==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER MEMBRANE PROTEIN 07-MAR-00 1EK9 . COMPND 2 MOLECULE: OUTER MEMBRANE PROTEIN TOLC; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR V.KORONAKIS,A.J.SHARFF,E.KORONAKIS,B.LUISI,C.HUGHES . 1284 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 57610.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1087 84.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 180 14.0 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 . 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 . 18 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 86 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 778 60.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 0.7 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 0 0 0 0 1 2 0 6 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 12 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 0 0 3 3 0 0 0 0 0 6 0 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 E 0 0 70 0, 0.0 193,-1.7 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 -47.2 -4.6 90.2 38.1 2 2 A N > - 0 0 33 191,-0.2 4,-1.9 1,-0.1 5,-0.1 -0.391 360.0-101.8 -91.3 174.4 -6.2 90.5 41.6 3 3 A L H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.875 119.6 55.0 -63.4 -37.7 -7.4 87.4 43.5 4 4 A X H > S+ 0 0 68 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.948 111.2 46.1 -61.1 -46.1 -11.2 87.9 42.7 5 5 A Q H > S+ 0 0 71 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.902 112.2 50.2 -66.6 -36.8 -10.4 88.1 39.0 6 6 A V H X S+ 0 0 0 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.905 111.7 47.6 -65.8 -47.1 -8.1 85.0 39.1 7 7 A Y H X S+ 0 0 6 -4,-2.6 4,-3.4 2,-0.2 -2,-0.2 0.927 109.5 52.8 -60.3 -38.3 -10.7 82.9 41.0 8 8 A Q H X S+ 0 0 62 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.893 111.1 47.5 -65.9 -37.8 -13.5 84.0 38.5 9 9 A Q H X S+ 0 0 65 -4,-1.9 4,-1.2 -5,-0.2 -1,-0.2 0.928 114.0 48.1 -70.5 -37.1 -11.3 82.9 35.6 10 10 A A H X S+ 0 0 0 -4,-2.5 4,-2.3 -5,-0.2 -2,-0.2 0.925 106.5 56.9 -63.7 -49.6 -10.6 79.6 37.5 11 11 A R H < S+ 0 0 88 -4,-3.4 -2,-0.2 1,-0.2 -1,-0.2 0.919 106.3 48.0 -54.0 -41.7 -14.3 78.9 38.3 12 12 A L H < S+ 0 0 119 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.861 125.6 25.3 -72.2 -31.5 -15.6 79.0 34.7 13 13 A S H < S+ 0 0 31 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.539 77.6 127.8-110.3 -6.4 -12.9 76.7 33.3 14 14 A N X - 0 0 8 -4,-2.3 4,-2.3 1,-0.2 3,-0.2 -0.373 41.3-160.3 -60.3 121.4 -11.5 74.5 36.0 15 15 A P H > S+ 0 0 0 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.727 85.4 58.1 -77.7 -23.7 -11.8 70.9 34.7 16 16 A E H > S+ 0 0 96 2,-0.2 4,-1.3 1,-0.1 -2,-0.1 0.880 113.5 39.6 -70.0 -40.7 -11.6 69.2 38.1 17 17 A