==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 06-JAN-05 1WWK . COMPND 2 MOLECULE: PHOSPHOGLYCERATE DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR M.SUGAHARA,N.KUNISHIMA,RIKEN STRUCTURAL GENOMICS/PROTEOMICS . 606 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26068.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 448 73.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 106 17.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 2 0.3 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 . 55 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 59 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 180 29.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 2.5 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 1 0 5 6 1 3 2 0 2 0 0 0 2 0 1 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 1 6 11 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 PARALLEL BRIDGES PER LADDER . 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 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 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 M 0 0 101 0, 0.0 22,-3.1 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 142.2 69.1 25.4 -15.7 2 2 A K E -a 23 0A 52 39,-0.3 41,-2.3 20,-0.2 42,-1.3 -0.930 360.0-159.5-118.9 140.5 70.8 27.4 -12.9 3 3 A V E -ab 24 44A 0 20,-3.6 22,-2.6 -2,-0.4 2,-0.7 -0.972 13.9-144.7-113.5 126.1 71.0 26.7 -9.2 4 4 A L E -ab 25 45A 0 40,-2.7 42,-3.0 -2,-0.5 2,-0.8 -0.793 8.0-163.7 -89.1 117.0 71.7 29.6 -6.9 5 5 A V E +ab 26 46A 0 20,-3.1 22,-1.7 -2,-0.7 42,-0.1 -0.866 14.0 172.5 -96.1 104.2 73.9 28.7 -3.9 6 6 A A + 0 0 0 40,-2.0 23,-3.4 -2,-0.8 41,-0.1 0.272 60.4 46.5 -99.1 9.9 73.4 31.5 -1.5 7 7 A A S S- 0 0 2 39,-0.4 21,-0.1 21,-0.3 20,-0.1 -0.964 101.9 -70.5-143.1 165.0 75.3 29.9 1.4 8 8 A P - 0 0 51 0, 0.0 2,-0.4 0, 0.0 -2,-0.1 -0.316 55.3-175.4 -54.9 126.9 78.6 28.2 2.0 9 9 A L - 0 0 23 -4,-0.1 279,-0.1 -2,-0.0 5,-0.0 -0.979 26.6-105.2-132.0 144.4 78.5 24.7 0.4 10 10 A H > - 0 0 72 -2,-0.4 4,-2.2 277,-0.2 5,-0.2 -0.199 29.8-117.6 -62.6 155.9 81.0 21.8 0.4 11 11 A E H > S+ 0 0 160 1,-0.2 4,-2.8 2,-0.2 5,-0.1 0.925 114.9 50.5 -59.6 -46.8 83.0 21.0 -2.7 12 12 A K H > S+ 0 0 138 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.855 109.7 51.5 -61.9 -34.8 81.5 17.6 -3.2 13 13 A