==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN/HYDROLASE 18-MAR-02 1L7V . COMPND 2 MOLECULE: VITAMIN B12 TRANSPORT SYSTEM PERMEASE PROTEIN . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR K.P.LOCHER,A.T.LEE,D.C.REES . 1110 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 46344.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 897 80.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 3.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 46 4.1 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 . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 133 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 565 50.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 31 2.8 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 4 0 2 4 8 5 2 0 0 0 2 1 5 0 0 2 0 0 0 2 0 5 3 0 0 0 2 RESIDUES PER ALPHA HELIX . 4 0 2 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 PARALLEL BRIDGES PER LADDER . 7 2 0 2 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 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 2 0 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 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 X 0 0 141 0, 0.0 750,-0.1 0, 0.0 751,-0.0 0.000 360.0 360.0 360.0 133.8 75.1 90.9 68.7 2 2 A L > - 0 0 16 1,-0.1 4,-2.2 738,-0.1 5,-0.2 -0.175 360.0-121.9 -59.7 151.5 73.8 89.2 65.5 3 3 A T H > S+ 0 0 96 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.990 108.2 44.0 -57.8 -72.1 70.7 90.5 63.8 4 4 A L H > S+ 0 0 66 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.846 114.3 56.1 -42.5 -41.5 68.4 87.5 63.8 5 5 A A H > S+ 0 0 13 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.981 106.4 44.7 -56.1 -66.5 69.5 86.9 67.4 6 6 A R H X S+ 0 0 175 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.855 115.6 51.3 -47.9 -40.8 68.5 90.3 68.8 7 7 A Q H X S+ 0 0 85 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.955 110.0 46.6 -63.8 -51.1 65.3 90.0 66.8 8 8 A Q H X S+ 0 0 52 -4,-3.0 4,-2.6 1,-0.2 -2,-0.2 0.936 110.4 54.4 -57.1 -46.6 64.4 86.5 68.2 9 9 A Q H X S+ 0 0 81 -4,-3.1 4,-3.0 1,-0.2 -1,-0.2 0.874 105.7 53.9 -54.4 -40.1 65.3 87.8 71.7 10 10 A R H X S+ 0 0 163 -4,-1.8 4,-2.0 -5,-0.3 -1,-0.2 0.972 110.5 43.9 -60.5 -54.8 62.8 90.6 71.2 11 11 A Q H X S+ 0 0 85 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.844 112.9 55.1 -59.9 -32.9 60.0 88.3 70.3 12 12 A N H X S+ 0 0 10 -4,-2.6 4,-2.6 -5,-0.2 5,-0.3 0.986 105.5 49.4 -62.7 -57.1 61.0 86.0 73.2 13 13 A I H X S+ 0 0 88 -4,-3.0 4,-1.2 1,-0.2 -1,-0.2 0.854 108.3 57.9 -49.2 -38.0 60.8 88.8 75.8 14 14 A R H >X S+ 0 0 160 -4,-2.0 4,-2.8 -5,-0.2 3,-0.7 0.974 108.9 41.8 -58.1 -57.0 57.4 89.5 74.3 15 15 A W H 3X>S+ 0 0 81 -4,-2.1 4,-4.5 1,-0.3 5,-0.5 0.936 108.8 57.1 -57.5 -50.3 56.1 86.0 75.0 16 16 A L H 3X5S+ 0 0 36 -4,-2.6 4,-1.5 1,-0.2 -1,-0.3 