L H > S+ 0 0 11 2,-0.2 4,-2.2 -3,-0.2 5,-0.2 0.911 114.9 53.2 -71.9 -47.0 -14.6 71.0 39.3 18 18 A R H X S+ 0 0 112 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.882 109.1 49.8 -57.1 -34.2 -16.4 70.7 35.9 19 19 A K H X S+ 0 0 47 -4,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.859 109.3 51.8 -70.6 -38.9 -15.8 66.9 36.0 20 20 A S H X S+ 0 0 4 -4,-1.3 4,-1.6 2,-0.2 -2,-0.2 0.855 107.1 52.3 -64.3 -39.5 -17.2 66.8 39.5 21 21 A A H X S+ 0 0 16 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.862 108.4 52.9 -61.8 -38.4 -20.4 68.7 38.3 22 22 A A H X S+ 0 0 3 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.825 107.4 50.1 -64.3 -43.5 -20.7 66.1 35.6 23 23 A D H X S+ 0 0 55 -4,-1.7 4,-1.5 2,-0.2 -1,-0.2 0.836 111.6 49.3 -61.3 -39.3 -20.6 63.3 38.1 24 24 A R H X S+ 0 0 60 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.918 110.7 49.3 -65.2 -48.7 -23.3 65.0 40.1 25 25 A D H X S+ 0 0 49 -4,-2.4 4,-2.9 1,-0.2 5,-0.2 0.902 110.3 50.4 -58.9 -43.9 -25.5 65.5 37.0 26 26 A A H X S+ 0 0 21 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.866 110.1 51.0 -60.8 -42.7 -25.1 61.9 36.1 27 27 A A H < S+ 0 0 16 -4,-1.5 4,-0.3 2,-0.2 -2,-0.2 0.887 112.4 44.8 -65.2 -41.3 -26.1 60.8 39.6 28 28 A F H >< S+ 0 0 91 -4,-2.2 3,-2.9 2,-0.2 4,-0.5 0.986 112.3 52.1 -64.7 -47.3 -29.2 63.0 39.7 29 29 A E H >X S+ 0 0 25 -4,-2.9 3,-1.4 1,-0.3 4,-0.8 0.819 98.6 67.0 -57.8 -31.3 -30.2 61.8 36.2 30 30 A K H 3X S+ 0 0 78 -4,-1.9 4,-2.4 1,-0.3 -1,-0.3 0.641 81.9 74.5 -67.3 -18.7 -29.8 58.2 37.4 31 31 A I H <> S+ 0 0 24 -3,-2.9 4,-1.7 -4,-0.3 -1,-0.3 0.936 94.4 54.1 -59.1 -38.1 -32.8 58.8 39.7 32 32 A N H <> S+ 0 0 62 -3,-1.4 4,-1.2 -4,-0.5 3,-0.4 0.922 108.4 47.6 -61.4 -43.8 -34.9 58.5 36.5 33 33 A E H < S+ 0 0 38 -4,-0.8 -1,-0.2 1,-0.2 3,-0.2 0.881 111.5 50.2 -66.4 -36.9 -33.3 55.2 35.7 34 34 A A H < S+ 0 0 18 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.735 110.2 50.2 -69.3 -27.4 -33.9 53.9 39.2 35 35 A R H >< S+ 0 0 96 -4,-1.7 3,-2.0 -3,-0.4 -1,-0.2 0.740 90.7 86.0 -77.2 -25.0 -37.6 55.0 39.0 36 36 A S G >< S+ 0 0 0 -4,-1.2 3,-1.9 1,-0.3 -2,-0.2 0.793 77.5 59.2 -53.5 -36.9 -38.0 53.2 35.7 37 37 A P G 3 S+ 0 0 42 0, 0.0 37,-0.3 0, 0.0 -1,-0.3 0.656 100.2 60.9 -67.6 -13.5 -38.8 49.6 36.9 38 38 A L G < S+ 0 0 23 -3,-2.0 -2,-0.2 42,-0.1 686,-0.1 0.335 97.8 72.7 -91.3 -1.1 -41.9 51.1 38.8 39 39 A L S < S- 0 0 50 -3,-1.9 35,-0.2 -4,-0.1 2,-0.1 -0.654 101.8 -70.0-110.2 166.6 -43.4 52.3 35.5 40 40 A P - 0 0 50 0, 0.0 684,-0.9 0, 0.0 2,-0.5 -0.405 40.2-154.5 -62.1 133.2 -45.1 50.3 32.7 41 41 A Q E -AB 72 723A 39 31,-2.5 31,-2.6 682,-0.2 2,-0.4 -0.940 17.5-179.9-107.4 121.9 -42.8 48.1 30.6 42 42 A L E +AB 71 722A 50 680,-3.0 680,-1.9 -2,-0.5 2,-0.3 -0.977 3.7 169.7-131.6 115.2 -44.2 47.5 27.1 43 43 A G E -A 70 0A 26 27,-1.8 27,-3.1 -2,-0.4 2,-0.5 -0.872 26.1-136.3-127.7 158.7 -42.5 45.4 24.4 44 44 A L E -AB 69 719A 50 675,-2.8 675,-2.1 -2,-0.3 2,-0.3 -0.981 23.9-179.5-112.5 120.2 -43.4 43.9 20.9 45 45 A G E +AB 68 718A 16 23,-2.6 23,-2.8 -2,-0.5 2,-0.3 -0.826 5.5 166.8-117.3 156.9 -42.4 40.3 20.1 46 46 A A E +AB 67 717A 27 671,-1.8 671,-2.9 -2,-0.3 2,-0.3 -0.898 6.4 169.5-169.4 135.7 -42.9 38.4 16.9 47 47 A D E -AB 66 716A 57 19,-2.6 19,-2.5 -2,-0.3 2,-0.3 -0.942 25.0-144.7-148.6 174.3 -41.6 35.1 15.5 48 48 A Y E -AB 65 715A 89 667,-1.8 667,-2.2 -2,-0.3 2,-0.4 -0.990 19.7-171.7-138.5 134.7 -41.7 32.3 12.9 49 49 A T E -AB 64 714A 39 15,-2.9 15,-2.4 -2,-0.3 2,-0.5 -0.993 10.3-162.0-135.5 133.5 -41.0 28.7 13.6 50 50 A Y E -AB 63 713A 73 663,-3.4 663,-1.5 -2,-0.4 2,-0.3 -0.936 14.8-171.3-112.1 127.0 -40.6 25.7 11.3 51 51 A S E -AB 62 712A 12 11,-3.0 11,-1.8 -2,-0.5 2,-0.4 -0.912 11.8-166.8-121.4 148.2 -40.9 22.2 12.8 52 52 A N E -AB 61 711A 47 659,-1.7 659,-1.2 -2,-0.3 9,-0.2 -0.951 18.6-144.9-138.9 104.4 -40.2 18.8 11.3 53 53 A G E + B 0 710A 2 7,-1.6 6,-0.4 -2,-0.4 2,-0.3 -0.162 24.6 162.7 -67.0 165.0 -41.4 15.8 13.2 54 54 A Y + 0 0 63 655,-1.5 3,-0.2 1,-0.3 655,-0.1 -0.971 44.3 38.8-169.5 174.2 -39.8 12.4 13.4 55 55 A R S S- 0 0 89 -2,-0.3 -1,-0.3 1,-0.3 652,-0.0 0.850 136.7 -8.8 37.9 81.7 -39.6 9.1 15.4 56 56 A D S S+ 0 0 108 -3,-0.1 651,-0.3 1,-0.1 -1,-0.3 0.462 143.0 55.1 83.0 3.1 -43.4 8.6 16.1 57 57 A A S > S+ 0 0 9 650,-0.2 3,-1.9 -3,-0.2 -4,-0.2 0.050 72.7 136.8-146.2 11.0 -44.3 12.1 14.8 58 58 A N T 3 + 0 0 118 1,-0.3 -4,-0.2 -5,-0.2 3,-0.1 -0.407 65.9 38.7 -58.4 136.7 -42.7 11.6 11.4 59 59 A G T 3 S+ 0 0 5 -6,-0.4 206,-0.7 1,-0.2 2,-0.5 0.379 92.2 100.2 96.2 -3.2 -45.1 13.0 8.8 60 60 A I < + 0 0 23 -3,-1.9 -7,-1.6 204,-0.1 2,-0.3 -0.965 44.4 160.6-120.0 110.2 -46.3 16.0 10.9 61 61 A N E +AC 52 262A 28 201,-2.4 201,-1.7 -2,-0.5 2,-0.3 -0.854 8.3 172.5-121.3 163.6 -44.6 19.3 10.0 62 62 A S E -AC 51 261A 14 -11,-1.8 -11,-3.0 -2,-0.3 2,-0.4 -0.990 25.3-149.0-162.6 162.5 -45.6 22.9 10.6 63 63 A N E -AC 50 260A 64 197,-1.5 197,-1.2 -2,-0.3 196,-0.4 -0.951 21.6-170.0-144.5 119.5 -44.7 26.5 10.4 64 64 A A E -A 49 0A 25 -15,-2.4 -15,-2.9 -2,-0.4 2,-0.4 -0.763 8.6-166.0-107.5 153.6 -46.0 28.9 13.0 65 65 A T E +A 48 0A 66 -2,-0.3 193,-2.0 -17,-0.3 2,-0.3 -0.981 14.0 175.7-136.6 132.9 -45.9 32.7 13.1 66 66 A S E +AD 47 257A 36 -19,-2.5 -19,-2.6 -2,-0.4 2,-0.3 -0.965 8.5 175.9-140.6 159.6 -46.7 34.7 16.2 67 67 A A E +AD 46 256A 29 189,-1.7 189,-2.2 -2,-0.3 2,-0.3 -0.912 10.4 166.7-161.4 136.7 -46.6 38.4 17.2 68 68 A S E -AD 45 255A 31 -23,-2.8 -23,-2.6 -2,-0.3 2,-0.5 -0.992 34.2-132.4-156.6 155.8 -47.7 40.2 20.4 69 69 A L E -AD 44 254A 74 