A H > S+ 0 0 0 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.919 110.9 46.4 -67.9 -41.9 78.0 19.1 -2.9 14 14 A I H X S+ 0 0 22 -4,-2.2 4,-2.1 1,-0.2 3,-0.4 0.912 109.9 57.2 -63.2 -39.9 78.8 21.7 -5.5 15 15 A Q H X S+ 0 0 83 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.812 99.0 57.7 -61.6 -33.1 80.3 18.9 -7.6 16 16 A V H X S+ 0 0 38 -4,-1.4 4,-0.7 2,-0.2 -1,-0.2 0.882 107.8 48.6 -65.1 -37.8 77.0 17.0 -7.5 17 17 A L H ><>S+ 0 0 0 -4,-1.2 5,-1.8 -3,-0.4 3,-0.6 0.947 114.7 43.3 -66.8 -49.6 75.3 20.0 -9.1 18 18 A K H ><5S+ 0 0 117 -4,-2.1 3,-2.5 1,-0.2 -2,-0.2 0.900 106.7 58.9 -65.7 -41.9 77.9 20.4 -11.8 19 19 A D H 3<5S+ 0 0 129 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.766 103.8 55.7 -59.4 -21.9 78.2 16.7 -12.6 20 20 A A T <<5S- 0 0 25 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.533 121.3-112.3 -86.1 -6.9 74.5 16.9 -13.4 21 21 A G T < 5 + 0 0 56 -3,-2.5 2,-0.2 1,-0.3 -3,-0.2 0.622 67.7 144.7 87.0 13.3 75.2 19.7 -15.9 22 22 A L < - 0 0 8 -5,-1.8 2,-0.4 1,-0.0 -1,-0.3 -0.573 52.1-118.7 -85.9 148.1 73.5 22.5 -13.9 23 23 A E E -a 2 0A 103 -22,-3.1 -20,-3.6 -2,-0.2 2,-0.5 -0.705 28.5-148.9 -83.7 136.4 74.8 26.0 -13.8 24 24 A V E -a 3 0A 30 -2,-0.4 2,-0.6 -22,-0.2 -20,-0.2 -0.941 12.4-167.5-115.3 122.4 75.9 27.2 -10.4 25 25 A I E -a 4 0A 52 -22,-2.6 -20,-3.1 -2,-0.5 2,-0.7 -0.920 14.8-165.4-101.8 116.4 75.6 30.8 -9.2 26 26 A Y E +a 5 0A 104 -2,-0.6 2,-0.3 -22,-0.2 -20,-0.2 -0.818 30.5 133.5-119.9 103.9 77.5 31.1 -5.9 27 27 A E - 0 0 71 -22,-1.7 -2,-0.0 -2,-0.7 -23,-0.0 -0.796 41.9-140.7-144.3 99.7 77.2 34.2 -3.6 28 28 A E S S- 0 0 93 -2,-0.3 -21,-0.3 1,-0.2 -22,-0.1 -0.228 70.5 -4.4 -66.8 146.8 76.7 33.6 0.1 29 29 A Y S S- 0 0 91 -23,-3.4 -1,-0.2 21,-0.2 2,-0.1 0.854 76.8-179.4 43.7 56.3 74.4 35.5 2.4 30 30 A P - 0 0 13 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.469 30.4-108.2 -73.5 153.9 73.1 38.1 -0.1 31 31 A D > - 0 0 96 -2,-0.1 4,-3.1 1,-0.1 5,-0.2 -0.319 36.5 -97.8 -78.0 171.3 70.6 40.7 1.1 32 32 A E H > S+ 0 0 82 1,-0.2 4,-3.3 2,-0.2 5,-0.3 0.952 122.8 52.0 -58.0 -48.0 67.1 40.5 0.1 33 33 A D H > S+ 0 0 98 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.934 115.2 41.7 -50.8 -50.4 67.4 43.1 -2.7 34 34 A R H > S+ 0 0 109 1,-0.2 4,-0.9 2,-0.2 3,-0.3 0.886 113.5 53.6 -65.4 -40.0 70.4 41.3 -4.2 35 