==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 30-JUL-10 3O7M . COMPND 2 MOLECULE: HYPOXANTHINE PHOSPHORIBOSYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS ANTHRACIS; . AUTHOR A.S.HALAVATY,G.MINASOV,L.SHUVALOVA,I.DUBROVSKA,J.WINSOR,L.PA . 665 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27807.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 448 67.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 111 16.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 77 11.6 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 . 10 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 45 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 56 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 132 19.8 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+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 1 0 4 0 0 4 0 0 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 7 0 4 0 4 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 . 8 4 3 5 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 . 4 4 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 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 2 A N 0 0 183 0, 0.0 2,-0.4 0, 0.0 165,-0.0 0.000 360.0 360.0 360.0 156.7 34.3 64.5 49.4 2 3 A I + 0 0 65 150,-0.1 2,-0.3 163,-0.0 165,-0.2 -0.851 360.0 179.1-105.9 140.8 31.7 64.4 52.1 3 4 A E E -A 166 0A 117 163,-2.5 163,-2.4 -2,-0.4 2,-0.1 -0.985 34.5 -98.3-141.0 153.4 29.0 61.8 52.2 4 5 A I E +A 165 0A 63 -2,-0.3 161,-0.3 161,-0.2 3,-0.1 -0.447 35.7 178.3 -65.0 137.4 26.1 60.9 54.4 5 6 A K E - 0 0 127 159,-2.7 2,-0.3 1,-0.3 -1,-0.2 0.724 55.9 -7.6-104.2 -73.9 26.9 58.1 56.8 6 7 A D E - 0 0 79 158,-0.2 158,-2.5 0, 0.0 2,-0.5 -0.936 60.4-112.8-129.4 157.4 23.9 57.3 59.0 7 8 A T E +A 163 0A 83 -2,-0.3 156,-0.3 156,-0.2 3,-0.2 -0.715 32.7 179.3 -80.2 128.8 20.5 58.7 59.9 8 9 A L E S+ 0 0 40 154,-3.1 2,-0.3 -2,-0.5 155,-0.2 0.770 70.4 13.6-102.2 -36.8 20.8 59.8 63.5 9 10 A I E S-A 162 0A 3 153,-1.9 153,-2.6 4,-0.0 -1,-0.4 -0.950 80.1-136.9-144.1 118.7 17.2 61.2 64.1 10 11 A S > - 0 0 35 -2,-0.3 4,-2.5 151,-0.2 5,-0.2 -0.210 27.4-106.0 -71.3 166.0 14.4 60.4 61.7 11 12 A E H > S+ 0 0 103 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.914 123.0 48.9 -56.6 -45.6 11.8 62.9 60.5 12 13 A E H > S+ 0 0 148 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.915 109.7 50.7 -62.1 -43.8 9.2 61.3 62.7 13 14 A Q H > S+ 0 0 95 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.884 110.3 51.3 -62.7 -39.5 11.5 61.4 