.2 -0.598 28.6 -90.3-114.8 177.3 4.0 2.8 -26.3 36 36 A E H > S+ 0 0 135 1,-0.2 4,-4.0 2,-0.2 5,-0.3 0.881 128.6 51.4 -53.5 -40.8 6.3 0.2 -27.7 37 37 A T H > S+ 0 0 43 2,-0.2 4,-2.9 3,-0.2 -1,-0.2 0.936 113.1 45.3 -63.1 -44.7 8.3 0.2 -24.5 38 38 A G H > S+ 0 0 0 -21,-0.7 4,-3.8 2,-0.2 -22,-0.3 0.962 119.0 40.8 -62.3 -52.2 5.1 -0.3 -22.6 39 39 A I H X S+ 0 0 50 -4,-3.8 4,-3.8 2,-0.2 5,-0.3 0.975 119.0 45.3 -59.3 -55.8 3.9 -3.0 -24.9 40 40 A K H X S+ 0 0 127 -4,-4.0 4,-3.3 -5,-0.2 -1,-0.2 0.883 115.6 49.6 -54.3 -38.7 7.4 -4.5 -25.2 41 41 A E H X S+ 0 0 46 -4,-2.9 4,-3.9 -5,-0.3 -2,-0.2 0.934 112.3 46.6 -66.2 -46.0 7.5 -4.1 -21.4 42 42 A A H X S+ 0 0 3 -4,-3.8 4,-3.9 2,-0.2 5,-0.2 0.972 116.5 43.7 -59.6 -55.0 4.1 -5.8 -21.0 43 43 A K H X S+ 0 0 64 -4,-3.8 4,-4.0 2,-0.2 5,-0.3 0.958 117.0 46.5 -54.1 -53.5 5.0 -8.6 -23.3 44 44 A L H X S+ 0 0 78 -4,-3.3 4,-2.9 -5,-0.3 -1,-0.2 0.928 113.2 50.9 -54.6 -46.3 8.4 -8.9 -21.7 45 45 A G H X S+ 0 0 2 -4,-3.9 4,-2.9 145,-0.3 -2,-0.2 0.964 113.3 43.6 -56.3 -54.2 6.7 -8.8 -18.4 46 46 A G H X S+ 0 0 0 -4,-3.9 4,-3.3 2,-0.3 5,-0.4 0.955 115.9 47.1 -55.7 -51.4 4.3 -11.5 -19.3 47 47 A E H X S+ 0 0 63 -4,-4.0 4,-2.3 1,-0.3 -1,-0.3 0.850 113.9 50.5 -57.7 -32.7 7.1 -13.5 -20.9 48 48 A R H X S+ 0 0 82 -4,-2.9 4,-1.4 -5,-0.3 -1,-0.3 0.852 112.3 45.8 -72.3 -36.4 9.0 -12.8 -17.7 49 49 A L H X>S+ 0 0 0 -4,-2.9 5,-1.0 -5,-0.2 4,-0.7 0.837 121.4 37.4 -75.4 -34.7 6.0 -13.9 -15.6 50 50 A K H <5S+ 0 0 84 -4,-3.3 -2,-0.2 -5,-0.2 -3,-0.2 0.761 111.3 60.6 -87.2 -28.2 5.5 -17.1 -17.7 51 51 A S H <5S+ 0 0 50 -4,-2.3 -3,-0.2 -5,-0.4 -2,-0.2 0.935 106.5 44.7 -64.4 -48.2 9.2 -17.7 -18.2 52 52 A R H <5S- 0 0 131 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.858 118.5-110.8 -65.1 -36.1 10.0 -18.1 -14.5 53 53 A G T <5 + 0 0 44 -4,-0.7 2,-0.6 1,-0.3 -3,-0.2 0.445 60.4 155.5 117.1 5.1 7.0 -20.3 -14.0 54 54 A Y < - 0 0 11 -5,-1.0 2,-0.3 -6,-0.2 -1,-0.3 -0.525 27.0-158.8 -68.6 114.0 4.8 -17.9 -11.9 55 55 A K - 0 0 82 -2,-0.6 2,-0.4 -5,-0.0 -5,-0.0 -0.681 4.9-137.1 -96.8 148.8 1.2 -19.0 -12.5 56 56 A F + 0 0 15 -2,-0.3 102,-0.1 1,-0.1 3,-0.1 -0.855 22.7 177.0-109.7 143.2 -1.9 -16.8 -11.9 57 57 A D S S+ 0 0 50 100,-0.9 27,-0.7 1,-0.4 2,-0.3 0.752 76.9 4.0-106.2 -41.3 -5.1 -17.7 -10.2 58 58 A I E -cd 84 158A 12 99,-1.3 101,-2.9 25,-0.2 -1,-0.4 -0.988 65.6-153.1-146.1 150.5 -6.9 -14.3 -10.3 59 59 A A E -cd 85 159A 0 25,-4.2 27,-4.0 -2,-0.3 2,-0.4 -0.972 2.3-161.9-131.9 146.3 -6.0 -10.9 -11.8 60 60 A F E +cd 86 160A 3 99,-1.4 101,-2.9 -2,-0.4 2,-0.3 -0.982 14.5 168.5-128.3 135.7 -6.9 -7.3 -11.0 61 61 A T E -cd 87 161A 0 25,-2.9 27,-2.5 -2,-0.4 101,-0.2 -0.834 30.6-104.8-135.3 174.8 -6.7 -4.2 -13.1 62 62 A S E -c 88 0A 0 99,-1.5 27,-0.3 25,-0.3 30,-0.1 -0.304 36.6-103.9 -91.8-180.0 -7.8 -0.6 -13.2 63 63 A A S S+ 0 0 42 25,-1.2 2,-0.4 24,-0.2 26,-0.1 0.099 88.9 105.4 -92.4 22.9 -10.5 1.0 -15.3 64 64 A L S > S- 0 0 5 24,-0.2 4,-4.2 1,-0.1 5,-0.3 -0.839 74.0-132.6-107.5 142.2 -7.9 2.6 -17.5 65 65 A Q H > S+ 0 0 62 -2,-0.4 4,-3.4 1,-0.2 5,-0.5 0.875 105.2 62.2 -56.2 -41.2 -7.0 1.4 -21.1 66 66 A R H > S+ 0 0 4 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.939 119.7 24.7 -51.3 -51.9 -3.3 1.5 -20.3 67 67 A A H > S+ 0 0 1 -3,-0.2 4,-3.0 2,-0.2 5,-0.2 0.871 121.2 56.8 -81.6 -38.3 -3.7 -1.2 -17.6 68 68 A Q H X S+ 0 0 87 -4,-4.2 4,-0.9 2,-0.2 -3,-0.2 0.834 119.9 34.2 -60.5 -31.0 -6.9 -2.6 -19.1 69 69 A K H X S+ 0 0 67 -4,-3.4 4,-2.5 -5,-0.3 -2,-0.2 0.907 113.9 55.7 -86.6 -53.4 -4.7 -3.1 -22.1 70 70 A T H X S+ 0 0 2 -4,-3.0 4,-2.5 -5,-0.5 5,-0.2 0.832 107.7 53.7 -49.5 -34.7 -1.4 -3.9 -20.4 71 71 A C H X S+ 0 0 0 -4,-3.0 4,-4.1 2,-0.2 5,-0.4 0.957 106.4 49.3 -66.5 -50.8 -3.3 -6.7 -18.6 72 72 A Q H X S+ 0 0 85 -4,-0.9 4,-3.5 -5,-0.2 5,-0.2 0.908 113.3 49.0 -54.2 -44.1 -4.6 -8.3 -21.8 73 73 A I H X S+ 0 0 12 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.978 116.9 38.8 -60.2 -58.8 -1.0 -8.2 -23.2 74 