==== 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 LYASE 09-AUG-10 3OCF . COMPND 2 MOLECULE: FUMARATE LYASE:DELTA CRYSTALLIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BRUCELLA MELITENSIS; . AUTHOR SEATTLE STRUCTURAL GENOMICS CENTER FOR INFECTIOUS DISEASE (S . 1748 9 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 53463.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1328 76.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 20 1.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 84 4.8 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 . 13 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 . 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 . 57 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 213 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 885 50.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 36 2.1 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 5 1 4 2 0 8 0 1 1 2 3 6 0 0 4 1 3 3 0 0 4 8 0 4 0 0 2 RESIDUES PER ALPHA HELIX . 4 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 0 0 PARALLEL BRIDGES PER LADDER . 9 4 0 0 6 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 ANTIPARALLEL BRIDGES PER LADDER . 12 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 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 T 0 0 121 0, 0.0 2,-0.3 0, 0.0 11,-0.1 0.000 360.0 360.0 360.0 159.4 36.4 26.2 -15.3 2 3 A R E -A 13 0A 39 11,-2.1 11,-2.7 9,-0.0 2,-0.5 -0.942 360.0-118.3-125.3 153.7 36.6 29.9 -14.5 3 4 A R E -A 12 0A 162 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.816 32.1-179.9 -98.3 125.9 39.1 31.5 -12.1 4 5 A E E -A 11 0A 10 7,-2.8 7,-1.6 -2,-0.5 2,-0.4 -0.771 11.3-150.0-114.8 168.3 37.9 33.4 -9.0 5 6 A Q E +A 10 0A 141 -2,-0.3 2,-0.2 5,-0.2 5,-0.2 -0.996 15.8 169.8-136.2 137.9 39.6 35.2 -6.2 6 7 A D E > -A 9 0A 18 3,-2.8 3,-1.3 -2,-0.4 -2,-0.0 -0.749 59.0 -75.9-128.9-171.6 38.9 35.9 -2.6 7 8 A S T 3 S+ 0 0 78 1177,-0.3 3,-0.1 1,-0.3 1178,-0.0 0.564 130.3 49.9 -66.1 -8.3 41.1 37.4 0.3 8 9 A L T 3 S- 0 0 75 1,-0.4 2,-0.3 1173,-0.1 -1,-0.3 0.595 119.7 -91.8 -99.4 -17.0 43.0 34.0 0.6 9 10 A G E < -A 6 0A 24 -3,-1.3 -3,-2.8 2,-0.0 -1,-0.4 -0.974 55.6 -34.8 139.6-155.4 43.8 33.6 -3.1 10 11 A E E +A 5 0A 113 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.816 37.1 177.5-116.8 145.5 42.5 31.9 -6.3 11 12 A R E -A 4 0A 69 -7,-1.6 -7,-2.8 -2,-0.3 2,-0.4 -0.975 28.6-122.7-137.3 154.8 40.6 28.8 -7.3 12 13 A D E -A 3 0A 83 -2,-0.3 -9,-0.2 -9,-0.2 -7,-0.0 -0.798 28.9-161.7 -89.7 136.2 39.2 27.3 -10.5 13 14 A I E -A 2 0A 0 -11,-2.7 -11,-2.1 -2,-0.4 8,-0.1 -0.971 31.6 -97.4-122.9 133.8 35.5 26.7 -10.4 14 15 A P > - 0 0 71 0, 0.0 3,-2.0 0, 0.0 0, 0.0 -0.273 37.8-124.7 -50.7 136.5 33.6 24.3 -12.8 15 16 A M T 3 S+ 0 0 60 1,-0.3 106,-0.2 3,-0.0 -2,-0.0 0.747 107.5 52.1 -63.5 -26.6 32.1 26.7 -15.4 16 17 A D T 3 S+ 0 0 75 2,-0.0 -1,-0.3 105,-0.0 2,-0.2 0.407 84.7 110.4 -89.2 -0.6 28.6 25.5 -14.9 17 18 A A < - 0 0 6 -3,-2.0 70,-0.1 1,-0.1 -4,-0.1 -0.555 50.5-164.1 -76.6 138.4 28.6 26.0 -11.1 18 19 A Y S S+ 0 0 23 -2,-0.2 93,-0.4 66,-0.1 -1,-0.1 0.691 72.4 80.8 -87.9 -24.7 26.5 28.8 -9.6 19 20 A F S S- 0 0 29 1,-0.1 2,-0.1 92,-0.1 85,-0.1 -0.348 73.9-144.2 -72.1 164.8 28.4 28.7 -6.3 20 21 A G > - 0 0 0 83,-0.2 4,-1.9 84,-0.1 5,-0.1 -0.301 34.8 -64.9-115.7-158.5 31.8 30.5 -6.1 21 22 A I H > S+ 0 0 3 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.862 124.9 55.2 -61.3 -41.8 35.2 30.2 -4.6 22 23 A Q H > S+ 0 0 32 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.905 110.2 46.3 -63.9 -39.4 34.1 30.6 -0.9 23 24 A T H > S+ 0 0 0 80,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.877 109.6 54.7 -65.9 -39.5 31.7 27.7 -1.3 24 25 A L H X S+ 0 0 30 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.910 108.3 48.9 -62.5 -40.5 34.4 25.6 -3.0 25 26 A R H X S+ 0 0 29 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.926 109.8 52.9 -63.6 -43.2 36.7 26.2 -0.0 26 27 A A H X S+ 0 0 1 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.914 105.2 53.2 -58.2 -45.0 33.8 25.2 2.3 27 28 A V H < S+ 0 0 44 -4,-2.6 4,-0.4 1,-0.2 -1,-0.2 0.923 114.9 43.0 -56.5 -41.3 33.3 21.9 0.4 28 29 A E H < S+ 0 0 59 -4,-1.8 3,-0.4 1,-0.2 -2,-0.2 0.843 116.2 47.4 -70.3 -36.9 37.0 21.2 0.9 29 30 A N H < S+ 0 0 2 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.846 123.0 28.2 -76.9 -31.6 37.1 22.3 4.5 30 31 A F < + 0 0 1 -4,-2.5 2,-0.9 -5,-0.2 3,-0.3 -0.026 65.4 142.1-129.5 31.3 34.0 20.5 5.7 31 32 A S + 0 0 49 -4,-0.4 1218,-0.1 -3,-0.4 -4,-0.1 -0.659 34.2 124.1 -74.5 108.9 33.5 17.3 3.7 32 33 A L + 0 0 0 -2,-0.9 1213,-0.3 3,-0.1 -1,-0.2 0.643 69.2 19.1-135.8 -39.5 32.3 15.2 6.7 33 34 A S S S- 0 0 10 -3,-0.3 1209,-0.1 2,-0.2 3,-0.1 0.476 82.2-123.2-124.4 -12.1 28.9 13.6 6.3 34 35 A D S S+ 0 0 94 1,-0.2 2,-0.6 0, 0.0 -3,-0.1 0.642 78.4 121.1 56.7 19.6 28.1 13.5 2.5 35 36 A V - 0 0 30 3,-0.0 57,-2.7 4,-0.0 58,-0.3 -0.944 46.6-167.4-111.6 112.6 24.9 15.5 3.6 36 37 A A B > -B 91 0B 15 -2,-0.6 3,-2.9 55,-0.3 4,-0.3 -0.534 38.7 -98.1 -95.3 164.4 24.7 18.9 1.9 37 38 A L G > S+ 0 0 2 53,-2.1 3,-1.9 1,-0.3 7,-0.3 0.749 117.7 72.0 -48.7 -32.3 22.5 21.9 2.6 38 39 A N G 3 S+ 0 0 45 50,-1.4 -1,-0.3 1,-0.3 51,-0.1 0.612 85.1 66.7 -65.1 -9.7 20.2 20.7 -0.2 