65.8 14 15 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.928 110.3 46.9 -62.3 -46.3 12.2 65.0 65.1 15 16 A Q H X S+ 0 0 44 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.903 111.1 52.4 -67.5 -36.1 8.5 65.9 65.0 16 17 A E H X S+ 0 0 121 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.918 113.0 45.3 -61.5 -40.0 7.8 63.9 68.2 17 18 A K H X S+ 0 0 42 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.911 109.3 53.7 -74.2 -39.4 10.5 65.8 70.0 18 19 A V H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.908 109.7 49.0 -58.5 -43.7 9.4 69.2 68.7 19 20 A K H X S+ 0 0 111 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.900 110.3 51.7 -60.2 -43.7 5.9 68.5 70.0 20 21 A E H X S+ 0 0 104 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.901 112.6 44.6 -60.2 -44.2 7.4 67.5 73.4 21 22 A L H X S+ 0 0 10 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.906 111.1 52.9 -69.7 -44.0 9.4 70.7 73.7 22 23 A A H X S+ 0 0 1 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.901 108.5 52.0 -57.8 -42.4 6.5 72.9 72.5 23 24 A L H X S+ 0 0 75 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.899 109.6 48.2 -61.1 -41.4 4.4 71.3 75.2 24 25 A Q H X S+ 0 0 87 -4,-1.7 4,-2.8 2,-0.2 -2,-0.2 0.930 112.6 48.7 -67.3 -41.6 7.0 72.0 77.9 25 26 A I H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.910 109.4 52.4 -60.8 -44.7 7.3 75.6 76.7 26 27 A E H < S+ 0 0 37 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.872 113.2 45.2 -60.0 -38.5 3.5 76.0 76.7 27 28 A R H >< S+ 0 0 150 -4,-2.0 3,-1.2 -5,-0.2 -2,-0.2 0.925 110.9 51.4 -72.6 -43.2 3.4 74.8 80.3 28 29 A D H 3< S+ 0 0 73 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.808 123.9 30.3 -62.9 -28.2 6.4 76.9 81.5 29 30 A F T >< S+ 0 0 11 -4,-1.9 3,-2.4 -5,-0.2 -1,-0.3 -0.055 84.6 164.9-122.2 32.9 4.8 80.0 80.1 30 31 A E T < S+ 0 0 147 -3,-1.2 3,-0.1 1,-0.3 -3,-0.1 -0.241 71.6 9.1 -58.2 129.3 1.1 79.1 80.4 31 32 A G T 3 S+ 0 0 83 1,-0.2 2,-0.3 -5,-0.1 -1,-0.3 0.415 112.6 101.7 81.9 4.3 -1.1 82.1 80.0 32 33 A E S < S- 0 0 65 -3,-2.4 -1,-0.2 -6,-0.2 25,-0.2 -0.796 72.7-110.7-121.5 158.1 1.7 84.4 78.9 33 34 A E - 0 0 96 -2,-0.3 53,-0.5 23,-0.1 2,-0.4 -0.525 32.4-157.1 -77.6 154.2 3.1 85.8 75.7 34 35 A I E -c 58 0B 1 23,-2.5 25,-2.0 -2,-0.2 2,-0.5 -0.976 11.6-149.4-134.5 144.1 6.4 84.5 74.4 35 36 A V E -cd 59 87B 7 51,-2.9 53,-2.7 -2,-0.4 2,-0.6 -0.974 15.5-159.3-110.7 121.7 9.0 86.0 72.1 36 37 A V E -cd 60 88B 1 23,-3.4 25,-2.0 -2,-0.5 2,-0.6 -0.904 5.0-167.9-104.7 121.7 10.9 83.4 70.2 