35 A L H >X S+ 0 0 2 -4,-3.1 4,-1.5 1,-0.2 3,-1.3 0.945 103.6 55.2 -59.3 -48.9 68.7 37.9 -3.7 36 36 A V H 3< S+ 0 0 18 -4,-3.3 4,-0.3 1,-0.3 -1,-0.2 0.820 109.8 48.7 -52.9 -30.9 65.6 39.0 -5.6 37 37 A E H 3< S+ 0 0 109 -4,-1.0 -1,-0.3 -5,-0.3 -2,-0.2 0.679 110.3 50.7 -83.5 -18.7 67.9 39.9 -8.5 38 38 A L H << S+ 0 0 23 -3,-1.3 3,-0.3 -4,-0.9 -2,-0.2 0.657 105.5 54.4 -91.7 -18.1 69.7 36.5 -8.4 39 39 A V S >< S+ 0 0 0 -4,-1.5 3,-1.2 1,-0.2 24,-0.4 0.478 77.4 95.7 -96.5 -3.5 66.7 34.3 -8.4 40 40 A K T 3 S+ 0 0 121 -4,-0.3 23,-0.4 1,-0.3 -1,-0.2 0.863 99.3 25.1 -56.2 -36.5 65.0 35.7 -11.5 41 41 A D T 3 S+ 0 0 46 -3,-0.3 2,-0.4 -4,-0.2 -39,-0.3 0.070 98.9 108.4-121.0 24.3 66.5 33.0 -13.8 42 42 A V < - 0 0 3 -3,-1.2 21,-0.3 1,-0.1 -39,-0.2 -0.826 50.2-159.2-108.4 146.9 67.2 30.1 -11.4 43 43 A E S S+ 0 0 21 -41,-2.3 22,-3.4 -2,-0.4 23,-1.3 0.611 81.1 19.4 -90.6 -17.5 65.3 26.8 -11.2 44 44 A A E -bc 3 66A 0 -42,-1.3 -40,-2.7 20,-0.2 2,-0.4 -0.995 59.1-153.4-152.9 156.0 66.5 26.2 -7.6 45 45 A I E -bc 4 67A 0 21,-1.8 23,-3.4 -2,-0.3 2,-0.5 -0.997 7.3-161.5-132.4 133.7 68.0 27.8 -4.5 46 46 A I E +bc 5 68A 2 -42,-3.0 -40,-2.0 -2,-0.4 -39,-0.4 -0.955 21.4 160.7-116.1 125.6 70.1 26.3 -1.8 47 47 A V E - c 0 69A 0 21,-3.2 23,-3.3 -2,-0.5 -40,-0.1 -0.891 28.0-147.4-133.2 164.2 70.5 27.9 1.6 48 48 A R S S- 0 0 29 2,-2.0 28,-0.1 -2,-0.3 -1,-0.1 0.121 77.2 -42.3 -97.2-136.1 71.5 27.2 5.2 49 49 A S S S+ 0 0 66 21,-0.1 22,-0.0 1,-0.1 20,-0.0 0.723 122.7 79.8 -65.8 -18.8 69.9 28.9 8.2 50 50 A K + 0 0 96 2,-0.1 -2,-2.0 27,-0.0 2,-0.2 -0.957 52.5 46.3-145.3 167.0 70.3 31.9 5.9 51 51 A P S S- 0 0 12 0, 0.0 2,-0.5 0, 0.0 -20,-0.1 0.507 78.1-114.1 -78.0-178.3 69.7 33.8 3.9 52 52 A K - 0 0 131 -2,-0.2 2,-1.3 1,-0.1 25,-0.2 -0.697 17.5-151.7 -83.3 121.5 66.0 34.4 4.3 53 53 A V B -e 77 0B 0 23,-2.7 25,-2.5 -2,-0.5 -1,-0.1 -0.696 29.4-178.2 -92.4 86.5 63.8 33.1 1.4 54 54 A T > - 0 0 34 -2,-1.3 4,-2.2 23,-0.2 5,-0.2 -0.167 42.5-103.1 -81.2 173.9 60.9 35.5 1.7 55 55 A R H > S+ 0 0 76 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.905 122.0 57.2 -60.8 -42.5 57.7 35.8 -0.3 56 56 A R H 4 S+ 0 0 100 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.910 108.3 47.4 -54.4 -42.9 59.1 38.7 -2.2 57 57 A V H >4 S+ 0 0 0 1,-0.2 3,-0.8 2,-0.2 -1,-0.2 0.923 114.2 46.0 -64.1 -45.0 62.1 