74 A I H X S+ 0 0 0 -4,-2.5 4,-4.1 2,-0.2 5,-0.3 0.927 120.8 46.5 -58.5 -45.7 0.6 -9.7 -20.1 75 75 A L H X>S+ 0 0 6 -4,-4.1 5,-1.7 1,-0.2 4,-0.8 0.905 116.7 44.1 -63.4 -41.2 -2.3 -12.1 -19.7 76 76 A E H <5S+ 0 0 108 -4,-3.5 -1,-0.2 -5,-0.4 -2,-0.2 0.766 118.3 46.9 -73.6 -25.4 -2.2 -12.9 -23.4 77 77 A E H <5S+ 0 0 54 -4,-2.5 -2,-0.2 -5,-0.2 -3,-0.2 0.945 105.2 54.6 -80.5 -53.9 1.6 -13.1 -23.2 78 78 A V H <5S- 0 0 9 -4,-4.1 -2,-0.2 -5,-0.2 -1,-0.2 0.773 112.6-121.3 -51.6 -24.8 1.9 -15.3 -20.1 79 79 A G T <5S+ 0 0 41 -4,-0.8 -3,-0.2 -5,-0.3 -1,-0.1 0.752 86.3 100.9 88.0 26.8 -0.4 -17.7 -21.9 80 80 A E > < + 0 0 61 -5,-1.7 3,-1.9 -6,-0.2 -4,-0.1 -0.288 25.7 145.2-138.0 52.2 -3.1 -17.7 -19.4 81 81 A P T 3 + 0 0 74 0, 0.0 4,-0.3 0, 0.0 -5,-0.1 0.835 66.9 75.2 -58.3 -32.3 -5.9 -15.4 -20.6 82 82 A N T 3 S+ 0 0 115 -7,-0.1 3,-0.1 -3,-0.1 -2,-0.0 0.776 75.3 109.5 -50.8 -26.7 -8.5 -17.8 -19.1 83 83 A L S < S- 0 0 16 -3,-1.9 2,-1.2 1,-0.1 -25,-0.2 -0.027 87.1-101.8 -48.3 155.3 -7.4 -16.2 -15.8 84 84 A E E -c 58 0A 125 -27,-0.7 -25,-4.2 1,-0.0 2,-0.9 -0.699 43.2-178.0 -88.3 94.6 -9.9 -14.0 -14.1 85 85 A T E -c 59 0A 32 -2,-1.2 -25,-0.3 -4,-0.3 2,-0.2 -0.816 8.3-168.5 -96.6 102.7 -8.7 -10.5 -14.9 86 86 A I E -c 60 0A 42 -27,-4.0 -25,-2.9 -2,-0.9 2,-0.4 -0.568 10.1-141.7 -91.0 156.3 -11.0 -8.0 -13.1 87 87 A K E -c 61 0A 78 -27,-0.2 2,-0.4 -2,-0.2 -25,-0.3 -0.951 14.4-170.4-119.8 136.7 -11.1 -4.2 -13.7 88 88 A S E -c 62 0A 2 -27,-2.5 -25,-1.2 -2,-0.4 3,-0.3 -0.986 22.7-159.4-129.9 136.9 -11.6 -1.6 -11.1 89 89 A E S > S+ 0 0 124 -2,-0.4 3,-1.1 -27,-0.3 -1,-0.1 0.789 99.7 59.2 -78.6 -27.8 -12.2 2.2 -11.4 90 90 A K T 3 S+ 0 0 76 1,-0.3 -1,-0.2 50,-0.1 49,-0.1 0.658 94.4 66.5 -73.3 -15.9 -11.0 2.6 -7.8 91 91 A L T 3 S+ 0 0 4 -3,-0.3 -1,-0.3 -30,-0.2 -2,-0.1 0.156 82.2 113.6 -90.9 18.9 -7.7 1.1 -8.9 92 92 A N S < S- 0 0 7 -3,-1.1 2,-0.3 1,-0.1 71,-0.2 -0.031 76.0 -78.8 -78.1-173.5 -7.0 4.1 -11.2 93 93 A E - 0 0 12 -65,-0.2 -1,-0.1 69,-0.1 3,-0.1 -0.681 53.5 -89.8 -92.7 144.8 -4.3 6.8 -10.8 94 94 A R - 0 0 3 -2,-0.3 -66,-0.1 1,-0.1 -1,-0.1 -0.282 54.0-106.2 -52.7 121.7 -4.5 9.6 -8.3 95 95 A Y - 0 0 65 1,-0.1 36,-2.2 37,-0.1 -67,-0.1 -0.090 21.4-152.1 -49.5 148.1 -6.2 12.5 -10.1 96 96 A Y > - 0 0 19 1,-0.3 3,-3.0 34,-0.3 34,-0.4 0.161 21.2-155.7-110.7 16.1 -3.9 15.4 -11.1 97 97 A G G > S- 0 0 4 32,-0.5 3,-0.7 1,-0.3 -1,-0.3 -0.161 72.3 -13.6 47.3-128.8 -6.5 18.1 -11.0 98 98 A D G 3 S+ 0 0 136 30,-1.9 -1,-0.3 1,-0.2 31,-0.1 0.201 124.2 82.4 -88.5 16.1 -5.5 21.0 -13.2 99 99 A L G X + 0 0 4 -3,-3.0 3,-1.4 29,-0.2 2,-0.4 0.683 57.6 113.7 -90.7 -21.1 -1.9 19.7 -13.5 100 100 A Q T < S+ 0 0 51 -3,-0.7 -73,-0.2 -4,-0.4 3,-0.1 -0.344 80.9 27.9 -55.5 108.1 -2.8 17.2 -16.2 101 101 A G T 3 S+ 0 0 44 -75,-0.8 2,-0.5 -2,-0.4 -1,-0.3 0.591 87.5 126.7 112.6 18.1 -0.9 18.5 -19.2 102 102 A L < - 0 0 40 -3,-1.4 -76,-2.0 4,-0.0 -1,-0.3 -0.934 61.7-120.8-112.5 122.0 2.0 20.2 -17.5 103 103 A N B > -H 25 0D 41 -2,-0.5 4,-4.1 -78,-0.2 5,-0.3 -0.352 19.5-127.9 -59.5 129.5 5.6 19.3 -18.5 104 104 A K H > S+ 0 0 45 -80,-2.3 4,-4.1 1,-0.2 5,-0.3 0.852 111.4 55.6 -46.3 -38.4 7.5 18.0 -15.5 105 105 A D H > S+ 0 0 72 -81,-0.4 4,-2.8 2,-0.2 -1,-0.2 0.971 114.2 36.6 -60.2 -55.2 10.2 20.5 -16.4 106 106 A D H > S+ 0 0 79 2,-0.2 4,-2.0 1,-0.2 5,-0.3 0.936 119.2 51.1 -62.8 -46.0 7.7 23.4 -16.2 107 107 A A H X S+ 0 0 0 -4,-4.1 4,-2.3 1,-0.2 3,-0.4 0.949 118.0 37.4 -55.5 -52.0 5.9 21.8 -13.3 108 108 A R H X S+ 0 0 136 -4,-4.1 4,-1.8 -5,-0.3 -1,-0.2 0.809 116.6 54.5 -69.9 -29.5 9.2 21.3 -11.4 109 109 A K H < S+ 0 0 142 -4,-2.8 -2,-0.2 -5,-0.3 -1,-0.2 0.703 119.6 32.7 -76.2 -20.5 10.3 24.7 -12.8 110 110 A K H < S+ 0 0 160 -4,-2.0 -2,-0.2 -3,-0.4 -1,-0.2 0.590 137.0 23.4-108.6 -18.4 7.2 26.3 -11.4 111 111 A W H X>S- 0 0 71 -4,-2.3 5,-1.2 -5,-0.3 4,-1.1 0.443 95.3-148.2-124.8 -8.0 6.7 24.2 -8.3 112 112 A G H X5 - 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