==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 20-MAR-12 4E8W . COMPND 2 MOLECULE: D-BETA-D-HEPTOSE 7-PHOSPHATE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BURKHOLDERIA CENOCEPACIA; . AUTHOR T.-W.LEE,T.B.VERHEY,M.S.JUNOP . 601 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26726.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 450 74.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 84 14.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 71 11.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.7 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 . 1 0.2 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 . 54 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 58 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 165 27.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.7 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 2 0 0 0 2 0 4 2 0 1 4 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 3 0 0 6 0 3 1 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 0 4 0 2 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 2 0 0 0 0 0 2 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 10 A V 0 0 53 0, 0.0 300,-0.1 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 119.3 29.4 -19.5 -31.7 2 11 A P >> - 0 0 73 0, 0.0 4,-1.6 0, 0.0 3,-1.3 -0.310 360.0-129.6 -56.0 135.5 30.2 -16.0 -30.4 3 12 A R T 34 S+ 0 0 140 1,-0.3 294,-0.0 2,-0.2 0, 0.0 0.596 110.7 54.7 -66.6 -9.6 28.4 -15.3 -27.1 4 13 A E T 34 S+ 0 0 150 2,-0.2 4,-0.4 3,-0.1 -1,-0.3 0.619 101.6 56.8 -95.0 -17.9 27.2 -12.0 -28.7 5 14 A Q T X4 S+ 0 0 60 -3,-1.3 3,-0.6 1,-0.2 -2,-0.2 0.909 114.7 36.7 -76.3 -44.4 25.8 -13.8 -31.8 6 15 A L G >< S+ 0 0 0 -4,-1.6 3,-1.1 1,-0.2 58,-0.3 0.467 99.7 81.2 -85.1 -1.8 23.5 -15.9 -29.7 7 16 A A G 3 S+ 0 0 35 1,-0.2 -1,-0.2 -5,-0.2 -2,-0.2 0.795 96.0 45.1 -69.1 -28.0 23.0 -13.0 -27.3 8 17 A R G < S+ 0 0 161 -3,-0.6 2,-0.7 -4,-0.4 -1,-0.2 0.050 83.7 120.7-104.1 23.5 20.4 -11.7 -29.9 9 18 A S < - 0 0 0 -3,-1.1 55,-2.7 53,-0.1 2,-0.6 -0.815 48.2-163.1 -87.3 113.2 18.8 -15.2 -30.3 10 19 A R E -a 64 0A 85 -2,-0.7 133,-2.4 258,-0.3 134,-1.3 -0.873 