36.6 -3.2 58 58 A I H >< S+ 0 0 3 -4,-2.2 3,-2.1 1,-0.2 -2,-0.2 0.917 107.7 55.0 -65.8 -44.3 59.9 33.7 -4.3 59 59 A E T 3< S+ 0 0 104 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.588 105.9 56.6 -66.8 -6.7 57.4 35.8 -6.2 60 60 A S T < S+ 0 0 40 -3,-0.8 -1,-0.3 -4,-0.3 -2,-0.2 0.306 89.3 81.5-104.4 6.6 60.4 37.1 -8.2 61 61 A A X + 0 0 9 -3,-2.1 3,-0.8 1,-0.1 -21,-0.2 -0.775 50.0 174.8-117.8 88.6 61.5 33.7 -9.3 62 62 A P T 3 S+ 0 0 114 0, 0.0 -1,-0.1 0, 0.0 -21,-0.1 0.746 83.3 40.9 -63.0 -26.5 59.5 32.6 -12.3 63 63 A K T 3 S+ 0 0 103 -23,-0.4 -22,-0.1 -24,-0.4 -23,-0.1 0.518 80.5 134.8-101.1 -7.2 61.5 29.4 -12.9 64 64 A L < + 0 0 15 -3,-0.8 -20,-0.2 -25,-0.2 -21,-0.2 -0.156 17.6 163.9 -53.0 125.1 61.9 28.4 -9.3 65 65 A K + 0 0 79 -22,-3.4 23,-2.1 1,-0.4 2,-0.3 0.710 62.4 13.0-108.8 -35.7 61.2 24.7 -8.9 66 66 A V E -cd 44 88A 0 -23,-1.3 -21,-1.8 21,-0.2 2,-0.5 -1.000 51.4-152.4-149.5 145.9 62.7 23.9 -5.5 67 67 A I E -cd 45 89A 0 21,-3.0 23,-2.6 -2,-0.3 2,-0.4 -0.982 25.2-163.5-116.0 122.7 64.0 25.6 -2.4 68 68 A A E -cd 46 90A 0 -23,-3.4 -21,-3.2 -2,-0.5 2,-0.5 -0.933 12.2-160.5-118.5 135.5 66.6 23.6 -0.5 69 69 A R E -c 47 0A 26 21,-2.6 2,-2.1 -2,-0.4 23,-0.4 -0.940 16.8-141.8-112.3 117.9 67.9 23.9 3.0 70 70 A A S S+ 0 0 1 -23,-3.3 2,-0.3 -2,-0.5 221,-0.2 -0.525 79.9 6.7 -79.8 78.0 71.2 22.3 3.8 71 71 A G S S- 0 0 12 -2,-2.1 21,-2.7 219,-0.3 2,-0.4 -0.999 104.5 -30.6 152.1-149.2 70.2 21.2 7.3 72 72 A V S S+ 0 0 84 -2,-0.3 -2,-0.1 19,-0.2 218,-0.0 -0.849 90.8 20.0-113.3 144.7 67.2 21.0 9.6 73 73 A G - 0 0 24 -2,-0.4 3,-0.1 1,-0.1 19,-0.1 0.260 54.1-132.5 86.7 148.6 64.2 23.3 9.8 74 74 A L > + 0 0 55 1,-0.1 3,-1.7 3,-0.1 5,-0.3 -0.110 59.2 128.0-127.6 35.8 62.7 25.8 7.4 75 75 A D T 3 S+ 0 0 123 1,-0.3 -1,-0.1 3,-0.1 -2,-0.1 0.749 76.0 52.8 -64.1 -23.1 62.2 28.8 9.7 76 76 A N T 3 S+ 0 0 5 -28,-0.1 -23,-2.7 -3,-0.1 2,-0.5 0.384 99.2 78.7 -94.0 7.0 64.0 31.0 7.2 77 77 A I B < S-e 53 0B 9 -3,-1.7 2,-2.1 -25,-0.2 -23,-0.2 -0.953 80.5-129.8-120.1 128.5 61.8 29.9 4.3 78 78 A D > - 0 0 55 -25,-2.5 4,-2.1 -2,-0.5 5,-0.2 -0.544 31.1-179.7 -74.8 85.4 58.3 31.3 3.6 79 79 A V H > S+ 0 0 66 -2,-2.1 4,-2.1 -5,-0.3 -1,-0.2 0.757 75.3 56.5 -59.2 -28.3 56.8 27.8 3.2 80 80 A E H > S+ 0 0 107 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.933 107.0 46.8 -70.8 -46.8 53.4 29.2 2.5 81 81 A A H > S+ 0 0 1 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.920 112.5 51.6 -59.9 -44.5 54.5 31.3 -0.5 82 82 A A H >X>S+ 0 0 0 -4,-2.1 5,-2.6 1,-0.2 4,-0.6 0.956 108.6 50.6 -57.1 -51.7 56.4 28.3 -1.8 83 83 A K H ><5S+ 0 0 155 -4,-2.1 3,-1.0 1,-0.2 -1,-0.2 0.875 105.8 56.8 -54.4 -41.0 53.3 26.1 -1.5 84 84 A E H 3<5S+ 0 0 113 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.874 111.1 42.1 -59.8 -39.5 51.2 28.7 -3.4 85 85 A K H <<5S- 0 0 120 -4,-1.6 -1,-0.3 -3,-0.6 -2,-0.2 0.430 116.3-112.6 -88.3 -0.2 53.6 28.6 -6.4 86 86 A G T <<5 + 0 0 66 -3,-1.0 2,-0.5 -4,-0.6 -3,-0.2 0.800 63.7 155.3 73.5 28.5 53.9 24.9 -6.3 87 87 A I < - 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0 0 64 -5,-2.3 2,-1.0 -6,-0.1 -1,-0.3 -0.846 49.6-154.0-105.3 129.8 93.3 22.4 41.3 127 127 A W + 0 0 43 -2,-0.5 2,-0.9 -3,-0.1 3,-0.5 -0.765 18.2 179.7 -98.6 90.1 93.6 18.6 41.3 128 128 A A > + 0 0 2 -2,-1.0 4,-0.6 -10,-0.3 3,-0.4 -0.187 33.0 129.7 -94.4 45.3 90.0 17.6 42.0 129 129 A K T >4 S+ 0 0 76 -2,-0.9 3,-1.2 1,-0.2 -1,-0.2 0.925 70.5 59.3 -59.1 -43.9 90.4 13.8 42.0 130 130 A K T 34 S+ 0 0 132 -3,-0.5 3,-0.4 1,-0.3 -1,-0.2 0.831 114.0 35.7 -57.0 -33.7 88.5 13.5 45.3 131 131 A E T 34 S+ 0 0 95 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.2 0.382 98.7 79.4-105.4 6.4 85.4 15.2 43.8 132 132 A A << + 0 0 0 -3,-1.2 2,-0.5 -4,-0.6 -1,-0.2 0.121 59.5 136.3 -94.9 20.7 85.6 13.7 40.3 133 133 A M + 0 0 71 -3,-0.4 455,-0.2 1,-0.1 2,-0.1 -0.563 30.8 160.1 -66.5 120.0 84.1 10.5 41.6 134 134 A G B -f 588 0C 5 453,-2.8 455,-1.6 -2,-0.5 2,-0.3 -0.278 32.6 -84.1-123.5-151.5 81.6 9.5 39.0 135 135 A I - 0 0 46 -23,-1.8 2,-0.3 453,-0.2 452,-0.1 -0.948 23.0-122.6-132.2 151.6 79.7 6.5 37.7 136 136 A E - 0 0 6 -2,-0.3 268,-0.1 1,-0.1 453,-0.0 -0.691 17.0-154.9 -87.7 138.8 80.1 3.6 35.3 137 137 A L > + 0 0 0 -2,-0.3 3,-2.3 2,-0.1 -1,-0.1 0.724 57.9 108.2 -89.8 -28.1 77.5 3.4 32.5 138 138 A E T 3 S+ 0 0 64 1,-0.3 25,-0.2 25,-0.1 24,-0.2 -0.305 91.5 11.8 -56.9 128.9 77.6 -0.3 31.7 139 139 A G T 3 S+ 0 0 55 23,-1.8 -1,-0.3 1,-0.3 24,-0.2 0.329 98.5 127.8 90.2 -11.0 74.3 -1.9 32.9 140 140 A K < - 0 0 37 -3,-2.3 24,-2.8 1,-0.1 2,-0.5 -0.381 61.5-115.4 -76.3 159.8 72.6 1.4 33.5 141 141 A T E -g 164 0D 18 22,-0.2 54,-3.2 52,-0.2 55,-1.5 -0.853 