37 38 A I E -cd 61 89B 0 51,-2.6 53,-2.8 -2,-0.6 2,-0.4 -0.950 7.5-155.3-112.6 111.9 14.3 84.5 68.7 38 39 A A E -cd 62 90B 0 23,-2.6 25,-2.1 -2,-0.6 2,-0.8 -0.724 12.5-134.9 -87.6 130.9 15.9 82.2 66.2 39 40 A V E > -c 63 0B 5 51,-2.6 4,-1.2 -2,-0.4 53,-0.2 -0.751 46.3 -93.4 -83.8 113.8 19.6 82.3 65.8 40 41 A L T 4 S+ 0 0 28 23,-2.8 25,-0.3 -2,-0.8 2,-0.2 -0.336 80.8 6.2 -71.7 155.9 20.3 82.3 62.0 41 42 A K T >4 S+ 0 0 40 23,-0.1 3,-1.9 108,-0.1 -1,-0.1 -0.850 119.6 33.6 -99.1 -36.0 20.8 80.4 59.9 42 43 A G T 34 S+ 0 0 5 1,-0.3 3,-0.5 -2,-0.2 4,-0.4 0.602 108.4 61.6 -58.1 -19.7 20.6 76.8 60.9 43 44 A S T 3X S+ 0 0 0 -4,-1.2 4,-2.8 1,-0.2 -1,-0.3 0.517 74.8 95.3 -85.5 -3.2 17.8 77.0 63.5 44 45 A F H <> S+ 0 0 0 -3,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.808 84.6 47.8 -63.7 -31.2 15.2 78.3 61.1 45 46 A V H > S+ 0 0 0 -3,-0.5 4,-2.2 2,-0.2 5,-0.2 0.954 114.0 46.2 -72.2 -48.9 13.6 74.9 60.3 46 47 A F H > S+ 0 0 1 -4,-0.4 4,-3.1 102,-0.4 -2,-0.2 0.907 114.3 49.8 -55.6 -47.1 13.5 73.8 63.9 47 48 A A H X S+ 0 0 0 -4,-2.8 4,-2.6 2,-0.2 5,-0.2 0.917 107.9 52.3 -60.3 -44.8 12.0 77.2 64.8 48 49 A A H X S+ 0 0 0 -4,-2.0 4,-0.8 -5,-0.2 -1,-0.2 0.897 116.4 40.3 -57.8 -44.8 9.4 77.0 62.0 49 50 A D H < S+ 0 0 11 -4,-2.2 4,-0.2 2,-0.2 -2,-0.2 0.896 114.3 52.5 -73.0 -42.8 8.2 73.6 63.3 50 51 A L H >< S+ 0 0 0 -4,-3.1 3,-2.1 -5,-0.2 4,-0.4 0.942 106.8 50.2 -62.2 -49.4 8.5 74.5 67.0 51 52 A I H >< S+ 0 0 0 -4,-2.6 3,-1.0 1,-0.3 -1,-0.2 0.796 99.7 65.7 -63.8 -25.7 6.3 77.6 66.8 52 53 A R T 3< S+ 0 0 23 -4,-0.8 -1,-0.3 -5,-0.2 -2,-0.2 0.535 105.0 45.3 -74.5 -4.8 3.6 75.8 65.0 53 54 A H T < S+ 0 0 63 -3,-2.1 2,-0.7 -4,-0.2 -1,-0.2 0.355 94.4 88.0-112.8 1.1 3.0 73.7 68.1 54 55 A I < - 0 0 0 -3,-1.0 4,-0.1 -4,-0.4 -31,-0.1 -0.904 53.8-175.2-100.8 117.1 3.1 76.6 70.5 55 56 A K + 0 0 127 -2,-0.7 -1,-0.1 -33,-0.1 3,-0.1 0.572 48.9 105.6 -90.5 -10.2 -0.3 78.0 70.9 56 57 A N S S- 0 0 23 1,-0.2 2,-0.4 -23,-0.0 -23,-0.1 -0.206 94.7 -80.8 -58.2 162.1 0.6 80.9 73.2 57 58 A D - 0 0 51 -25,-0.2 -23,-2.5 603,-0.0 2,-0.4 -0.579 64.4-167.8 -62.5 117.3 0.7 84.5 71.6 58 59 A V E -c 34 0B 0 -2,-0.4 604,-0.4 -25,-0.2 2,-0.4 -0.944 22.0-166.6-121.9 135.6 4.1 84.2 70.0 59 60 A T E -c 35 0B 28 -25,-2.0 -23,-3.4 -2,-0.4 2,-0.4 -0.939 16.7-157.1-111.9 141.1 6.3 87.0 68.5 60 61 A I E +c 36 0B 1 599,-0.5 2,-0.3 -2,-0.4 -23,-0.2 -0.957 19.2 158.3-122.4 141.7 9.2 85.8 66.3 61 62 A D E -c 37 0B 2 -25,-2.0 -23,-2.6 -2,-0.4 2,-0.3 -0.932 26.5-126.4-149.2 172.4 12.5 87.5 65.4 62 63 A F