0.824 112.4 47.0 -50.5 -27.5 57.7 85.8 78.4 17 17 A L H X S+ 0 0 87 -4,-2.9 3,-1.5 1,-0.2 4,-0.7 0.861 110.8 51.0 -45.3 -46.6 40.6 83.3 88.0 30 30 A S H >< S+ 0 0 0 -4,-2.8 3,-1.4 1,-0.3 -1,-0.2 0.950 105.7 54.2 -59.2 -49.3 41.5 80.2 90.1 31 31 A L H 3< S+ 0 0 12 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.528 112.9 47.9 -61.1 -4.4 41.3 82.2 93.3 32 32 A C H << S+ 0 0 9 -3,-1.5 6,-1.2 -4,-0.5 2,-0.4 0.481 99.2 69.8-117.4 -6.7 37.8 83.3 92.2 33 33 A A B << +A 37 0A 13 -3,-1.4 4,-0.2 -4,-0.7 -1,-0.1 -0.944 36.8 119.6-126.0 140.9 36.0 80.1 91.2 34 34 A G S S- 0 0 21 2,-1.3 3,-0.1 -2,-0.4 -1,-0.1 -0.003 95.2 -52.1 172.6 62.7 34.7 77.0 93.0 35 35 A E S S+ 0 0 150 1,-0.0 2,-0.3 0, 0.0 -2,-0.1 0.605 133.5 37.7 71.5 6.4 30.9 76.3 92.7 36 36 A Q S S- 0 0 127 -4,-0.1 -2,-1.3 2,-0.0 2,-0.3 -0.905 89.6-113.8-173.4 164.2 30.3 79.8 93.8 37 37 A W B -A 33 0A 173 -2,-0.3 -4,-0.2 -4,-0.2 2,-0.1 -0.834 20.4-176.6-115.9 151.4 32.1 83.0 93.1 38 38 A I - 0 0 17 -6,-1.2 -5,-0.1 -2,-0.3 -2,-0.0 -0.582 19.8-153.1-145.6 82.1 34.1 85.3 95.3 39 39 A S - 0 0 21 -2,-0.1 3,-0.2 1,-0.1 -2,-0.0 0.003 37.5 -95.5 -49.0 157.5 35.2 88.4 93.5 40 40 A P S > S+ 0 0 69 0, 0.0 3,-1.0 0, 0.0 4,-0.3 0.838 125.3 56.6 -46.1 -38.3 38.4 90.1 94.8 41 41 A G G > S+ 0 0 62 1,-0.3 2,-1.1 2,-0.1 3,-0.9 0.968 103.1 50.0 -60.2 -56.3 36.2 92.5 96.7 42 42 A D G 3 S+ 0 0 91 -3,-0.2 6,-0.4 1,-0.2 3,-0.3 -0.050 84.9 103.2 -75.7 36.7 34.3 89.9 98.7 43 43 A W G < S+ 0 0 58 -2,-1.1 -1,-0.2 -3,-1.0 10,-0.2 0.857 73.7 50.7 -86.9 -39.8 37.7 88.3 99.6 44 44 A F S < S+ 0 0 174 -3,-0.9 -1,-0.2 -4,-0.3 -2,-0.1 0.151 87.4 115.8 -86.1 21.2 38.0 89.5 103.2 45 45 A T S > S- 0 0 51 -3,-0.3 4,-2.3 1,-0.1 5,-0.4 -0.616 89.5-101.6 -87.8 148.6 34.5 88.2 103.9 46 46 A P T 4 S+ 0 0 100 0, 0.0 4,-0.2 0, 0.0 -1,-0.1 0.704 127.9 49.7 -42.1 -21.0 34.1 85.4 106.5 47 47 A R T >> S+ 0 0 149 2,-0.2 4,-2.5 3,-0.1 3,-1.6 0.930 107.4 49.4 -83.6 -55.3 33.7 83.2 103.3 48 48 A G T 34>S+ 0 0 1 -6,-0.4 5,-2.1 1,-0.3 6,-0.3 0.896 105.9 57.5 -50.8 -46.4 36.8 84.5 101.5 49 49 A E T 3<>S+ 0 0 101 -4,-2.3 5,-0.8 3,-0.2 -1,-0.3 0.769 115.5 39.4 -57.8 -25.1 39.0 84.0 104.5 50 50 A L T <>5S+ 0 0 81 -3,-1.6 4,-0.7 -5,-0.4 5,-0.3 0.940 130.8 20.8 -87.0 -67.0 37.8 80.4 104.4 51 51 A F H X>S+ 0 0 81 -4,-2.5 5,-2.6 3,-0.2 4,-2.5 0.990 128.3 42.4 -64.3 -81.1 37.8 79.5 100.8 52 52 A V H 4>S+ 0 0 11 3,-0.2 5,-2.4 4,-0.2 -3,-0.2 0.764 132.8 20.6 -35.3 -46.5 40.1 82.0 99.1 53 53 A W H 4 S+ 0 0 0 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.939 113.7 48.1 -50.2 -56.0 47.0 76.9 98.8 59 59 A R H X S+ 0 0 14 -4,-1.4 4,-2.5 127,-0.3 -2,-0.2 0.920 111.7 50.2 -52.4 -50.4 45.6 74.7 96.1 60 60 A T H X S+ 0 0 0 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.942 109.2 50.1 -57.6 -49.9 46.3 77.3 93.4 61 61 A L H X S+ 0 0 63 -4,-2.8 4,-2.1 -5,-0.2 -1,-0.2 0.848 109.1 53.8 -57.9 -34.3 49.9 77.8 94.5 62 62 A A H X S+ 0 0 0 -4,-2.1 4,-3.1 -5,-0.2 5,-0.3 0.964 108.3 48.8 -64.1 -51.3 50.3 74.0 94.4 63 63 A V H X S+ 0 0 0 -4,-2.5 4,-3.7 1,-0.2 5,-0.2 0.950 109.2 52.4 -51.8 -56.6 49.1 73.8 90.9 64 64 A L H X S+ 0 0 17 -4,-2.6 4,-2.6 1,-0.2 5,-0.3 0.920 114.1 42.7 -45.4 -55.8 51.3 76.6 89.7 65 65 A L H X S+ 0 0 32 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.938 115.5 47.3 -60.2 -50.5 54.4 75.0 91.1 66 66 A V H X S+ 0 0 0 -4,-3.1 4,-3.2 2,-0.2 5,-0.3 0.919 114.9 48.8 -59.0 -43.1 53.5 71.5 89.9 67 67 A G H X S+ 0 0 0 -4,-3.7 4,-3.1 -5,-0.3 217,-0.3 0.996 111.9 44.6 -57.6 -69.5 52.7 72.8 86.5 68 68 A A H X S+ 0 0 9 -4,-2.6 4,-2.6 -5,-0.2 -1,-0.2 0.819 118.4 49.2 -43.7 -37.0 55.9 74.9 86.0 69 69 A A H X S+ 0 0 0 -4,-2.3 4,-3.9 -5,-0.3 5,-0.3 0.993 110.5 44.3 -68.7 -64.8 57.8 71.9 87.4 70 70 A L H X S+ 0 0 7 -4,-3.2 4,-2.0 1,-0.2 -2,-0.2 0.864 117.3 50.5 -47.5 -40.1 56.2 69.1 85.2 71 71 A A H X S+ 0 0 0 -4,-3.1 4,-1.9 -5,-0.3 3,-0.4 0.993 113.2 41.7 -62.5 -62.6 56.7 71.5 82.3 72 72 A I H X S+ 0 0 0 -4,-2.6 4,-3.2 -5,-0.3 5,-0.2 0.893 110.7 59.2 -52.2 -43.1 60.3 72.3 83.0 73 73 A S H X S+ 0 0 0 -4,-3.9 4,-3.4 1,-0.2 5,-0.3 0.934 103.4 52.1 -52.6 -48.3 61.0 68.6 83.8 74 74 A G H X S+ 0 0 0 -4,-2.0 4,-2.6 -3,-0.4 -1,-0.2 0.929 110.9 46.8 -54.4 -48.2 59.8 67.8 80.3 75 75 A A H X S+ 0 0 0 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.987 114.7 47.9 -55.7 -58.5 62.2 70.3 78.8 76 76 A V H X S+ 0 0 0 -4,-3.2 4,-2.5 1,-0.2 -2,-0.2 0.852 112.8 45.8 -50.9 -47.9 65.0 69.0 81.0 77 77 A X H X S+ 0 0 1 -4,-3.4 4,-2.8 -5,-0.2 5,-0.3 0.967 110.0 55.3 -63.0 -49.4 64.4 65.3 80.3 78 78 A Q H X>S+ 0 0 0 -4,-2.6 5,-2.1 8,-0.4 4,-0.8 0.902 110.0 46.7 -47.9 -47.8 64.1 66.0 76.6 79 79 A A H ><5S+ 0 0 8 -4,-2.4 3,-1.5 3,-0.2 -1,-0.2 0.982 111.8 50.6 -59.4 -57.5 67.5 67.7 76.6 80 80 A L H 3<5S+ 0 0 3 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.891 119.0 35.5 -45.9 -53.1 69.1 64.8 78.6 81 81 A F H 3<5S- 0 0 5 -4,-2.8 -1,-0.3 2,-0.2 -2,-0.2 0.447 103.4-126.3 -86.0 1.1 67.9 62.1 76.3 82 82 A E T <<5S+ 0 0 53 -3,-1.5 -3,-0.2 -4,-0.8 -4,-0.1 0.968 75.0 114.8 51.7 53.3 68.2 64.1 73.2 83 83 A N > < - 0 0 4 -5,-2.1 3,-1.9 -6,-0.2 -2,-0.2 -0.835 62.8-150.3-161.3 118.1 64.6 63.3 72.5 84 84 A P T 3 S+ 0 0 32 0, 0.0 -6,-0.1 0, 0.0 178,-0.1 0.726 98.1 63.7 -56.4 -28.0 61.4 65.5 72.3 85 85 A L T 3 S+ 0 0 9 -7,-0.1 2,-0.3 2,-0.0 6,-0.1 0.548 75.3 116.9 -78.0 -7.3 59.2 62.6 73.4 86 86 A A < + 0 0 0 -3,-1.9 -8,-0.4 4,-0.1 -9,-0.1 -0.463 37.6 143.8 -66.3 125.8 61.0 62.5 76.8 87 87 A E > - 0 0 4 -2,-0.3 4,-2.0 -10,-0.1 6,-0.3 -0.981 58.0-111.6-161.8 151.6 58.6 63.4 79.6 88 88 A P T 4>S+ 0 0 2 0, 0.0 5,-1.9 0, 0.0 6,-1.2 0.932 112.8 43.5 -49.1 -57.9 57.9 62.5 83.3 89 89 A G T >45S+ 0 0 25 3,-0.2 3,-1.3 4,-0.2 6,-0.3 