8.0-174.4-107.8 115.6 15.2 -14.7 -29.3 11 20 A V E -ab 65 144A 1 53,-2.0 55,-2.6 -2,-0.6 2,-0.9 -0.930 13.9-154.3-112.9 127.6 13.1 -17.8 -28.6 12 21 A L E -ab 66 145A 0 132,-2.5 134,-2.7 -2,-0.5 2,-0.5 -0.845 13.9-161.4 -99.3 100.6 9.4 -17.7 -27.9 13 22 A V E -ab 67 146A 1 53,-3.0 55,-2.9 -2,-0.9 2,-0.4 -0.702 11.7-176.8 -83.8 128.1 8.5 -20.7 -25.7 14 23 A V E +ab 68 147A 4 132,-3.5 134,-3.1 -2,-0.5 2,-0.3 -0.989 30.8 55.4-129.3 133.9 4.8 -21.5 -25.8 15 24 A G E S- b 0 148A 2 53,-1.8 2,-0.6 -2,-0.4 55,-0.4 -0.993 81.2 -3.8 151.4-154.5 2.9 -24.2 -23.9 16 25 A D - 0 0 10 132,-1.7 35,-2.7 -2,-0.3 2,-0.3 -0.633 52.8-164.5 -85.6 114.1 2.1 -25.7 -20.5 17 26 A V E +J 50 0B 2 -2,-0.6 85,-0.4 53,-0.3 2,-0.3 -0.701 17.3 160.9 -95.0 147.8 3.8 -24.2 -17.5 18 27 A M E -J 49 0B 13 31,-1.5 31,-2.8 -2,-0.3 2,-0.5 -0.971 35.8-117.0-157.6 171.3 4.0 -25.9 -14.1 19 28 A L E -Jk 48 103B 0 83,-1.9 85,-2.1 -2,-0.3 2,-0.8 -0.973 16.9-150.5-120.7 121.6 5.7 -26.2 -10.8 20 29 A D E -Jk 47 104B 21 27,-2.4 27,-1.9 -2,-0.5 2,-0.3 -0.827 26.3-178.8 -91.7 110.4 7.5 -29.4 -9.7 21 30 A R E -Jk 46 105B 17 83,-1.9 85,-2.5 -2,-0.8 2,-0.4 -0.843 11.5-163.1-116.6 147.9 7.3 -29.5 -5.9 22 31 A Y E -Jk 45 106B 43 23,-2.6 23,-1.8 -2,-0.3 2,-0.5 -0.993 6.8-161.1-134.9 132.5 8.6 -32.0 -3.4 23 32 A W E -Jk 44 107B 87 83,-3.5 85,-3.4 -2,-0.4 2,-0.5 -0.956 8.1-166.6-112.1 121.4 7.8 -32.8 0.3 24 33 A F E +Jk 43 108B 49 19,-2.5 18,-3.1 -2,-0.5 19,-1.6 -0.929 24.8 152.0-107.4 123.1 10.4 -34.7 2.3 25 34 A G E -Jk 41 109B 4 83,-2.7 85,-0.6 -2,-0.5 2,-0.4 -0.750 42.4-102.5-138.8-178.6 9.2 -36.1 5.6 26 35 A N E -J 40 0B 88 14,-2.5 14,-2.8 -2,-0.2 2,-0.6 -0.937 20.8-161.0-112.1 137.0 9.4 -38.7 8.4 27 36 A V + 0 0 29 -2,-0.4 12,-0.2 12,-0.2 3,-0.1 -0.933 32.8 141.6-118.4 105.0 6.9 -41.5 8.8 28 37 A D + 0 0 150 -2,-0.6 2,-0.2 10,-0.4 -1,-0.1 0.635 62.0 32.0-114.6 -25.7 7.0 -43.0 12.3 29 38 A R S S- 0 0 157 9,-0.4 9,-1.6 7,-0.0 2,-0.4 -0.788 70.4-113.7-132.6 171.2 3.3 -43.8 13.0 30 39 A I B -M 37 0C 102 -2,-0.2 -3,-0.0 7,-0.2 8,-0.0 -0.843 43.8-101.2-102.9 143.4 -0.0 -44.8 11.5 31 40 A S - 0 0 22 5,-2.5 5,-0.1 -2,-0.4 -1,-0.1 -0.275 16.4-137.5 -60.4 145.9 -3.0 -42.4 11.5 32 41 A P S S+ 0 0 118 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.675 103.8 49.1 -76.8 -16.3 -5.7 -42.8 14.1 33 42 A E S S+ 0 0 183 1,-0.2 -2,-0.0 3,-0.1 -3,-0.0 0.753 121.5 10.5 -93.4 -30.1 -8.4 -42.2 11.4 34 43 A A S S- 0 0 38 2,-0.2 2,-2.3 3,-0.0 -3,-0.3 -0.979 77.4-101.8-149.0 157.3 -7.2 -44.6 8.7 35 44 A P S S+ 0 0 127 0, 0.0 -5,-0.0 0, 0.0 0, 0.0 -0.262 85.4 114.1 -74.2 53.0 -4.7 -47.4 8.0 36 45 A V S S- 0 0 71 -2,-2.3 -5,-2.5 -5,-0.1 -2,-0.2 -0.912 71.3-100.1-127.5 151.1 -2.4 -44.9 6.2 37 46 A P B -M 30 0C 73 0, 0.0 2,-0.5 0, 0.0 -7,-0.2 -0.190 27.3-133.1 -62.6 158.4 1.0 -43.5 7.0 38 47 A V - 0 0 41 -9,-1.6 2,-0.7 -7,-0.0 -10,-0.4 -0.983 16.6-157.7-113.1 127.2 1.6 -40.2 8.7 39 48 A V - 0 0 44 -2,-0.5 2,-1.1 -12,-0.2 -12,-0.2 -0.881 5.6-161.3-111.1 103.6 4.2 -38.0 7.0 40 49 A H E -J 26 0B 122 -14,-2.8 -14,-2.5 -2,-0.7 2,-0.3 -0.734 24.6-140.6 -77.9 102.6 5.7 -35.3 9.2 41 50 A V E +J 25 0B 51 -2,-1.1 -16,-0.3 -16,-0.3 3,-0.1 -0.501 26.6 176.9 -72.5 129.4 7.2 -33.0 6.4 42 51 A Q E + 0 0 107 -18,-3.1 2,-0.3 1,-0.3 -17,-0.2 0.688 63.0 5.0-105.5 -26.8 10.6 -31.6 7.3 43 52 A R E -J 24 0B 127 -19,-1.6 -19,-2.5 2,-0.0 2,-0.4 -0.992 55.6-146.4-157.0 160.5 11.5 -29.7 4.1 44 53 A Q E -J 23 0B 82 -2,-0.3 2,-0.3 -21,-0.2 -21,-0.2 -0.998 11.8-174.3-133.4 131.9 10.2 -28.6 0.7 45 54 A E E +J 22 0B 98 -23,-1.8 -23,-2.6 -2,-0.4 2,-0.3 -0.866 8.1 179.1-118.5 158.0 12.0 -28.1 -2.6 46 55 A E E +J 21 0B 47 -2,-0.3 2,-0.3 -25,-0.2 -25,-0.2 -0.989 8.7 177.9-158.4 150.3 10.7 -26.8 -5.9 47 56 A R E -J 20 0B 76 -27,-1.9 -27,-2.4 -2,-0.3 2,-0.2 -0.985 41.6 -86.4-149.8 155.9 11.7 -25.9 -9.4 48 57 A L E -J 19 0B 4 -2,-0.3 2,-0.2 -29,-0.2 -29,-0.2 -0.432 51.3-174.4 -63.7 131.1 10.2 -24.6 -12.7 49 58 A G E > +J 18 0B 1 -31,-2.8 -31,-1.5 -2,-0.2 3,-1.4 -0.698 39.1 16.6-122.8 176.1 8.7 -27.4 -14.7 50 59 A G E >> S-J 17 0B 4 1,-0.3 4,-1.3 -2,-0.2 3,-1.1 -0.328 129.1 -7.8 64.8-142.7 7.0 -27.9 -18.1 51 60 A A H 3> S+ 0 0 0 -35,-2.7 4,-2.2 97,-0.3 -1,-0.3 0.757 130.8 68.8 -56.2 -26.4 7.6 -25.2 -20.7 52 61 A A H <> S+ 0 0 0 -3,-1.4 4,-1.2 -36,-0.3 -1,-0.2 0.882 99.7 45.8 -62.7 -41.2 9.2 -23.1 -17.9 53 62 A