E -c 38 0B 5 -2,-0.3 2,-0.4 -25,-0.2 -23,-0.2 -0.923 11.9-164.7-125.3 152.1 15.9 86.6 64.3 63 64 A I E -c 39 0B 0 -25,-2.1 -23,-2.8 -2,-0.3 2,-0.4 -0.977 3.4-163.7-134.2 145.2 19.5 87.3 65.4 64 65 A S E +G 76 0C 15 12,-2.3 11,-2.7 -2,-0.4 12,-1.7 -0.998 16.9 159.0-132.6 131.8 22.7 86.9 63.5 65 66 A A E -G 74 0C 24 -2,-0.4 2,-0.3 -25,-0.3 9,-0.2 -0.940 20.3-160.2-143.1 159.4 26.2 86.8 65.0 66 67 A S E -G 73 0C 53 7,-2.3 7,-3.0 -2,-0.3 2,-0.2 -0.967 14.2-149.5-143.7 131.9 29.6 85.5 64.0 67 68 A S E -G 72 0C 64 -2,-0.3 2,-0.2 5,-0.3 5,-0.2 -0.608 15.7-179.9 -99.8 164.1 32.5 84.9 66.5 68 69 A Y 0 0 86 3,-1.6 -2,-0.0 -2,-0.2 0, 0.0 -0.859 360.0 360.0-148.8 177.8 36.3 85.1 66.0 69 70 A G 0 0 126 -2,-0.2 -1,-0.0 185,-0.0 -2,-0.0 0.651 360.0 360.0 98.6 360.0 39.7 84.7 67.8 70 ! 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 71 78 A K 0 0 68 0, 0.0 -3,-1.6 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0-100.7 34.6 88.0 71.2 72 79 A V E -G 67 0C 4 -5,-0.2 2,-0.4 27,-0.0 -5,-0.3 -0.995 360.0-141.7-141.9 140.0 31.5 87.9 69.0 73 80 A K E -G 66 0C 27 -7,-3.0 -7,-2.3 -2,-0.3 2,-0.6 -0.890 13.6-135.1-107.7 136.6 30.2 90.3 66.4 74 81 A L E +G 65 0C 5 -2,-0.4 176,-0.7 -9,-0.2 -9,-0.3 -0.810 24.4 175.1 -91.3 121.4 26.5 91.1 66.0 75 82 A L E S+ 0 0 71 -11,-2.7 2,-0.3 -2,-0.6 -10,-0.2 0.791 74.5 12.2 -93.5 -38.2 25.5 91.1 62.3 76 83 A K E S-G 64 0C 35 -12,-1.7 -12,-2.3 173,-0.1 -1,-0.3 -0.931 74.2-158.4-145.4 116.5 21.8 91.6 62.6 77 84 A D - 0 0 2 170,-0.7 -15,-0.2 -2,-0.3 2,-0.1 -0.363 33.9 -85.2 -87.3 168.2 20.2 92.7 65.9 78 85 A I - 0 0 0 1,-0.1 -1,-0.1 -2,-0.1 -15,-0.1 -0.471 24.3-160.7 -75.7 151.0 16.6 92.1 66.8 79 86 A D + 0 0 50 -17,-0.1 -1,-0.1 -2,-0.1 -18,-0.1 0.696 65.0 86.6 -96.2 -30.5 13.8 94.5 65.9 80 87 A V S S- 0 0 12 1,-0.1 2,-0.6 2,-0.0 -2,-0.1 -0.280 82.5-108.8 -76.5 160.0 11.2 93.4 68.4 81 88 A N + 0 0 55 1,-0.1 -1,-0.1 2,-0.0 -2,-0.1 -0.765 36.8 167.1 -86.2 121.2 10.8 94.6 72.0 82 89 A I > + 0 0 0 -2,-0.6 3,-2.2 3,-0.1 31,-0.4 0.316 32.7 128.3-112.2 5.7 11.8 92.0 74.6 83 90 A T T 3 S- 0 0 39 1,-0.3 28,-0.2 29,-0.2 3,-0.1 -0.484 89.1 -0.2 -65.8 121.9 11.8 94.4 77.6 84 91 A G T 3 S+ 0 0 45 27,-2.3 -1,-0.3 -2,-0.3 2,-0.2 0.606 113.2 120.5 72.6 15.1 9.7 92.8 80.3 85 92 A K S < S- 0 0 66 -3,-2.2 29,-1.8 26,-0.1 28,-1.3 -0.698 70.9-109.7-112.2 162.5 8.9 89.8 78.0 86 93 A N E - e 0 114B 8 -53,-0.5 -51,-2.9 -2,-0.2 2,-0.5 -0.790 41.4-164.2 -86.4 121.4 9.5 86.1 78.1 87 94 A V E -de 35 115B 0 27,-2.8 29,-2.8 -2,-0.6 2,-0.5 -0.925 18.3-173.2-120.2 