0.946 115.6 43.4 -57.2 -58.5 54.6 60.7 82.6 90 90 A L T 345S+ 0 0 38 1,-0.3 63,-0.2 2,-0.1 -1,-0.2 0.939 113.3 50.2 -56.5 -52.9 55.4 58.7 79.5 91 91 A L T 3<5S- 0 0 1 -4,-2.0 -1,-0.3 -6,-0.1 -2,-0.2 0.482 113.1-118.9 -67.5 -1.0 58.8 57.5 80.7 92 92 A G T <>5S+ 0 0 0 -3,-1.3 4,-1.3 -4,-0.3 -3,-0.2 0.687 74.7 131.9 73.0 18.2 57.2 56.4 84.0 93 93 A V H > S+ 0 0 3 -6,-1.2 4,-1.4 2,-0.2 -1,-0.2 0.922 107.4 48.4 -73.1 -44.2 56.0 59.7 87.8 95 95 A N H > S+ 0 0 28 -7,-0.3 4,-3.0 -6,-0.3 -1,-0.2 0.786 107.1 60.2 -65.0 -24.5 55.0 56.1 88.5 96 96 A G H X S+ 0 0 3 -4,-1.3 4,-2.5 1,-0.2 -1,-0.2 0.955 108.2 40.6 -65.9 -49.0 58.4 55.8 89.9 97 97 A A H X S+ 0 0 0 -4,-1.7 4,-1.0 27,-0.3 -1,-0.2 0.707 112.4 61.2 -70.0 -18.9 57.7 58.4 92.5 98 98 A G H >X S+ 0 0 4 -4,-1.4 4,-2.2 2,-0.2 3,-1.0 0.986 107.4 40.3 -68.7 -58.9 54.3 56.7 92.7 99 99 A V H 3X S+ 0 0 37 -4,-3.0 4,-2.5 1,-0.3 5,-0.3 0.910 113.0 56.2 -54.1 -46.8 55.8 53.4 93.9 100 100 A G H 3X S+ 0 0 15 -4,-2.5 4,-1.1 -5,-0.2 -1,-0.3 0.764 110.6 46.1 -59.6 -25.5 58.3 55.3 96.1 101 101 A L H < S+ 0 0 51 -4,-2.7 3,-0.7 3,-0.2 4,-0.3 0.975 118.6 34.4 -63.3 -60.4 53.4 55.0 103.3 106 106 A L H 3< S+ 0 0 72 -4,-3.0 -3,-0.2 1,-0.2 -2,-0.2 0.992 123.0 42.4 -60.4 -66.1 52.7 51.3 103.8 107 107 A L T 3< S+ 0 0 153 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.2 0.428 127.1 42.0 -62.9 5.6 56.1 50.1 105.0 108 108 A G S < S- 0 0 33 -3,-0.7 2,-0.2 -5,-0.2 -3,-0.2 0.495 100.7 -95.3-114.5-102.6 56.0 53.3 107.0 109 109 A Q > - 0 0 133 -5,-0.4 3,-2.7 -4,-0.3 -3,-0.1 -0.863 26.5-101.9 176.3 149.4 53.0 54.7 109.0 110 110 A G T 3 S+ 0 0 78 1,-0.3 -4,-0.1 -2,-0.2 -5,-0.1 0.588 117.2 68.1 -58.8 -7.1 50.1 57.1 108.7 111 111 A Q T 3 + 0 0 155 -6,-0.1 -1,-0.3 2,-0.1 -6,-0.0 0.478 65.4 122.6 -90.7 -5.3 52.3 59.4 110.8 112 112 A L < - 0 0 52 -3,-2.7 5,-0.1 -7,-0.1 -4,-0.0 -0.429 65.1-131.5 -58.8 109.5 54.9 59.9 108.0 113 113 A P >> - 0 0 67 0, 0.0 4,-1.8 0, 0.0 3,-0.9 -0.282 21.9-106.9 -62.8 155.6 54.8 63.7 107.6 114 114 A N H 3> S+ 0 0 58 1,-0.3 4,-3.1 75,-0.3 5,-0.3 0.930 119.9 57.4 -46.9 -57.0 54.5 64.9 104.0 115 115 A W H 3> S+ 0 0 153 1,-0.3 4,-1.7 2,-0.2 -1,-0.3 0.839 106.3 52.2 -44.2 -39.2 58.2 66.0 103.9 116 116 A A H <> S+ 0 0 19 -3,-0.9 4,-1.1 2,-0.2 -1,-0.3 0.957 113.4 42.7 -63.4 -50.0 59.1 62.5 104.8 117 117 A L H >X S+ 0 0 28 -4,-1.8 4,-1.9 -3,-0.3 3,-1.3 0.950 108.1 58.0 -60.5 -53.5 56.9 61.1 102.0 118 118 A G H 3X S+ 0 0 3 -4,-3.1 4,-2.9 1,-0.3 -1,-0.2 0.871 104.0 53.7 -44.9 -43.9 58.1 63.6 99.4 119 119 A L H 3X S+ 0 0 98 -4,-1.7 4,-1.3 -5,-0.3 -1,-0.3 0.853 108.0 50.1 -61.4 -34.6 61.6 62.5 100.0 120 120 A C H X S+ 0 0 105 -4,-2.1 4,-2.0 1,-0.3 3,-0.8 0.970 111.8 43.2 -59.8 -50.4 71.6 53.9 82.0 135 135 A F H 3X S+ 0 0 36 -4,-2.5 4,-0.9 1,-0.2 -1,-0.3 0.737 110.7 59.6 -64.6 -22.2 69.5 52.5 79.1 136 136 A A H 3< S+ 