185,-2.6 185,-1.9 -2,-0.3 2,-0.3 -0.934 33.4-167.6-101.5 124.4 -47.6 43.3 22.5 70 70 A Q E -AD 43 253A 108 -27,-3.1 -27,-1.8 -2,-0.5 2,-0.4 -0.910 6.5-170.0-119.1 147.7 -46.7 42.5 26.1 71 71 A L E -AD 42 252A 50 181,-2.5 181,-1.7 -2,-0.3 2,-0.4 -0.999 4.0-171.5-137.6 131.5 -46.9 44.8 29.2 72 72 A T E +AD 41 251A 65 -31,-2.6 -31,-2.5 -2,-0.4 2,-0.3 -0.954 4.8 179.9-122.5 147.7 -45.6 44.4 32.7 73 73 A Q E - D 0 250A 45 177,-2.1 177,-2.6 -2,-0.4 2,-0.2 -0.947 25.4-129.0-151.7 122.8 -46.5 46.7 35.7 74 74 A S E + D 0 249A 15 -2,-0.3 175,-0.2 -37,-0.3 3,-0.1 -0.534 27.1 172.3 -74.6 134.9 -45.2 46.4 39.2 75 75 A I E S+ 0 0 88 173,-2.2 2,-0.4 1,-0.3 174,-0.2 0.775 73.8 7.4-108.3 -50.5 -47.9 46.4 41.8 76 76 A F E S+ D 0 248A 93 172,-2.3 172,-2.5 4,-0.0 -1,-0.3 -0.962 72.4 138.4-136.9 114.6 -46.1 45.6 45.0 77 77 A D >> - 0 0 24 -2,-0.4 4,-1.2 170,-0.2 3,-0.8 -0.600 23.6-174.1-156.6 88.7 -42.3 45.3 45.0 78 78 A X H >> S+ 0 0 70 168,-0.3 4,-2.7 1,-0.2 3,-1.2 0.946 86.9 62.1 -51.1 -45.5 -40.5 46.9 48.0 79 79 A S H 3> S+ 0 0 54 1,-0.3 4,-2.2 163,-0.2 -1,-0.2 0.805 102.9 50.1 -50.2 -34.7 -37.1 46.1 46.4 80 80 A K H <> S+ 0 0 62 -3,-0.8 4,-1.0 1,-0.2 -1,-0.3 0.792 112.3 45.5 -78.5 -30.3 -38.0 48.5 43.5 81 81 A W H S+ 0 0 67 -4,-2.8 5,-3.0 1,-0.2 6,-0.8 0.859 109.5 52.0 -70.2 -40.6 39.2 100.5 50.1 144 144 A F H ><5S+ 0 0 75 -4,-2.7 3,-1.2 4,-0.2 -1,-0.2 0.893 107.7 52.5 -56.5 -48.6 41.6 97.7 49.4 145 145 A N H 3<5S+ 0 0 122 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.817 111.8 46.7 -59.5 -31.0 43.0 99.6 46.4 146 146 A V T 3<5S- 0 0 82 -4,-1.5 -1,-0.2 -5,-0.1 -2,-0.2 0.366 119.3-109.7 -97.8 7.1 43.6 102.7 48.6 147 147 A G T < 5S+ 0 0 65 -3,-1.2 -3,-0.2 -4,-0.2 -4,-0.1 0.638 85.7 117.3 83.7 10.8 45.2 100.7 51.4 148 148 A L S > - 0 0 52 -2,-0.3 3,-1.5 1,-0.1 4,-0.7 -0.439 34.3-112.2 -75.9 157.6 43.5 93.9 53.4 151 151 A I H 3> S+ 0 0 77 1,-0.3 4,-2.4 2,-0.2 3,-0.4 0.837 111.0 78.5 -63.0 -25.4 42.7 91.9 50.3 152 152 A T H 3> S+ 0 0 14 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.840 88.7 54.1 -47.7 -38.9 41.2 89.2 52.7 153 153 A D H <> S+ 0 0 18 -3,-1.5 4,-2.3 2,-0.2 -1,-0.2 0.878 108.8 48.0 -67.6 -36.9 38.0 91.4 53.1 154 154 A V H X S+ 0 0 22 -4,-0.7 4,-2.4 -3,-0.4 5,-0.2 0.961 112.0 49.7 -67.0 -45.5 37.5 91.5 49.3 155 155 A Q H X S+ 0 0 55 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.892 112.4 47.2 -64.8 -36.1 38.0 87.7 49.0 156 156 A N H X S+ 0 0 3 -4,-2.3 4,-1.7 -5,-0.2 -1,-0.2 0.902 112.9 48.4 -68.4 -38.1 35.5 87.0 51.8 157 157 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.899 109.6 52.7 -70.7 -34.8 32.9 89.3 50.3 158 158 A R H X S+ 0 0 105 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.888 106.8 52.3 -64.4 -44.0 33.3 87.8 46.8 159 159 A A H