39 40 A H G < S+ 0 0 79 -3,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.543 104.9 44.5 -84.4 -9.2 19.1 17.9 2.2 40 41 A I S X> S+ 0 0 2 -3,-1.9 3,-1.5 -4,-0.3 4,-1.0 -0.594 73.2 167.6-125.6 69.8 17.5 20.6 4.3 41 42 A P H 3> + 0 0 45 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.733 66.7 71.3 -60.6 -21.6 15.9 22.7 1.6 42 43 A A H 3> S+ 0 0 20 1,-0.2 4,-2.2 2,-0.2 111,-0.1 0.844 99.6 47.7 -60.4 -35.7 13.8 24.7 4.1 43 44 A L H <> S+ 0 0 0 -3,-1.5 4,-2.5 -6,-0.2 -1,-0.2 0.849 110.1 52.9 -71.6 -37.6 17.0 26.5 5.2 44 45 A V H X S+ 0 0 0 -4,-1.0 4,-2.4 -7,-0.3 -2,-0.2 0.966 112.7 43.8 -58.8 -51.1 17.9 27.1 1.5 45 46 A R H X S+ 0 0 80 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.901 113.0 52.0 -64.3 -42.2 14.5 28.7 0.9 46 47 A A H X S+ 0 0 0 -4,-2.2 4,-2.9 -5,-0.2 -1,-0.2 0.923 109.6 49.5 -55.6 -46.9 14.7 30.7 4.2 47 48 A L H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.923 110.2 50.2 -61.3 -46.1 18.1 32.0 3.3 48 49 A A H X S+ 0 0 1 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.865 111.5 49.5 -58.5 -39.5 16.9 33.1 -0.2 49 50 A M H X S+ 0 0 5 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.918 109.9 49.9 -65.1 -46.6 13.9 34.8 1.5 50 51 A V H X S+ 0 0 0 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.923 111.8 48.9 -58.1 -43.7 16.2 36.6 3.9 51 52 A K H X S+ 0 0 1 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.842 111.1 49.7 -63.5 -38.8 18.4 37.7 1.0 52 53 A K H X S+ 0 0 45 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.919 111.4 49.7 -63.3 -46.2 15.3 38.9 -0.9 53 54 A A H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.880 112.6 46.9 -57.9 -44.5 14.2 40.9 2.2 54 55 A A H X S+ 0 0 0 -4,-2.4 4,-2.9 2,-0.2 5,-0.2 0.925 110.7 50.1 -67.3 -46.8 17.6 42.5 2.6 55 56 A A H X S+ 0 0 4 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.906 112.5 49.5 -57.3 -39.1 17.9 43.5 -1.1 56 57 A T H X S+ 0 0 8 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.912 113.0 44.3 -69.5 -48.0 14.4 45.1 -1.0 57 58 A A H X S+ 0 0 0 -4,-2.2 4,-1.6 2,-0.2 -2,-0.2 0.936 113.9 51.2 -60.6 -47.0 15.0 47.1 2.2 58 59 A N H <>S+ 0 0 2 -4,-2.9 5,-3.0 2,-0.2 6,-1.1 0.895 113.1 46.7 -54.4 -41.8 18.4 48.1 0.8 59 60 A Y H ><5S+ 0 0 82 -4,-2.3 3,-2.2 -5,-0.2 -2,-0.2 0.954 111.4 48.5 -66.2 -53.5 16.7 49.2 -2.4 60 61 A K H 3<5S+ 0 0 120 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.686 111.2 52.1 -61.5 -22.8 13.9 51.2 -0.8 61 62 A L T 3<5S- 0 0 85 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.265 116.1-118.7 -96.4 9.4 16.5 52.9 1.4 62 63 A R T < 5S+ 0 0 95 -3,-2.2 -3,-0.2 2,-0.2 -2,-0.1 0.729 85.6 112.1 61.4 29.7 