0 0 2 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.770 108.5 41.9 -77.8 -27.4 70.1 55.8 77.5 137 137 A R H X< S+ 0 0 58 -4,-1.6 3,-0.6 -3,-0.8 -2,-0.2 0.928 113.7 47.3 -84.7 -52.0 73.8 55.5 77.5 138 138 A R H 3< S+ 0 0 195 -4,-2.0 -2,-0.1 1,-0.3 -3,-0.1 0.743 133.0 15.8 -63.9 -24.1 74.4 51.9 76.5 139 139 A H T 3< S- 0 0 96 -4,-0.9 2,-0.5 -5,-0.3 -1,-0.3 -0.480 75.1-159.7-152.7 75.3 71.9 52.3 73.6 140 140 A L < + 0 0 85 -3,-0.6 2,-0.3 4,-0.1 -4,-0.1 -0.409 37.7 137.6 -60.3 108.3 71.1 55.8 72.6 141 141 A S > - 0 0 43 -2,-0.5 4,-1.8 1,-0.1 5,-0.3 -0.970 55.2-140.4-156.5 140.7 67.8 55.6 70.7 142 142 A T H > S+ 0 0 51 -2,-0.3 4,-1.3 2,-0.2 -1,-0.1 0.829 108.8 44.7 -70.4 -32.8 64.5 57.5 70.7 143 143 A S H > S+ 0 0 22 2,-0.2 4,-2.7 3,-0.2 -1,-0.2 0.935 111.2 52.8 -75.5 -48.3 62.5 54.3 70.4 144 144 A R H >> S+ 0 0 34 2,-0.2 4,-3.1 1,-0.2 3,-0.7 0.967 113.4 41.4 -49.0 -68.5 64.4 52.4 73.1 145 145 A L H 3X S+ 0 0 1 -4,-1.8 4,-2.4 1,-0.3 5,-0.3 0.879 116.5 49.7 -49.5 -44.8 64.0 55.1 75.8 146 146 A L H 3X S+ 0 0 9 -4,-1.3 4,-1.5 -5,-0.3 -1,-0.3 0.839 115.4 45.6 -66.0 -30.5 60.4 55.7 74.8 147 147 A L H X S+ 0 0 52 -4,-2.2 4,-2.1 1,-0.2 3,-0.9 0.938 111.8 53.6 -56.4 -53.4 53.5 49.8 83.4 155 155 A I H 3X S+ 0 0 46 -4,-2.9 4,-2.0 1,-0.3 -1,-0.2 0.875 108.3 51.0 -50.4 -42.2 55.8 47.8 85.8 156 156 A C H 3X S+ 0 0 9 -4,-2.2 4,-1.3 -5,-0.2 -1,-0.3 0.786 105.8 55.5 -69.1 -27.2 55.3 50.6 88.4 157 157 A S H X S+ 0 0 14 -4,-1.3 4,-1.9 2,-0.2 3,-0.7 0.973 114.8 41.0 -70.0 -55.0 51.2 49.8 93.0 161 161 A T H 3X S+ 0 0 47 -4,-3.0 4,-1.8 1,-0.2 5,-0.2 0.896 116.0 52.1 -59.6 -41.8 48.0 47.9 92.3 162 162 A W H 3X S+ 0 0 97 -4,-3.5 4,-0.7 -5,-0.2 -1,-0.2 0.672 111.6 45.7 -69.9 -19.4 49.4 44.7 93.7 163 163 A A H - 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0 0 3 -5,-1.9 3,-1.6 -6,-0.3 -2,-0.2 -0.904 65.4-147.7-158.2 126.1 58.3 49.6 62.6 409 84 B P T 3 S+ 0 0 34 0, 0.0 178,-0.1 0, 0.0 -6,-0.1 0.690 99.1 62.5 -59.1 -28.4 58.8 47.0 65.5 410 85 B L T 3 S+ 0 0 8 -7,-0.1 2,-0.5 -8,-0.1 6,-0.2 0.400 75.6 118.0 -83.7 3.5 56.8 49.0 68.0 411 86 B A < + 0 0 0 -3,-1.6 -8,-0.5 -12,-0.1 -9,-0.1 -0.608 37.4 140.7 -74.5 121.6 53.8 48.7 65.8 412 87 B E > - 0 0 3 -2,-0.5 4,-2.0 -10,-0.2 6,-0.3 -0.976 58.8-113.6-161.3 149.1 51.1 46.9 67.8 413 88 B P H >>S+ 0 0 2 0, 0.0 5,-1.4 0, 0.0 6,-1.0 0.932 110.9 47.3 -46.9 -62.2 47.3 47.0 68.4 414 89 B G H 45S+ 0 0 27 3,-0.2 3,-0.3 2,-0.2 6,-0.2 0.866 117.1 39.6 -52.0 -47.9 47.3 48.0 72.1 415 90 B L H 45S+ 0 0 42 1,-0.2 63,-0.2 -5,-0.1 -1,-0.2 0.975 114.2 49.1 -71.2 -55.8 49.9 50.8 71.8 416 91 B L H <5S- 0 0 0 -4,-2.0 -1,-0.2 -6,-0.2 -2,-0.2 0.521 112.2-119.1 -63.7 -3.4 48.8 52.5 68.6 417 92 B G T X5S+ 0 0 1 -4,-0.7 4,-1.2 -3,-0.3 -3,-0.2 0.652 74.2 131.5 76.7 17.0 45.3 52.5 69.9 418 93 B V H > S+ 0 0 3 -6,-1.0 4,-2.0 2,-0.2 -1,-0.2 0.945 