N H <> S+ 0 0 9 -3,-1.1 4,-1.3 2,-0.2 -1,-0.2 0.848 109.4 55.8 -71.4 -34.1 12.2 -25.4 -17.7 54 63 A V H X S+ 0 0 1 -4,-1.3 4,-0.9 1,-0.2 3,-0.5 0.929 109.8 45.7 -61.9 -44.3 12.5 -25.4 -21.5 55 64 A A H X S+ 0 0 0 -4,-2.2 4,-0.9 1,-0.2 -1,-0.2 0.770 104.9 63.8 -67.9 -26.4 12.7 -21.6 -21.5 56 65 A R H X S+ 0 0 72 -4,-1.2 4,-1.2 1,-0.2 -1,-0.2 0.848 100.2 52.0 -66.0 -35.4 15.2 -21.8 -18.6 57 66 A N H X S+ 0 0 1 -4,-1.3 4,-0.9 -3,-0.5 -1,-0.2 0.792 99.9 60.8 -73.5 -31.6 17.7 -23.6 -20.8 58 67 A A H <>S+ 0 0 2 -4,-0.9 5,-1.2 1,-0.2 -1,-0.2 0.834 106.2 48.4 -65.5 -32.2 17.6 -21.1 -23.7 59 68 A V H ><5S+ 0 0 32 -4,-0.9 3,-1.9 -3,-0.2 -1,-0.2 0.884 104.5 56.2 -76.7 -40.9 18.8 -18.3 -21.3 60 69 A T H 3<5S+ 0 0 24 -4,-1.2 237,-0.7 1,-0.3 -1,-0.2 0.687 99.3 61.9 -70.0 -17.7 21.8 -20.2 -19.8 61 70 A L T 3<5S- 0 0 2 -4,-0.9 -1,-0.3 235,-0.2 -2,-0.2 0.479 129.1 -96.3 -83.3 -3.1 23.2 -20.8 -23.2 62 71 A G T < 5S+ 0 0 32 -3,-1.9 -3,-0.2 1,-0.3 -2,-0.1 0.173 90.0 110.0 111.6 -15.3 23.5 -17.0 -23.6 63 72 A G < - 0 0 6 -5,-1.2 -1,-0.3 -6,-0.2 2,-0.3 -0.111 66.6-104.3 -87.0-177.4 20.3 -16.4 -25.5 64 73 A Q E -a 10 0A 94 -55,-2.7 -53,-2.0 -58,-0.3 2,-0.3 -0.836 32.1-169.3-109.8 148.3 17.0 -14.7 -24.7 65 74 A A E -ac 11 89A 4 23,-0.5 25,-2.5 -2,-0.3 2,-0.3 -0.993 10.4-162.6-141.0 145.1 13.7 -16.5 -24.0 66 75 A G E -ac 12 90A 0 -55,-2.6 -53,-3.0 -2,-0.3 2,-0.5 -0.941 11.1-148.4-123.2 148.1 10.0 -15.6 -23.6 67 76 A L E -ac 13 91A 0 23,-2.3 25,-2.5 -2,-0.3 2,-0.7 -0.913 9.6-173.7-124.4 107.2 7.3 -17.7 -22.1 68 77 A L E +ac 14 92A 6 -55,-2.9 -53,-1.8 -2,-0.5 2,-0.3 -0.876 38.3 118.7 -95.7 115.7 3.7 -17.6 -23.3 69 78 A C E - c 0 93A 7 23,-1.1 25,-2.8 -2,-0.7 2,-0.4 -0.920 57.6 -98.9-160.2-178.6 1.5 -19.6 -20.9 70 79 A V E + c 0 94A 24 -55,-0.4 -53,-0.3 -2,-0.3 2,-0.2 -0.974 33.6 168.2-121.8 127.5 -1.4 -19.7 -18.5 71 80 A V E - c 0 95A 0 23,-2.4 25,-2.0 -2,-0.4 2,-0.2 -0.753 29.1-115.1-120.7 176.1 -1.1 -19.7 -14.7 72 81 A G E - c 0 96A 2 -2,-0.2 2,-1.2 23,-0.2 26,-0.0 -0.502 30.6 -99.3-103.6 176.7 -3.8 -19.2 -12.0 73 82 A C S S+ 0 0 65 23,-0.6 2,-0.2 26,-0.4 22,-0.0 -0.590 88.2 92.7 -93.1 69.7 -4.4 -16.4 -9.4 74 83 A D S > S- 0 0 55 -2,-1.2 4,-2.1 1,-0.0 5,-0.2 -0.774 90.5 -76.7-145.2-172.1 -2.8 -18.4 -6.6 75 84 A E H > S+ 0 0 107 -2,-0.2 4,-2.2 2,-0.2 5,-0.1 0.918 124.9 46.7 -63.4 -50.0 0.3 -19.1 -4.6 76 85 A P H > S+ 0 0 16 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.837 109.7 58.2 -65.0 -26.9 2.1 -21.4 -7.1 77 86 A G H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.967 107.8 44.3 -59.0 -55.6 1.2 -18.8 -9.7 78 87 A E H X S+ 0 0 120 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.859 111.8 55.9 -53.3 -39.4 3.1 -16.2 -7.7 79 88 A R H X S+ 0 0 74 -4,-2.2 4,-2.8 2,-0.2 -1,-0.2 0.899 105.2 49.1 -66.2 -42.8 5.9 -18.6 -7.2 80 89 A I H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.922 109.5 53.4 -62.1 -44.5 6.4 -19.3 -10.9 81 90 A V H X S+ 0 0 45 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.920 112.4 44.3 -53.8 -47.9 6.5 -15.6 -11.6 82 91 A E H X S+ 0 0 96 -4,-2.1 4,-1.4 1,-0.2 -2,-0.2 0.918 114.1 49.2 -63.4 -45.0 9.2 -15.2 -9.0 83 92 A L H < S+ 0 0 20 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.786 111.6 50.4 -68.0 -28.0 11.1 -18.2 -10.3 84 93 A L H >X>S+ 0 0 0 -4,-2.5 3,-1.6 -5,-0.2 5,-1.4 0.909 107.0 52.9 -73.6 -44.3 10.9 -16.9 -13.8 85 94 A G H 3<5S+ 0 0 61 -4,-2.2 3,-0.4 1,-0.3 -2,-0.2 0.786 108.4 51.4 -61.7 -29.1 12.2 -13.4 -12.9 86 95 A S T 3<5S+ 0 0 86 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.1 0.027 107.5 53.4 -98.3 25.7 15.2 -15.0 -11.2 87 96 A S T <45S- 0 0 17 -3,-1.6 -1,-0.2 2,-0.2 -2,-0.2 0.366 111.7-106.8-138.1 -2.5 16.1 -17.1 -14.2 88 97 A G T <5S+ 0 0 48 -4,-0.5 -23,-0.5 -3,-0.4 2,-0.5 0.536 72.1 137.4 89.4 9.3 16.3 -14.5 -17.0 89 98 A V E < -c 65 0A 5 -5,-1.4 -1,-0.3 -25,-0.1 -23,-0.2 -0.781 53.5-132.0 -94.8 126.0 13.1 -15.6 -18.8 90 99 A T E -c 66 0A 77 -25,-2.5 -23,-2.3 -2,-0.5 2,-0.3 -0.658 28.6-139.4 -74.9 115.2 10.7 -12.9 -20.0 91 100 A P E +c 67 0A 54 0, 0.0 -23,-0.1 0, 0.0 -1,-0.0 -0.562 29.3 173.9 -83.2 138.2 7.2 -13.8 -18.7 92 101 A H E +c 68 0A 20 -25,-2.5 -23,-1.1 -2,-0.3 2,-0.3 -0.536 25.3 167.9-134.2 66.9 4.1 -13.5 -20.9 93 102 A L E -c 69 0A 9 -25,-0.2 2,-0.4 -23,-0.1 -23,-0.2 -0.603 29.9-148.6 -92.7 141.4 1.5 -15.1 -18.7 94 103 