18.5 53.9 -1.7 63 64 A Q S > - 0 0 65 0, 0.0 4,-2.5 0, 0.0 3,-0.6 -0.175 26.9-112.6 -60.1 145.5 21.0 50.4 -7.1 66 67 A E H 3> S+ 0 0 128 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.833 111.9 48.9 -45.3 -48.8 17.8 49.5 -9.0 67 68 A P H 3> S+ 0 0 72 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.890 112.6 48.3 -70.3 -31.6 19.3 47.0 -11.5 68 69 A K H <> S+ 0 0 52 -3,-0.6 4,-2.5 2,-0.2 5,-0.2 0.922 113.0 48.8 -68.1 -46.2 21.2 45.1 -8.8 69 70 A Y H X S+ 0 0 56 -4,-2.5 4,-2.6 2,-0.2 5,-0.3 0.962 111.8 48.5 -54.3 -51.4 18.0 44.9 -6.7 70 71 A A H X S+ 0 0 50 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.924 114.8 44.7 -62.0 -40.3 15.9 43.7 -9.5 71 72 A A H X S+ 0 0 5 -4,-2.0 4,-2.1 -5,-0.2 -1,-0.2 0.876 113.7 49.3 -71.0 -40.2 18.3 41.0 -10.6 72 73 A I H X S+ 0 0 1 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.906 112.0 48.7 -63.3 -45.9 19.0 39.8 -7.0 73 74 A V H X S+ 0 0 19 -4,-2.6 4,-2.6 -5,-0.2 -2,-0.2 0.928 109.7 51.1 -61.3 -47.8 15.3 39.6 -6.3 74 75 A A H X S+ 0 0 24 -4,-2.4 4,-1.8 -5,-0.3 -1,-0.2 0.919 112.1 48.9 -53.8 -46.7 14.6 37.6 -9.5 75 76 A A H X S+ 0 0 0 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.936 110.7 48.4 -60.9 -49.4 17.4 35.2 -8.5 76 77 A C H X S+ 0 0 0 -4,-2.7 4,-2.9 1,-0.2 -1,-0.2 0.864 108.0 56.7 -56.2 -40.9 16.1 34.7 -4.9 77 78 A D H X S+ 0 0 51 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.903 103.3 53.7 -59.9 -43.6 12.6 34.1 -6.4 78 79 A D H <>S+ 0 0 25 -4,-1.8 5,-2.5 2,-0.2 4,-0.4 0.930 112.0 44.3 -55.9 -45.2 14.0 31.3 -8.5 79 80 A I H ><5S+ 0 0 0 -4,-1.7 3,-1.3 1,-0.2 -2,-0.2 0.921 110.9 52.6 -67.4 -46.0 15.5 29.6 -5.4 80 81 A I H 3<5S+ 0 0 23 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.859 108.4 54.3 -54.8 -33.8 12.3 30.2 -3.3 81 82 A D T 3<5S- 0 0 129 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.544 128.8 -97.8 -83.6 -8.3 10.5 28.5 -6.3 82 83 A G T X 5S+ 0 0 41 -3,-1.3 3,-0.5 -4,-0.4 -3,-0.2 0.510 78.1 131.4 111.9 7.1 12.7 25.4 -6.0 83 84 A L T 3 < + 0 0 93 -5,-2.5 -1,-0.4 1,-0.2 -2,-0.1 -0.566 63.6 23.5 -84.8 155.5 15.4 26.0 -8.6 84 85 A L T > + 0 0 15 -2,-0.2 3,-1.8 1,-0.1 4,-0.2 0.609 69.9 139.3 68.2 19.5 19.1 25.6 -8.1 85 86 A M G X + 0 0 35 -3,-0.5 3,-1.9 1,-0.3 -2,-0.1 0.881 69.1 60.6 -57.5 -38.7 18.8 23.3 -5.0 86 87 A E G 3 S+ 0 0 112 1,-0.3 -1,-0.3 -48,-0.1 -48,-0.1 0.579 92.6 66.2 -67.4 -10.8 21.7 21.2 -6.4 87 88 A Q G < S+ 0 0 21 -3,-1.8 2,-1.2 1,-0.1 -1,-0.3 0.513 78.0 89.5 -87.2 -6.7 24.0 24.3 -6.1 88 89 A F < + 0 0 1 -3,-1.9 -50,-1.4 -4,-0.2 -1,-0.1 -0.751 51.5 151.0 -93.5 93.1 23.7 24.3 -2.3 89 90 A V + 0 0 41 -2,-1.2 2,-0.2 -52,-0.2 -1,-0.2 