106.7 45.2 -70.8 -49.2 42.1 48.4 70.2 420 95 B N H > S+ 0 0 27 -7,-0.3 4,-2.8 1,-0.2 -1,-0.2 0.770 105.2 66.0 -64.8 -23.4 40.5 51.4 71.7 421 96 B G H X S+ 0 0 3 -4,-1.2 4,-2.1 1,-0.2 -1,-0.2 0.971 105.8 39.9 -60.3 -50.7 39.4 52.2 68.2 422 97 B A H X S+ 0 0 0 -4,-1.6 4,-2.7 27,-0.3 -2,-0.2 0.844 110.4 62.9 -65.5 -32.2 37.2 49.1 68.3 423 98 B G H >X S+ 0 0 4 -4,-2.0 4,-2.7 2,-0.2 3,-0.6 0.988 104.9 43.8 -53.6 -64.7 36.4 50.1 71.9 424 99 B V H 3X S+ 0 0 42 -4,-2.8 4,-2.9 1,-0.3 -2,-0.2 0.932 116.1 47.5 -43.0 -62.2 34.7 53.3 70.8 425 100 B G H 3X S+ 0 0 15 -4,-2.1 4,-1.1 1,-0.2 -1,-0.3 0.814 112.2 51.2 -52.5 -34.5 32.9 51.5 67.9 426 101 B L H XX S+ 0 0 22 -4,-2.7 4,-2.0 -3,-0.6 3,-0.7 0.971 112.0 43.8 -69.3 -53.9 31.8 48.7 70.2 427 102 B I H 3X S+ 0 0 9 -4,-2.7 4,-2.3 1,-0.2 5,-0.3 0.915 103.9 66.3 -56.6 -44.6 30.3 51.0 72.9 428 103 B A H 3X S+ 0 0 46 -4,-2.9 4,-1.8 -5,-0.3 -1,-0.2 0.876 107.8 41.4 -43.5 -44.4 28.7 53.1 70.2 429 104 B A H X S- 0 0 17 -4,-2.4 4,-1.8 -5,-0.1 3,-0.7 -0.343 79.8-163.1-156.4 66.8 20.9 49.7 70.8 434 109 B Q T 34 S- 0 0 131 -3,-0.5 -4,-0.1 1,-0.3 -3,-0.1 -0.292 77.5 -13.3 -57.7 127.2 21.4 48.0 74.2 435 110 B G T 34 S+ 0 0 80 2,-0.2 -1,-0.3 1,-0.2 -5,-0.1 0.241 121.4 85.8 66.6 -17.0 20.7 44.3 74.2 436 111 B Q T <4 S+ 0 0 163 -3,-0.7 -2,-0.2 -6,-0.1 -1,-0.2 0.867 73.7 73.8 -81.3 -38.5 18.9 44.6 70.8 437 112 B L S < S- 0 0 71 -4,-1.8 -2,-0.2 -8,-0.1 5,-0.1 -0.642 83.5-129.8 -81.3 124.6 22.1 44.3 68.7 438 113 B P > - 0 0 62 0, 0.0 4,-2.0 0, 0.0 3,-0.5 -0.257 25.7-103.5 -69.1 160.2 23.5 40.7 68.6 439 114 B N H > S+ 0 0 50 1,-0.3 4,-3.0 75,-0.2 3,-0.5 0.922 124.6 49.9 -48.0 -52.2 27.1 39.9 69.3 440 115 B W H > S+ 0 0 143 1,-0.3 4,-1.5 2,-0.2 -1,-0.3 0.844 107.7 54.3 -57.7 -34.6 27.9 39.5 65.6 441 116 B A H > S+ 0 0 12 -3,-0.5 4,-1.0 1,-0.2 -1,-0.3 0.860 111.0 47.5 -67.0 -32.9 26.2 42.8 65.0 442 117 B L H >X S+ 0 0 26 -4,-2.0 4,-1.8 -3,-0.5 3,-0.7 0.939 101.9 62.1 -71.2 -49.8 28.6 44.2 67.6 443 118 B G H 3X S+ 0 0 2 -4,-3.0 4,-2.9 1,-0.3 3,-0.2 0.859 102.9 51.4 -43.9 -44.5 31.7 42.5 66.1 444 119 B L H 3X S+ 0 0 103 -4,-1.5 4,-1.3 1,-0.2 -1,-0.3 0.891 106.7 53.6 -63.1 -39.7 31.1 44.6 62.9 445 120 B C H X S+ 0 0 90 -4,-2.6 4,-3.0 2,-0.2 3,-0.9 0.975 114.2 39.2 -49.8 -68.6 39.2 53.8 61.2 453 128 B I H 3X S+ 0 0 11 -4,-1.4 4,-3.6 1,-0.3 5,-0.3 0.917 113.8 53.6 -48.0 -54.9 42.2 54.1 63.6 454 129 B T H 3X S+ 0 0 0 -4,-2.9 4,-1.9 1,-0.2 -1,-0.3 0.833 114.6 45.3 -52.6 -31.7 44.4 51.7 61.6 455 130 B L H < S+ 0 0 57 -4,-2.0 3,-0.6 -3,-0.4 -2,-0.2 0.934 114.2 48.5 -76.0 -48.5 52.5 57.9 54.6 463 138 B R H 3< S+ 0 0 192 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.754 133.0 13.0 -65.7 -25.8 52.7 61.6 54.9 464 139 B H T 3< S- 0 0 99 -4,-1.0 -1,-0.2 -5,-0.2 6,-0.2 -0.392 76.8-158.2-152.4 68.2 55.5 61.5 57.5 465 140 B L < + 0 0 88 -3,-0.6 