A E E -c 70 0A 2 -25,-2.8 -23,-2.4 -2,-0.3 2,-0.5 -0.875 21.5-139.5 -97.2 138.4 -2.2 -15.1 -19.0 95 104 A R E -c 71 0A 29 -2,-0.4 -23,-0.2 -25,-0.2 305,-0.1 -0.876 16.7-172.5-105.2 131.3 -4.0 -15.3 -15.6 96 105 A D E > -c 72 0A 7 -25,-2.0 3,-1.9 -2,-0.5 -23,-0.6 -0.925 8.2-164.9-121.9 102.0 -7.1 -17.5 -15.1 97 106 A P T 3 S+ 0 0 80 0, 0.0 -1,-0.1 0, 0.0 -25,-0.1 0.695 93.5 51.1 -61.3 -19.0 -8.7 -16.8 -11.6 98 107 A A T 3 S+ 0 0 81 -3,-0.1 -26,-0.1 2,-0.1 -3,-0.0 0.519 97.9 85.1 -93.0 -8.9 -10.7 -20.0 -12.1 99 108 A L S < S- 0 0 12 -3,-1.9 2,-0.4 -28,-0.2 -26,-0.4 -0.785 72.8-136.9 -98.6 133.7 -7.7 -22.1 -13.0 100 109 A P - 0 0 42 0, 0.0 21,-0.4 0, 0.0 2,-0.1 -0.771 33.8-108.9 -81.5 130.9 -5.4 -23.8 -10.5 101 110 A T - 0 0 2 -2,-0.4 2,-0.2 1,-0.1 -30,-0.1 -0.409 42.7-103.0 -59.1 128.6 -1.7 -23.3 -11.5 102 111 A T + 0 0 10 -85,-0.4 -83,-1.9 -2,-0.1 2,-0.4 -0.367 53.0 168.0 -60.2 121.8 -0.4 -26.7 -12.6 103 112 A I E -kL 19 119B 9 16,-1.7 16,-1.9 -85,-0.2 2,-0.7 -0.998 28.7-155.0-140.9 133.7 1.7 -28.3 -9.9 104 113 A K E -kL 20 118B 12 -85,-2.1 -83,-1.9 -2,-0.4 2,-0.6 -0.909 19.6-165.4-106.9 104.9 3.1 -31.9 -9.4 105 114 A L E -kL 21 117B 12 12,-3.3 12,-3.2 -2,-0.7 2,-0.5 -0.806 3.2-164.4 -97.5 119.7 3.6 -32.5 -5.7 106 115 A R E -kL 22 116B 36 -85,-2.5 -83,-3.5 -2,-0.6 2,-0.5 -0.890 4.8-156.4 -99.9 128.5 5.7 -35.5 -4.7 107 116 A V E +kL 23 115B 18 8,-2.4 7,-2.7 -2,-0.5 8,-1.1 -0.913 22.0 177.7-102.0 127.6 5.5 -36.7 -1.1 108 117 A L E +kL 24 113B 22 -85,-3.4 -83,-2.7 -2,-0.5 2,-0.3 -0.934 19.0 173.6-130.3 151.2 8.6 -38.6 0.0 109 118 A A E > S+kL 25 112B 7 3,-2.3 3,-0.7 -2,-0.3 -83,-0.1 -0.959 75.9 8.7-148.9 147.0 10.0 -40.3 3.1 110 119 A R T 3 S- 0 0 201 -85,-0.6 3,-0.1 -2,-0.3 -84,-0.1 0.842 130.3 -61.5 52.7 38.2 13.2 -42.4 3.4 111 120 A Q T 3 S+ 0 0 196 1,-0.2 2,-0.3 0, 0.0 -1,-0.2 0.883 117.3 105.9 58.3 43.1 14.2 -41.4 -0.1 112 121 A Q E < S-L 109 0B 124 -3,-0.7 -3,-2.3 0, 0.0 -1,-0.2 -0.983 71.9-113.8-154.6 135.3 11.0 -43.1 -1.5 113 122 A Q E +L 108 0B 106 -2,-0.3 -5,-0.2 -5,-0.2 3,-0.1 -0.441 24.5 177.9 -73.9 143.9 7.8 -41.7 -2.9 114 123 A L E - 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