X S+ 0 0 6 -4,-1.7 4,-1.6 620,-0.3 -1,-0.2 0.939 112.1 46.7 -56.3 -44.6 32.7 84.3 48.2 160 160 A Q H X S+ 0 0 45 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.908 110.2 52.2 -62.6 -47.8 29.5 85.5 49.9 161 161 A Y H X S+ 0 0 35 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.912 106.9 53.2 -56.4 -47.1 28.3 87.3 46.8 162 162 A D H X S+ 0 0 6 -4,-2.4 4,-1.5 1,-0.2 -1,-0.2 0.861 106.8 53.2 -58.6 -37.6 28.8 84.2 44.7 163 163 A T H X S+ 0 0 55 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.924 108.7 48.2 -61.7 -42.1 26.6 82.2 47.1 164 164 A V H X S+ 0 0 2 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.919 106.4 57.8 -73.9 -27.9 23.8 84.8 46.9 165 165 A L H X S+ 0 0 52 -4,-2.6 4,-1.0 1,-0.2 -1,-0.2 0.896 108.4 47.0 -59.7 -41.9 24.0 84.7 43.0 166 166 A A H >X S+ 0 0 0 -4,-1.5 4,-1.4 1,-0.2 3,-0.5 0.901 109.7 52.7 -66.5 -38.3 23.4 80.9 43.2 167 167 A N H 3X S+ 0 0 62 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.834 102.7 59.8 -65.7 -36.3 20.5 81.5 45.6 168 168 A E H 3X S+ 0 0 27 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.805 100.3 55.1 -58.2 -37.0 19.0 83.9 43.2 169 169 A L H + 0 0 36 221,-3.4 4,-0.6 1,-0.2 -1,-0.1 -0.621 34.1 175.4 -82.6 101.5 -0.9 95.4 51.2 198 198 A V T 4 S+ 0 0 63 -2,-1.2 -1,-0.2 2,-0.2 -2,-0.1 0.660 74.9 59.9 -87.9 -9.8 1.6 95.2 54.0 199 199 A E T 4 S+ 0 0 140 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 0.863 117.4 33.3 -75.7 -33.6 1.2 98.9 55.2 200 200 A N T 4 S+ 0 0 99 218,-0.1 2,-0.2 2,-0.0 -2,-0.2 0.407 91.5 121.9 -96.7 0.2 -2.5 98.0 55.9 201 201 A F < + 0 0 38 -4,-0.6 2,-0.3 -5,-0.1 -3,-0.1 -0.390 31.6 165.1 -63.8 144.7 -2.1 94.4 57.0 202 202 A K - 0 0 135 -2,-0.2 2,-0.2 2,-0.0 -2,-0.0 -0.958 27.0-130.1-149.0 161.2 -3.4 93.4 60.5 203 203 A T - 0 0 28 -2,-0.3 2,-0.4 135,-0.1 187,-0.0 -0.674 13.2-155.6-118.1 156.0 -4.1 90.1 62.2 204 204 A D - 0 0 110 -2,-0.2 134,-0.0 0, 0.0 -2,-0.0 -0.985 23.8-115.7-130.1 135.1 -7.2 89.1 64.2 205 205 A K - 0 0 127 -2,-0.4 2,-0.1 1,-0.1 130,-0.0 -0.319 39.0-116.2 -69.4 143.5 -7.4 86.5 66.9 206 206 A P - 0 0 27 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.451 35.8 -85.6 -74.5 166.5 -9.7 83.6 65.8 207 207 A Q - 0 0 131 -2,-0.1 5,-0.1 1,-0.1 0, 0.0 -0.219 65.8 -74.9 -66.0 159.3 -12.9 82.7 67.6 208 208 A P > - 0 0 80 0, 0.0 4,-1.6 0, 0.0 3,-0.3 -0.212 43.8-118.5 -54.3 150.4 -12.5 80.4 70.6 209 209 A V H > S+ 0 0 24 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.781 111.1 58.3 -66.8 -33.4 -11.7 76.8 69.6 210 210 A N H > S+ 0 0 114 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.921 107.0 48.0 -59.6 -43.4 -14.9 75.4 71.2 211 211 A A H > S+ 0 0 46 -3,-0.3 4,-2.0 2,-0.2 -2,-0.2 0.868 111.7 49.1 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