2,-0.3 4,-0.1 -4,-0.1 -0.282 37.9 136.7 -52.4 110.7 57.1 58.1 57.8 466 141 B S > - 0 0 44 -2,-0.2 4,-1.9 1,-0.1 5,-0.3 -0.951 56.0-140.2-159.9 140.0 58.7 58.0 61.3 467 142 B T H > S+ 0 0 52 -2,-0.3 4,-1.6 2,-0.2 -1,-0.1 0.834 109.6 46.3 -70.9 -31.7 58.9 55.5 64.1 468 143 B S H > S+ 0 0 25 2,-0.2 4,-1.6 3,-0.1 -1,-0.2 0.960 111.5 50.2 -73.0 -53.0 58.4 58.3 66.6 469 144 B R H >> S+ 0 0 34 2,-0.2 4,-2.7 1,-0.2 3,-1.4 0.957 114.7 42.6 -47.4 -66.2 55.5 59.9 64.8 470 145 B L H 3X S+ 0 0 1 -4,-1.9 4,-2.4 1,-0.3 -1,-0.2 0.905 114.8 50.4 -49.8 -49.2 53.5 56.7 64.4 471 146 B L H 3X S+ 0 0 9 -4,-1.6 4,-0.9 -5,-0.3 -1,-0.3 0.709 115.4 45.8 -65.5 -18.4 54.3 55.7 67.9 472 147 B L H - 0 0 77 -2,-0.2 4,-2.2 1,-0.1 5,-0.3 -0.919 22.7-141.0-138.9 104.0 29.2 49.5 86.1 497 172 B L H > S+ 0 0 129 -2,-0.4 4,-1.4 1,-0.2 5,-0.1 0.742 104.7 50.2 -36.4 -30.7 32.7 50.3 87.4 498 173 B R H > S+ 0 0 185 2,-0.2 4,-3.3 3,-0.2 5,-0.4 0.977 106.8 48.3 -75.7 -61.4 33.4 46.7 86.8 499 174 B Q H > S+ 0 0 91 1,-0.2 4,-1.4 2,-0.2 -2,-0.2 0.886 113.8 50.8 -45.7 -45.9 32.2 46.2 83.2 500 175 B L H X S+ 0 0 40 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.932 114.2 42.0 -59.2 -50.2 34.2 49.4 82.3 501 176 B X H X S+ 0 0 81 -4,-1.4 4,-2.5 -5,-0.3 -2,-0.2 0.898 110.9 54.5 -67.4 -42.8 37.4 48.2 83.9 502 177 B Y H < S+ 0 0 73 -4,-3.3 -1,-0.2 1,-0.2 129,-0.2 0.804 113.9 44.6 -62.3 -27.1 37.2 44.6 82.6 503 178 B W H >< S+ 0 0 92 -4,-1.4 74,-2.7 -5,-0.4 3,-1.5 0.934 114.6 44.4 -80.7 -50.8 36.8 46.0 79.1 504 179 B X H 3< S+ 0 0 57 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.2 0.811 124.9 37.7 -63.3 -29.2 39.6 48.7 79.3 505 180 B X T 3< S- 0 0 89 -4,-2.5 126,-2.1 -5,-0.2 127,-0.6 0.086 115.2-120.5-110.9 23.1 41.8 46.0 80.9 506 181 B G < + 0 0 0 -3,-1.5 125,-0.8 124,-0.2 124,-0.3 0.641 35.9 179.2 51.6 147.6 40.6 43.0 78.9 507 182 B G - 0 0 21 68,-1.8 3,-0.2 122,-0.3 -1,-0.1 -0.868 35.0-151.4-178.6 142.8 39.0 39.8 80.1 508 183 B F > + 0 0 2 -2,-0.2 3,-1.2 1,-0.2 -120,-0.1 0.168 62.8 118.2-103.1 16.2 37.5 36.5 79.0 509 184 B G T 3 S+ 0 0 51 1,-0.3 2,-0.4 -7,-0.1 -1,-0.2 0.891 76.4 39.2 -49.1 -52.1 35.1 36.3 81.9 510 185 B G T 3 S+ 0 0 64 -3,-0.2 2,-0.7 64,-0.1 -1,-0.3 -0.249 76.8 137.8-100.2 48.6 31.9 36.3 80.0 511 186 B V < + 0 0 12 -3,-1.2 -127,-0.3 -2,-0.4 2,-0.3 -0.824 23.8 164.3 -97.3 114.2 32.7 34.1 77.0 512 187 B D > - 0 0 60 -2,-0.7 3,-1.6 -129,-0.1 4,-0.1 -0.784 55.8 -99.0-123.0 165.7 29.9 31.7 76.1 513 188 B W G > S+ 0 0 64 -134,-0.4 3,-1.4 1,-0.3 4,-0.2 0.621 114.3 79.7 -58.5 -11.9 29.0 29.6 73.1 514 189 B R G 3 S+ 0 0 187 1,-0.3 -1,-0.3 2,-0.1 -75,-0.2 0.323 91.9 49.1 -80.2 10.5 26.6 32.4 72.2 515 190 B Q G X> S+ 0 0 25 -3,-1.6 4,-1.8 -76,-0.1 3,-1.7 0.195 75.6 110.7-126.9 5.5 29.6 34.3 70.9 516 191 B S H <> + 0 0 36 -3,-1.4 4,-2.7 1,-0.3 5,-0.2 0.719 68.8 66.4 -56.4 -23.0 