130.6 12.2 85.2 75.7 88 95 A I E -de 36 116B 0 -53,-2.7 -51,-2.6 -2,-0.5 2,-0.5 -0.970 13.5-154.6-119.0 119.5 13.2 81.9 74.2 89 96 A V E -de 37 117B 1 27,-2.9 29,-3.1 -2,-0.5 2,-0.5 -0.812 14.1-150.0 -95.3 123.7 16.3 81.8 72.0 90 97 A V E +de 38 118B 0 -53,-2.8 -51,-2.6 -2,-0.5 2,-0.3 -0.853 19.5 172.5-106.7 128.3 16.2 79.0 69.5 91 98 A E E - e 0 119B 26 27,-2.7 29,-1.9 -2,-0.5 30,-0.1 -0.902 34.5-141.1-129.2 158.0 19.4 77.2 68.2 92 99 A D E S- 0 0 22 1,-0.3 29,-2.1 -2,-0.3 2,-0.3 0.914 88.0 -3.6 -81.6 -49.4 20.2 74.2 66.1 93 100 A I E - e 0 121B 34 27,-0.2 2,-0.5 26,-0.1 -1,-0.3 -1.000 55.2-158.0-145.7 144.0 23.2 73.1 68.1 94 101 A I E + e 0 122B 5 27,-1.4 29,-2.6 -2,-0.3 32,-0.2 -0.991 32.6 140.2-121.2 122.6 25.2 74.3 71.1 95 102 A D S S+ 0 0 68 -2,-0.5 33,-0.1 27,-0.2 31,-0.1 0.490 79.6 14.3-122.6 -82.3 28.7 73.0 71.5 96 103 A S S S- 0 0 20 31,-0.2 32,-3.0 1,-0.1 33,-1.1 0.847 83.8-150.4 -64.9 -34.7 31.3 75.6 72.7 97 104 A G > + 0 0 5 30,-0.2 4,-2.2 31,-0.1 5,-0.2 0.473 57.1 123.5 78.8 4.3 28.5 78.0 73.7 98 105 A L H > S+ 0 0 76 2,-0.2 4,-1.8 1,-0.2 5,-0.2 0.958 73.9 42.1 -63.8 -52.2 30.7 81.1 73.1 99 106 A T H > S+ 0 0 31 1,-0.2 4,-2.6 2,-0.2 3,-0.3 0.954 117.4 46.8 -58.9 -50.1 28.4 82.8 70.6 100 107 A L H > S+ 0 0 6 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.829 107.6 56.8 -64.7 -33.6 25.2 82.0 72.6 101 108 A H H X S+ 0 0 60 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.899 110.0 45.6 -62.7 -39.0 26.9 83.2 75.9 102 109 A F H X S+ 0 0 9 -4,-1.8 4,-2.6 -3,-0.3 -2,-0.2 0.928 111.4 52.0 -70.9 -43.2 27.5 86.6 74.3 103 110 A L H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 5,-0.2 0.886 106.7 55.8 -59.7 -37.1 24.0 86.6 72.9 104 111 A K H X S+ 0 0 53 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.927 109.4 43.8 -59.6 -49.4 22.7 85.9 76.4 105 112 A D H X S+ 0 0 67 -4,-1.8 4,-1.3 2,-0.2 -2,-0.2 0.905 113.7 53.0 -62.3 -39.9 24.5 88.9 77.8 106 113 A H H < S+ 0 0 0 -4,-2.6 3,-0.5 1,-0.2 4,-0.4 0.948 111.1 44.9 -61.7 -48.9 23.3 91.0 74.9 107 114 A F H >< S+ 0 0 0 -4,-3.0 3,-1.9 1,-0.2 -1,-0.2 0.886 105.8 61.1 -64.0 -38.3 19.7 90.0 75.4 108 115 A F H >< S+ 0 0 97 -4,-2.3 3,-2.0 1,-0.3 -1,-0.2 0.846 93.7 65.1 -57.9 -28.7 20.0 90.6 79.2 109 116 A M T 3< S+ 0 0 34 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.714 94.4 59.1 -64.5 -22.6 20.8 94.3 78.3 110 117 A H T < S- 0 0 2 -3,-1.9 -1,-0.3 -4,-0.4 -2,-0.2 0.414 110.8-127.0 -81.5 -2.6 17.3 94.6 77.0 111 118 A K < - 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