24.3-163.2-101.0 127.5 69.2 2.2 32.1 142 142 A I E -gh 165 196D 4 22,-3.2 24,-2.9 -2,-0.5 2,-0.7 -0.924 7.8-150.2-109.5 130.8 68.9 5.0 29.6 143 143 A G E -gh 166 197D 0 53,-4.1 55,-2.6 -2,-0.5 2,-0.7 -0.901 8.3-160.6-103.6 114.9 65.4 6.4 28.9 144 144 A I E -gh 167 198D 0 22,-3.9 24,-2.1 -2,-0.7 2,-0.8 -0.854 1.6-164.5 -99.7 112.2 65.0 7.7 25.4 145 145 A I E S+gh 168 199D 1 53,-2.3 55,-3.2 -2,-0.7 24,-0.1 -0.847 74.2 28.5 -97.1 106.7 62.0 10.1 25.0 146 146 A G - 0 0 6 22,-1.3 2,-1.1 -2,-0.8 -1,-0.2 0.648 69.7-155.3 105.2 91.2 61.4 10.5 21.3 147 147 A F + 0 0 3 4,-0.1 26,-0.2 21,-0.1 -1,-0.1 -0.594 52.3 111.4 -98.8 71.0 62.3 7.4 19.3 148 148 A G S > S- 0 0 27 -2,-1.1 4,-2.3 52,-0.3 5,-0.2 -0.025 86.6 -43.6-114.3-141.2 62.9 8.9 15.9 149 149 A R H > S+ 0 0 146 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.960 140.2 31.6 -59.9 -54.1 66.0 9.5 13.8 150 150 A I H > S+ 0 0 46 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.913 117.1 55.9 -73.1 -41.5 68.2 10.7 16.5 151 151 A G H > S+ 0 0 0 49,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.907 106.7 52.6 -56.4 -41.3 66.6 8.6 19.3 152 152 A Y H X S+ 0 0 39 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.954 108.4 49.2 -59.6 -49.1 67.3 5.6 17.2 153 153 A Q H X S+ 0 0 33 -4,-1.6 4,-2.1 1,-0.2 -1,-0.2 0.896 110.1 51.4 -59.8 -40.1 71.0 6.5 16.8 154 154 A V H X S+ 0 0 2 -4,-2.6 4,-3.2 1,-0.2 -1,-0.2 0.918 108.5 51.3 -62.9 -42.2 71.3 7.0 20.5 155 155 A A H X S+ 0 0 0 -4,-2.3 4,-2.7 -5,-0.2 5,-0.2 0.907 106.6 55.1 -58.9 -41.4 69.8 3.6 21.2 156 156 A K H X S+ 0 0 89 -4,-2.4 4,-1.1 1,-0.2 -1,-0.2 0.935 113.1 41.4 -54.5 -46.8 72.3 2.1 18.8 157 157 A I H X S+ 0 0 0 -4,-2.1 4,-1.4 2,-0.2 -2,-0.2 0.868 111.1 55.6 -71.8 -38.0 75.1 3.7 20.9 158 158 A A H ><>S+ 0 0 2 -4,-3.2 5,-2.2 1,-0.2 3,-0.8 0.949 106.3 51.1 -57.1 -45.9 73.5 2.8 24.2 159 159 A N H ><5S+ 0 0 73 -4,-2.7 3,-1.0 1,-0.3 -1,-0.2 0.845 106.4 57.0 -58.8 -31.8 73.4 -0.8 23.1 160 160 A A H 3<5S+ 0 0 10 -4,-1.1 -1,-0.3 1,-0.3 -2,-0.2 0.809 106.3 49.0 -69.1 -29.4 77.1 -0.4 22.3 161 161 A L T <<5S- 0 0 1 -4,-1.4 -1,-0.3 -3,-0.8 -22,-0.3 0.364 117.6-112.3 -91.5 3.6 77.7 0.7 25.9 162 162 A G T < 5 + 0 0 40 -3,-1.0 -23,-1.8 -4,-0.3 2,-0.2 0.788 65.1 153.1 71.2 27.3 75.8 -2.2 27.3 163 163 A M < - 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