30.8 31.4 68.8 517 192 B W H 3> S+ 0 0 190 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.874 103.8 44.7 -67.7 -34.3 29.8 33.4 65.7 518 193 B L H <> S+ 0 0 5 -3,-1.7 4,-0.6 2,-0.2 -2,-0.2 0.936 110.9 54.0 -71.6 -47.5 32.6 35.9 66.6 519 194 B X H >X S+ 0 0 9 -4,-1.8 3,-1.6 1,-0.2 4,-0.8 0.941 111.0 45.1 -50.7 -53.8 35.0 33.1 67.3 520 195 B L H >< S+ 0 0 104 -4,-2.7 3,-1.8 1,-0.3 -1,-0.2 0.940 103.5 64.5 -56.0 -48.7 34.3 31.5 63.9 521 196 B A H 3< S+ 0 0 37 -4,-2.0 4,-0.5 1,-0.3 -1,-0.3 0.603 99.0 57.1 -51.3 -13.3 34.6 34.9 62.2 522 197 B L H S+ 0 0 70 0, 0.0 4,-2.6 0, 0.0 3,-0.5 0.959 116.3 33.9 -47.5 -70.5 38.9 32.8 58.0 525 200 B V H >>S+ 0 0 2 -4,-0.5 4,-2.2 1,-0.2 5,-0.6 0.936 115.1 58.6 -50.5 -54.7 41.2 35.8 58.2 526 201 B L H X5S+ 0 0 16 -4,-2.3 4,-1.0 1,-0.2 -1,-0.2 0.874 112.7 40.3 -42.1 -48.1 43.5 34.1 60.7 527 202 B L H <5S+ 0 0 116 -4,-2.9 -1,-0.2 -3,-0.5 -2,-0.2 0.895 118.5 47.5 -71.4 -40.9 44.0 31.3 58.2 528 203 B W H >X5S+ 0 0 99 -4,-2.6 3,-3.3 -5,-0.3 4,-0.6 0.996 113.1 43.1 -62.4 -68.6 44.2 33.6 55.1 529 204 B I H ><5S+ 0 0 1 -4,-2.2 3,-0.8 1,-0.3 -1,-0.2 0.792 104.9 67.4 -50.2 -31.0 46.6 36.3 56.4 530 205 B C T 3<> + 0 0 15 -2,-1.2 4,-2.2 2,-0.2 3,-1.0 0.948 60.9 61.2 -64.6 -50.8 54.0 35.6 53.7 534 209 B R H >> S+ 0 0 206 -3,-0.4 4,-2.2 1,-0.3 3,-0.7 0.914 101.1 52.4 -40.3 -65.0 55.4 36.7 50.3 535 210 B P H 3> S+ 0 0 10 0, 0.0 4,-2.4 0, 0.0 -1,-0.3 0.800 113.8 45.1 -44.0 -37.1 53.7 40.1 50.4 536 211 B X H X S+ 0 0 32 -4,-2.2 3,-3.4 1,-0.2 4,-0.8 0.992 112.6 51.8 -54.7 -67.7 58.7 42.1 50.4 539 214 B L H >< S+ 0 0 5 -4,-2.4 3,-0.7 1,-0.3 -1,-0.2 0.808 103.9 61.3 -37.4 -41.0 56.9 44.8 52.4 540 215 B A H 3< S+ 0 0 29 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.732 90.2 66.2 -64.3 -26.3 59.5 44.3 55.1 541 216 B L H << S- 0 0 2 -3,-3.4 -1,-0.2 -4,-0.8 -2,-0.2 0.896 119.0 -96.9 -62.6 -38.6 62.4 45.4 52.8 542 217 B G S+ 0 0 58 1,-0.2 4,-3.1 2,-0.2 -1,-0.2 0.771 125.1 39.4 -23.0 -80.5 58.5 50.8 50.5 544 219 B I H > S+ 0 0 42 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.910 121.0 43.9 -44.6 -58.1 60.8 51.7 47.6 545 220 B S H > S+ 0 0 6 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.933 114.4 51.3 -54.3 -47.5 62.5 48.3 47.5 546 221 B A H <>S+ 0 0 0 -4,-3.5 5,-1.5 -7,-0.2 -1,-0.2 0.886 116.7 41.7 -56.2 -42.3 59.1 46.6 47.9 547 222 B R H >X5S+ 0 0 79 -4,-3.1 3,-4.0 -5,-0.3 4,-0.7 0.997 108.6 52.8 -70.4 -68.2 57.8 48.7 45.0 548 223 B Q H 3<5S+ 0 0 2 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.657 104.4 63.2 -44.8 -16.8 60.7 48.6 42.5 549 224 B L T 3<5S- 0 0 18 -4,-1.1 -1,-0.3 -5,-0.3 -2,-0.2 0.334 125.8 -99.5 -91.1 5.9 60.5 44.8 42.9 550 225 B G T <45 + 0 0 8 -3,-4.0 400,-0.3 1,-0.2 -3,-0.2 0.687 67.9 154.0 87.7 21.2 57.0 44.8 41.5 551 226 B L << - 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