0.405 17.1 118.3-111.0 -3.9 26.6 22.1 -1.6 90 91 A V - 0 0 0 10,-0.1 -53,-2.1 1,-0.1 -52,-0.1 -0.488 69.8-105.6 -76.8 138.2 28.1 22.9 1.7 91 92 A D B > -B 36 0B 10 -55,-0.2 3,-1.6 -65,-0.2 -55,-0.3 -0.315 18.4-127.9 -56.9 140.6 28.1 20.1 4.3 92 93 A V T 3 S+ 0 0 2 -57,-2.7 263,-0.2 1,-0.3 -1,-0.1 0.784 109.4 60.4 -60.4 -24.0 25.5 20.4 7.2 93 94 A F T 3 S+ 0 0 4 -58,-0.3 -1,-0.3 -63,-0.2 1110,-0.2 0.202 79.1 146.7 -91.1 14.3 28.4 19.8 9.7 94 95 A Q < - 0 0 1 -3,-1.6 3,-0.3 257,-0.1 258,-0.2 -0.136 42.7-138.4 -48.2 136.1 30.2 23.0 8.4 95 96 A G S S+ 0 0 0 1,-0.2 5,-0.4 -69,-0.1 3,-0.4 -0.263 74.7 80.2 -77.0-179.7 32.2 25.0 10.9 96 97 A G S > S- 0 0 0 1,-0.2 3,-2.0 3,-0.1 -1,-0.2 0.506 102.6-101.3 98.5 0.4 32.0 28.8 10.7 97 98 A A T 3 S- 0 0 6 251,-0.6 -1,-0.2 1,-0.3 253,-0.1 0.696 90.7 -36.0 59.6 20.6 28.6 29.1 12.6 98 99 A G T >> S+ 0 0 0 -3,-0.4 4,-2.5 250,-0.1 3,-0.9 0.191 105.9 119.0 120.3 -18.1 26.7 29.6 9.4 99 100 A T H <> S+ 0 0 22 -3,-2.0 4,-2.9 1,-0.3 5,-0.2 0.837 77.6 50.3 -49.4 -43.7 29.2 31.6 7.3 100 101 A S H 3> S+ 0 0 9 -5,-0.4 4,-1.9 2,-0.2 -1,-0.3 0.797 110.4 49.5 -75.4 -28.1 29.4 29.0 4.6 101 102 A S H <> S+ 0 0 0 -3,-0.9 4,-2.1 2,-0.2 -1,-0.2 0.901 112.6 48.1 -70.0 -42.2 25.7 28.7 4.3 102 103 A N H X S+ 0 0 1 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.941 115.7 44.0 -61.0 -47.9 25.5 32.5 4.1 103 104 A M H X S+ 0 0 7 -4,-2.9 4,-2.6 2,-0.2 5,-0.2 0.822 108.1 58.0 -69.0 -35.6 28.2 32.6 1.4 104 105 A N H X S+ 0 0 0 -4,-1.9 4,-2.1 -5,-0.2 -1,-0.2 0.931 112.2 42.3 -56.7 -45.6 26.8 29.6 -0.5 105 106 A A H X S+ 0 0 1 -4,-2.1 4,-2.7 2,-0.2 5,-0.3 0.928 113.5 51.4 -65.5 -45.5 23.6 31.7 -0.9 106 107 A N H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.891 114.0 44.1 -62.0 -42.0 25.4 35.0 -1.7 107 108 A E H X S+ 0 0 2 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.937 115.5 45.3 -69.4 -49.7 27.5 33.3 -4.4 108 109 A V H X S+ 0 0 0 -4,-2.1 4,-2.2 -5,-0.2 -2,-0.2 0.885 115.9 47.7 -61.3 -41.1 24.6 31.3 -6.0 109 110 A I H X S+ 0 0 0 -4,-2.7 4,-2.8 -5,-0.2 5,-0.2 0.927 110.4 51.6 -68.7 -44.8 22.3 34.4 -5.9 110 111 A A H X S+ 0 0 0 -4,-2.3 4,-2.4 -5,-0.3 -2,-0.2 0.954 113.4 44.7 -55.5 -50.6 25.0 36.7 -7.4 111 112 A N H X S+ 0 0 1 -4,-2.5 4,-1.9 -93,-0.4 -2,-0.2 0.887 114.8 46.6 -64.1 -40.3 25.6 34.3 -10.3 112 113 A R H X S+ 0 0 50 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.848 111.1 53.3 -69.4 -35.2 21.9 33.7 -11.0 113 114 A A H X S+ 0 0 0 -4,-2.8 4,-1.4 2,-0.2 -2,-0.2 0.899 106.8 53.3 -61.8 -42.5 21.3 37.5 -10.8 114 115 A L H <>S+ 0 0 0 -4,-2.4 5,-2.9 -5,-0.2 3,-0.4 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